A0A087YN89_POEFO Loading...

ADP/ATP translocase

ADP:ATP antiporter that mediates import of ADP into the mitochondrial matrix for ATP synthesis, and export of ATP out to fuel the cell. Cycles between the cytoplasmic-open state (c-state) and the matrix-open state (m-state): operates by the alternating access mechanism with a single substrate-binding site intermittently exposed to either the cytosolic (c-state) or matrix (m-state) side of the inner mitochondrial membrane. Catalyzes the exchange of ADP and ATP across the membrane.

AlphaFold DB (A0A3B3V417), UniProt , Accession A0A087YN89, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 298 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
1M57.7Low82.1Confident178 Ų178103.7 Ų103.788%0.87754%0.543SS*.  0135.10-74169.662.400107.5A5 I6M1-A5 HydrophobicContact CB-CB 4.45Å; M1-A5 HydrophobicContact CE-CB 4.32Å; M1-I6 HydrophobicContact CB-CD1 4.23Å; M1-I6 HydrophobicContact CB-CG1 3.89Å; M1-I6 HydrophobicContact CE-CG1 4.1Å
2S82.1Confident82.3Confident73 Ų7399.6 Ų99.651%0.5152%0.518SS..  trans-62.3151.9175.359.50000110.6Q4 A5 I6S2-Q4 PolarHBondContact O-N 3.43Å; S2-Q4 VanDerWaalsContact O-N 3.16Å; S2-A5 WeakPolarHBondContact O-CB 3.49Å; S2-A5 PolarHBondContact O-N 2.92Å; S2-A5 PolarHBondContact OG-N 2.96Å; S2-I6 PolarHBondContact O-N 3.31Å; S2-I6 VanDerWaalsContact O-N 3.12Å
3E82.9Confident82.9Confident175 Ų17599.2 Ų99.282%0.81852%0.516SS*.Hα-helixtrans-53.7-36.2177.5-71.3-174.8156.100112.2A5 I6 S7E3-A5 PolarHBondContact O-N 2.76Å; E3-I6 PolarHBondContact O-N 2.94Å; E3-S7 PolarHBondContact O-N 3.47Å
4Q81.4Confident83.1Confident164 Ų16494.4 Ų94.477%0.76650%0.498SS*.Hα-helixtrans-62-41.9174.5-69178.4-11.600112.7S2 I6 S7 F8S2-Q4 PolarHBondContact O-N 3.43Å; S2-Q4 VanDerWaalsContact O-N 3.16Å; Q4-I6 VanDerWaalsContact C-N 3.33Å; Q4-I6 PolarHBondContact O-N 3.13Å; Q4-S7 PolarHBondContact O-N 3.27Å; Q4-F8 WeakPolarHBondContact O-CB 3.43Å; Q4-F8 PolarHBondContact O-N 2.81Å
5A85.3Confident83.3Confident36 Ų3689.6 Ų89.630%0.29848%0.48SS..Hα-helixtrans-67.3-36177.400000111.7M1 S2 E3 A9M1-A5 HydrophobicContact CB-CB 4.45Å; M1-A5 HydrophobicContact CE-CB 4.32Å; S2-A5 WeakPolarHBondContact O-CB 3.49Å; S2-A5 PolarHBondContact O-N 2.92Å; S2-A5 PolarHBondContact OG-N 2.96Å; E3-A5 PolarHBondContact O-N 2.76Å; A5-A9 WeakPolarHBondContact O-CB 3.44Å; A5-A9 PolarHBondContact O-N 2.85Å
6I86.8Confident83.7Confident71 Ų7184.1 Ų84.136%0.36445%0.451SS..Hα-helixtrans-69.1-45.2176.2-63.9172.6000110.6M1 S2 E3 Q4 A9 K10M1-I6 HydrophobicContact CB-CD1 4.23Å; M1-I6 HydrophobicContact CB-CG1 3.89Å; M1-I6 HydrophobicContact CE-CG1 4.1Å; S2-I6 PolarHBondContact O-N 3.31Å; S2-I6 VanDerWaalsContact O-N 3.12Å; E3-I6 PolarHBondContact O-N 2.94Å; Q4-I6 VanDerWaalsContact C-N 3.33Å; Q4-I6 PolarHBondContact O-N 3.13Å; I6-A9 PolarHBondContact O-N 3.35Å; I6-K10 HydrophobicContact CG2-CD 4.3Å; I6-K10 WeakPolarHBondContact O-CG 3.23Å; I6-K10 PolarHBondContact O-N 3.09Å
7S83.8Confident84.1Confident62 Ų6284.3 Ų84.343%0.43445%0.451SS..Hα-helixtrans-59.4-47.8175.7-167.50000111.2E3 Q4 A9 K10 D11E3-S7 PolarHBondContact O-N 3.47Å; Q4-S7 PolarHBondContact O-N 3.27Å; S7-A9 VanDerWaalsContact C-N 3.35Å; S7-A9 PolarHBondContact O-N 3.34Å; S7-K10 WeakPolarHBondContact O-CB 3.45Å; S7-K10 PolarHBondContact O-N 3.12Å; S7-D11 PolarHBondContact O-N 3.43Å
8F85.2Confident84.3Confident96 Ų9680.4 Ų80.442%0.42143%0.432SS..Hα-helixtrans-58.3-45.8176.5174.8-95.5000112.1Q4 K10 D11 F12 F89Q4-F8 WeakPolarHBondContact O-CB 3.43Å; Q4-F8 PolarHBondContact O-N 2.81Å; F8-K10 VanDerWaalsContact C-N 3.33Å; F8-K10 PolarHBondContact O-N 3.29Å; F8-D11 PolarHBondContact O-N 2.93Å; F8-F12 HydrophobicContact CE1-CB 4.49Å; F8-F12 VanDerWaalsContact O-CB 3.23Å; F8-F12 WeakPolarHBondContact O-CB 3.43Å; F8-F12 PolarHBondContact O-N 3.33Å; F8-F89 AromaticContact CE2-CD2 3.94Å; F8-F89 HydrophobicContact CE2-CD2 3.94Å; F8-F89 AromaticContact CE2-CE2 3.86Å; F8-F89 HydrophobicContact CE2-CE2 3.86Å; F8-F89 HydrophobicContact CE2-CG 4.39Å; F8-F89 HydrophobicContact CE2-CZ 4.24Å; F8-F89 HydrophobicContact CZ-CD2 4.44Å; F8-F89 HydrophobicContact CZ-CG 4.45Å
9A87.3Confident84.5Confident35 Ų3577.1 Ų77.129%0.28942%0.416SS..Hα-helixtrans-61.9-41.2178.400000111.8A5 I6 S7 L13A5-A9 WeakPolarHBondContact O-CB 3.44Å; A5-A9 PolarHBondContact O-N 2.85Å; I6-A9 PolarHBondContact O-N 3.35Å; S7-A9 VanDerWaalsContact C-N 3.35Å; S7-A9 PolarHBondContact O-N 3.34Å; A9-L13 WeakPolarHBondContact O-CB 3.35Å; A9-L13 VanDerWaalsContact O-CG 3.24Å; A9-L13 WeakPolarHBondContact O-CG 3.35Å; A9-L13 PolarHBondContact O-N 2.81Å
10K86.6Confident84.9Confident142 Ų14274.3 Ų74.362%0.61740%0.404SS*.Hα-helixtrans-61.3-48.1175.5-74.4176.6178.2-178.60111.6I6 S7 F8 L13 A14I6-K10 HydrophobicContact CG2-CD 4.3Å; I6-K10 WeakPolarHBondContact O-CG 3.23Å; I6-K10 PolarHBondContact O-N 3.09Å; S7-K10 WeakPolarHBondContact O-CB 3.45Å; S7-K10 PolarHBondContact O-N 3.12Å; F8-K10 VanDerWaalsContact C-N 3.33Å; F8-K10 PolarHBondContact O-N 3.29Å; K10-L13 PolarHBondContact O-N 3.38Å; K10-A14 VanDerWaalsContact O-CB 3.22Å; K10-A14 WeakPolarHBondContact O-CB 3.4Å; K10-A14 PolarHBondContact O-N 3.11Å
11D83.6Confident85.2Confident109 Ų10974.2 Ų74.258%0.58340%0.402SS*.Hα-helixtrans-66.1-40.7-179.8-66.8-27.2000112S7 F8 A14 G15S7-D11 PolarHBondContact O-N 3.43Å; F8-D11 PolarHBondContact O-N 2.93Å; D11-A14 PolarHBondContact O-N 3.35Å; D11-G15 PolarHBondContact O-N 3.41Å
12F85.3Confident86.8Confident54 Ų5466.1 Ų66.124%0.23736%0.363CS..Hα-helixtrans-62.4-45.6176.9-177.9-102.5000111.9F8 G16 F82 Q85F8-F12 HydrophobicContact CE1-CB 4.49Å; F8-F12 VanDerWaalsContact O-CB 3.23Å; F8-F12 WeakPolarHBondContact O-CB 3.43Å; F8-F12 PolarHBondContact O-N 3.33Å; F12-G16 PolarHBondContact O-N 3.38Å; F12-F82 HydrophobicContact CD1-CD1 4.29Å; F12-F82 HydrophobicContact CE1-CB 4.49Å; F12-F82 AromaticContact CE1-CD1 3.53Å; F12-F82 HydrophobicContact CE1-CD1 3.53Å; F12-F82 HydrophobicContact CE1-CE1 4.27Å; F12-F82 HydrophobicContact CE1-CG 4.48Å; F12-F82 HydrophobicContact CZ-CB 4.08Å; F12-F82 AromaticContact CZ-CD1 3.79Å; F12-F82 HydrophobicContact CZ-CD1 3.79Å; F12-F82 HydrophobicContact CZ-CG 4.45Å; F12-Q85 HydrophobicContact CD2-CB 4.29Å; F12-Q85 HydrophobicContact CE2-CB 3.67Å
13L89.4Confident87.2Confident95 Ų9565.2 Ų65.250%0.49735%0.35SS..Hα-helixtrans-68.2-44.7176.9-71.8172.9000111.9A9 K10 G15 G16 I17A9-L13 WeakPolarHBondContact O-CB 3.35Å; A9-L13 VanDerWaalsContact O-CG 3.24Å; A9-L13 WeakPolarHBondContact O-CG 3.35Å; A9-L13 PolarHBondContact O-N 2.81Å; K10-L13 PolarHBondContact O-N 3.38Å; L13-G15 VanDerWaalsContact C-N 3.35Å; L13-G15 PolarHBondContact O-N 3.4Å; L13-G16 WeakPolarHBondContact O-CA 2.95Å; L13-G16 PolarHBondContact O-N 2.75Å; L13-G16 VanDerWaalsContact O-N 3.09Å; L13-I17 WeakPolarHBondContact O-CG1 3.38Å; L13-I17 PolarHBondContact O-N 2.95Å
14A86.2Confident87.8Confident32 Ų3259.1 Ų59.126%0.26433%0.325SS..Hα-helixtrans-60.6-44.8178.100000111.5K10 D11 G16 I17 S18K10-A14 VanDerWaalsContact O-CB 3.22Å; K10-A14 WeakPolarHBondContact O-CB 3.4Å; K10-A14 PolarHBondContact O-N 3.11Å; D11-A14 PolarHBondContact O-N 3.35Å; A14-G16 VanDerWaalsContact C-N 3.3Å; A14-G16 PolarHBondContact O-N 3.15Å; A14-I17 PolarHBondContact O-N 3.31Å; A14-S18 WeakPolarHBondContact O-CB 3.4Å; A14-S18 PolarHBondContact O-N 3.45Å
15G86.4Confident88.5Confident22 Ų2254 Ų5423%0.22731%0.31CS..Hα-helixtrans-62.2-37.9173.500000112.4D11 L13 A19 Y81D11-G15 PolarHBondContact O-N 3.41Å; L13-G15 VanDerWaalsContact C-N 3.35Å; L13-G15 PolarHBondContact O-N 3.4Å; G15-A19 VanDerWaalsContact O-CB 3.23Å; G15-A19 WeakPolarHBondContact O-CB 3.43Å; G15-A19 PolarHBondContact O-N 3.4Å; G15-Y81 VanDerWaalsContact C-OH 3.26Å; G15-Y81 WeakPolarHBondContact CA-OH 3.18Å; G15-Y81 PolarHBondContact O-OH 3.4Å
16G89.4Confident88.9Confident1 Ų152.7 Ų52.71%0.0130%0.299CS..Hα-helixtrans-65-44.517600000113.8F12 L13 A14 A19 A20F12-G16 PolarHBondContact O-N 3.38Å; L13-G16 WeakPolarHBondContact O-CA 2.95Å; L13-G16 PolarHBondContact O-N 2.75Å; L13-G16 VanDerWaalsContact O-N 3.09Å; A14-G16 VanDerWaalsContact C-N 3.3Å; A14-G16 PolarHBondContact O-N 3.15Å; G16-A19 PolarHBondContact O-N 3.08Å; G16-A20 WeakPolarHBondContact O-CB 3.45Å; G16-A20 PolarHBondContact O-N 2.89Å
17I90.1Very high89.4Confident88 Ų8849.6 Ų49.645%0.45128%0.284SS..Hα-helixtrans-65.3-48.1176.9-67.8165.7000110.3L13 A14 A19 A20 I21L13-I17 WeakPolarHBondContact O-CG1 3.38Å; L13-I17 PolarHBondContact O-N 2.95Å; A14-I17 PolarHBondContact O-N 3.31Å; I17-A19 VanDerWaalsContact C-N 3.31Å; I17-A19 PolarHBondContact O-N 3.46Å; I17-A20 WeakPolarHBondContact O-CB 3.41Å; I17-A20 PolarHBondContact O-N 2.93Å; I17-A20 VanDerWaalsContact O-N 3.1Å; I17-I21 HydrophobicContact CG2-CD1 3.82Å; I17-I21 HydrophobicContact CG2-CG1 4.47Å; I17-I21 WeakPolarHBondContact O-CG1 3.38Å; I17-I21 PolarHBondContact O-N 3.1Å
18S88Confident90Very high15 Ų1548 Ų4811%0.10527%0.272CS..Hα-helixtrans-58.5-44177.3179.60000111.6A14 A20 I21 S22 L288A14-S18 WeakPolarHBondContact O-CB 3.4Å; A14-S18 PolarHBondContact O-N 3.45Å; S18-A20 PolarHBondContact O-N 2.95Å; S18-I21 PolarHBondContact O-N 3.18Å; S18-S22 WeakPolarHBondContact O-CB 3.37Å; S18-S22 PolarHBondContact O-N 2.95Å; S18-L288 WeakPolarHBondContact OG-CD2 3.31Å
19A88.4Confident90.5Very high17 Ų1745.1 Ų45.114%0.1426%0.261CS..Hα-helixtrans-63.6-41.8174.200000112.5G15 G16 I17 K23 Y81G15-A19 VanDerWaalsContact O-CB 3.23Å; G15-A19 WeakPolarHBondContact O-CB 3.43Å; G15-A19 PolarHBondContact O-N 3.4Å; G16-A19 PolarHBondContact O-N 3.08Å; I17-A19 VanDerWaalsContact C-N 3.31Å; I17-A19 PolarHBondContact O-N 3.46Å; A19-K23 VanDerWaalsContact O-CB 3.31Å; A19-K23 WeakPolarHBondContact O-CB 3.18Å; A19-K23 WeakPolarHBondContact O-CG 3.17Å; A19-K23 PolarHBondContact O-N 3.45Å; A19-Y81 HydrophobicContact CB-CD2 3.25Å; A19-Y81 HydrophobicContact CB-CE2 3.51Å; A19-Y81 HydrophobicContact CB-CG 3.82Å
20A91.8Very high91Very high20 Ų2043.9 Ų43.917%0.16525%0.249CC..Hα-helixtrans-61.6-44.2177.900000111.8G16 I17 S18 T24 V78G16-A20 WeakPolarHBondContact O-CB 3.45Å; G16-A20 PolarHBondContact O-N 2.89Å; I17-A20 WeakPolarHBondContact O-CB 3.41Å; I17-A20 PolarHBondContact O-N 2.93Å; I17-A20 VanDerWaalsContact O-N 3.1Å; S18-A20 PolarHBondContact O-N 2.95Å; A20-T24 WeakPolarHBondContact O-CB 3.42Å; A20-T24 PolarHBondContact O-N 3.35Å; A20-T24 PolarHBondContact O-OG1 3.32Å; A20-V78 HydrophobicContact CB-CB 4.43Å; A20-V78 HydrophobicContact CB-CG1 3.74Å; A20-V78 HydrophobicContact CB-CG2 4.12Å
21I91.9Very high91.5Very high73 Ų7337.3 Ų37.337%0.37422%0.22SC..Hα-helixtrans-62.8-54.3177.2-67.3167.4000110I17 S18 K23 T24 A25 V287 Y291I17-I21 HydrophobicContact CG2-CD1 3.82Å; I17-I21 HydrophobicContact CG2-CG1 4.47Å; I17-I21 WeakPolarHBondContact O-CG1 3.38Å; I17-I21 PolarHBondContact O-N 3.1Å; S18-I21 PolarHBondContact O-N 3.18Å; I21-K23 VanDerWaalsContact C-N 3.35Å; I21-K23 PolarHBondContact O-N 2.89Å; I21-T24 PolarHBondContact O-N 2.83Å; I21-T24 VanDerWaalsContact O-N 3.14Å; I21-A25 WeakPolarHBondContact O-CB 3.19Å; I21-A25 PolarHBondContact O-N 2.91Å; I21-V287 HydrophobicContact CG2-CG1 4.22Å; I21-Y291 HydrophobicContact CD1-CD2 3.92Å; I21-Y291 HydrophobicContact CD1-CE2 3.56Å
22S90.6Very high92.1Very high8 Ų832.1 Ų32.16%0.05619%0.193CC..Hα-helixtrans-57.1-46.2-179.7174.20000112S18 T24 A25 V26 G284S18-S22 WeakPolarHBondContact O-CB 3.37Å; S18-S22 PolarHBondContact O-N 2.95Å; S22-T24 PolarHBondContact O-N 3.23Å; S22-A25 PolarHBondContact O-N 3.43Å; S22-V26 WeakPolarHBondContact O-CG2 3.15Å; S22-V26 PolarHBondContact O-N 3.43Å; S22-G284 PolarHBondContact OG-O 3.06Å
23K91.4Very high92.7Very high54 Ų5430 Ų3024%0.23518%0.183CC..Hα-helixtrans-65-38.1177.9-68-64.2178.5-160.90112.7A19 I21 A27 N77A19-K23 VanDerWaalsContact O-CB 3.31Å; A19-K23 WeakPolarHBondContact O-CB 3.18Å; A19-K23 WeakPolarHBondContact O-CG 3.17Å; A19-K23 PolarHBondContact O-N 3.45Å; I21-K23 VanDerWaalsContact C-N 3.35Å; I21-K23 PolarHBondContact O-N 2.89Å; K23-A27 WeakPolarHBondContact O-CB 3Å; K23-A27 PolarHBondContact O-N 2.76Å; K23-N77 HydrophobicContact CB-CB 4.11Å; K23-N77 HydrophobicContact CG-CB 4.4Å
24T95.6Very high93Very high48 Ų4825.7 Ų25.729%0.29416%0.161SC..Hα-helixtrans-70.9-38.8179.4-59.20000111.2A20 I21 S22 V26 A27 W71 N74A20-T24 WeakPolarHBondContact O-CB 3.42Å; A20-T24 PolarHBondContact O-N 3.35Å; A20-T24 PolarHBondContact O-OG1 3.32Å; I21-T24 PolarHBondContact O-N 2.83Å; I21-T24 VanDerWaalsContact O-N 3.14Å; S22-T24 PolarHBondContact O-N 3.23Å; T24-V26 VanDerWaalsContact C-N 3.33Å; T24-V26 PolarHBondContact O-N 2.81Å; T24-A27 WeakPolarHBondContact O-CB 3.22Å; T24-A27 PolarHBondContact O-N 3.39Å; T24-W71 PolarHBondContact O-NE1 2.89Å; T24-N74 PolarHBondContact OG1-ND2 3.41Å
25A95Very high93.6Very high55 Ų5524.2 Ų24.246%0.45515%0.148SC..Hα-helixtrans-61.3-40.5176.300000112.2I21 S22 V287I21-A25 WeakPolarHBondContact O-CB 3.19Å; I21-A25 PolarHBondContact O-N 2.91Å; S22-A25 PolarHBondContact O-N 3.43Å; A25-V287 HydrophobicContact CB-CG1 4.14Å; A25-V287 HydrophobicContact CB-CG2 3.85Å
26V94.8Very high94.1Very high9 Ų923.9 Ų23.96%0.05514%0.141CC..THydrogen-bonded Turntrans-94.32.4179.5-54.60000114.6S22 T24 P28 I29 E30 R280S22-V26 WeakPolarHBondContact O-CG2 3.15Å; S22-V26 PolarHBondContact O-N 3.43Å; T24-V26 VanDerWaalsContact C-N 3.33Å; T24-V26 PolarHBondContact O-N 2.81Å; V26-P28 VanDerWaalsContact C-CD 3.43Å; V26-P28 VanDerWaalsContact C-N 3.34Å; V26-I29 HydrophobicContact CB-CG2 4.04Å; V26-I29 WeakPolarHBondContact O-CG2 3.27Å; V26-I29 PolarHBondContact O-N 3Å; V26-E30 WeakPolarHBondContact O-CB 3.37Å; V26-E30 PolarHBondContact O-N 3.24Å; V26-R280 HydrophobicContact CB-CG 4.15Å; V26-R280 HydrophobicContact CG2-CG 3.9Å
27A95.9Very high94.4Very high6 Ų623.9 Ų23.95%0.0514%0.141CC..Hα-helixtrans-56.6-39178.900000113.5K23 T24 E30 R31 W71 N74K23-A27 WeakPolarHBondContact O-CB 3Å; K23-A27 PolarHBondContact O-N 2.76Å; T24-A27 WeakPolarHBondContact O-CB 3.22Å; T24-A27 PolarHBondContact O-N 3.39Å; A27-E30 PolarHBondContact O-N 3.46Å; A27-R31 WeakPolarHBondContact O-CB 3.44Å; A27-R31 PolarHBondContact O-N 2.67Å; A27-W71 HydrophobicContact CB-CG 4.28Å; A27-N74 HydrophobicContact CB-CB 4.2Å
28P97.3Very high94.7Very high28 Ų2819.7 Ų19.718%0.18212%0.12CC..Hα-helixtrans-58.8-51.8176.8-25.535000113.5V26 E30 R31 V32 F70 W71V26-P28 VanDerWaalsContact C-CD 3.43Å; V26-P28 VanDerWaalsContact C-N 3.34Å; P28-E30 VanDerWaalsContact C-N 3.28Å; P28-E30 PolarHBondContact O-N 3.29Å; P28-R31 PolarHBondContact O-N 3.23Å; P28-V32 WeakPolarHBondContact O-CG2 3.33Å; P28-V32 PolarHBondContact O-N 2.92Å; P28-V32 VanDerWaalsContact O-N 3.1Å; P28-F70 HydrophobicContact CB-CB 3.84Å; P28-F70 HydrophobicContact CB-CD1 3.82Å; P28-F70 HydrophobicContact CB-CG 3.85Å; P28-F70 HydrophobicContact CG-CB 3.97Å; P28-F70 HydrophobicContact CG-CG 4.4Å; P28-W71 HydrophobicContact CG-CH2 3.94Å; P28-W71 HydrophobicContact CG-CZ2 3.61Å
29I96.4Very high95Very high36 Ų3619.6 Ų19.619%0.18512%0.117CC..Hα-helixtrans-68.8-30.6179.4-172.260000111.7V26 V32 K33 I54 L279 R280V26-I29 HydrophobicContact CB-CG2 4.04Å; V26-I29 WeakPolarHBondContact O-CG2 3.27Å; V26-I29 PolarHBondContact O-N 3Å; I29-V32 HydrophobicContact CD1-CB 4.4Å; I29-V32 PolarHBondContact O-N 2.88Å; I29-K33 PolarHBondContact O-N 3.02Å; I29-I54 HydrophobicContact CD1-CG2 4.05Å; I29-L279 HydrophobicContact CD1-CD1 4.49Å; I29-L279 HydrophobicContact CG1-CB 4.25Å; I29-R280 HydrophobicContact CG2-CB 3.97Å; I29-R280 HydrophobicContact CG2-CG 4.32Å
30E96Very high95.2Very high9 Ų922.1 Ų22.14%0.04213%0.126CC..Hα-helixtrans-68.5-36.3174-172.8152.1-160.800112.8V26 A27 P28 K33 L34 R138 R280V26-E30 WeakPolarHBondContact O-CB 3.37Å; V26-E30 PolarHBondContact O-N 3.24Å; A27-E30 PolarHBondContact O-N 3.46Å; P28-E30 VanDerWaalsContact C-N 3.28Å; P28-E30 PolarHBondContact O-N 3.29Å; E30-K33 WeakPolarHBondContact O-CB 3.29Å; E30-K33 PolarHBondContact O-N 3.11Å; E30-L34 HydrophobicContact CG-CD1 4.46Å; E30-L34 WeakPolarHBondContact O-CG 3.39Å; E30-L34 PolarHBondContact O-N 3.47Å; E30-R138 IonicContact OE1-CZ 3.32Å; E30-R138 IonicContact OE1-NE 2.63Å; E30-R138 IonicContact OE1-NH1 3.61Å; E30-R138 PolarHBondContact OE1-NH1 2.89Å; E30-R138 IonicContact OE1-NH2 2.72Å; E30-R138 PolarHBondContact OE1-NH2 3.32Å; E30-R138 IonicContact OE2-CZ 2.67Å; E30-R138 IonicContact OE2-NH1 3.72Å; E30-R138 IonicContact OE2-NH2 2.64Å; E30-R138 PolarHBondContact OE2-NH2 2.91Å; E30-R280 HydrophobicContact CB-CG 4Å; E30-R280 HydrophobicContact CG-CG 4.43Å; E30-R280 WeakPolarHBondContact OE1-CD 3.37Å; E30-R280 WeakPolarHBondContact OE2-CD 3.41Å
31R97.3Very high95.2Very high4 Ų421.1 Ų21.12%0.01512%0.118CC..Hα-helixtrans-65.3-43.5172.8-171.7177-177.7-127.2-5.7111.1A27 P28 K33 L34 L35 Q65 S69 F70 A142 D144A27-R31 WeakPolarHBondContact O-CB 3.44Å; A27-R31 PolarHBondContact O-N 2.67Å; P28-R31 PolarHBondContact O-N 3.23Å; R31-K33 VanDerWaalsContact C-N 3.32Å; R31-K33 PolarHBondContact O-N 3.14Å; R31-L34 PolarHBondContact O-N 3.35Å; R31-L35 HydrophobicContact CG-CD1 4.1Å; R31-L35 HydrophobicContact CG-CG 4.48Å; R31-L35 WeakPolarHBondContact O-CG 3.27Å; R31-L35 PolarHBondContact O-N 3.46Å; R31-Q65 VanDerWaalsContact CZ-OE1 3.28Å; R31-S69 WeakPolarHBondContact CD-O 3.34Å; R31-S69 PolarHBondContact NE-O 3.45Å; R31-S69 VanDerWaalsContact NE-O 3.12Å; R31-S69 VanDerWaalsContact NH1-C 3.27Å; R31-S69 PolarHBondContact NH1-O 3.1Å; R31-S69 PolarHBondContact NH1-OG 2.74Å; R31-F70 WeakPolarHBondContact CD-O 3.22Å; R31-A142 HydrophobicContact CG-CB 4.37Å; R31-A142 PolarHBondContact NE-O 3.44Å; R31-D144 PolarHBondContact NH2-O 3.11Å
32V97.3Very high95.2Very high1 Ų118.5 Ų18.51%0.00611%0.106CC..Hα-helixtrans-58.1-45.4174.1172.70000111P28 I29 L34 L35 L36 I54 C57 V58 I61 F70P28-V32 WeakPolarHBondContact O-CG2 3.33Å; P28-V32 PolarHBondContact O-N 2.92Å; P28-V32 VanDerWaalsContact O-N 3.1Å; I29-V32 HydrophobicContact CD1-CB 4.4Å; I29-V32 PolarHBondContact O-N 2.88Å; V32-L34 PolarHBondContact O-N 2.9Å; V32-L35 PolarHBondContact O-N 3.3Å; V32-L36 HydrophobicContact CG1-CD1 3.94Å; V32-L36 HydrophobicContact CG1-CG 4.41Å; V32-L36 WeakPolarHBondContact O-CG 3.29Å; V32-L36 PolarHBondContact O-N 2.94Å; V32-I54 HydrophobicContact CG1-CB 4.32Å; V32-I54 HydrophobicContact CG1-CG1 4.3Å; V32-I54 HydrophobicContact CG1-CG2 4.1Å; V32-C57 HydrophobicContact CG1-CB 3.85Å; V32-C57 HydrophobicContact CG2-CB 4.26Å; V32-V58 HydrophobicContact CG2-CG2 3.77Å; V32-I61 HydrophobicContact CG2-CD1 4.14Å; V32-F70 HydrophobicContact CG2-CE1 4.41Å
33K97.1Very high95.1Very high9 Ų923.5 Ų23.54%0.03913%0.127CC..Hα-helixtrans-52.7-55.2173.2178.2-140.3162.9175.10110.8I29 E30 R31 L35 L36 Q37 Y229 D232 G273 N277I29-K33 PolarHBondContact O-N 3.02Å; E30-K33 WeakPolarHBondContact O-CB 3.29Å; E30-K33 PolarHBondContact O-N 3.11Å; R31-K33 VanDerWaalsContact C-N 3.32Å; R31-K33 PolarHBondContact O-N 3.14Å; K33-L35 PolarHBondContact O-N 3.33Å; K33-L36 PolarHBondContact O-N 3.47Å; K33-Q37 VanDerWaalsContact O-CB 3.25Å; K33-Q37 WeakPolarHBondContact O-CB 3.11Å; K33-Q37 PolarHBondContact O-N 3.5Å; K33-Y229 VanDerWaalsContact CE-OH 3.28Å; K33-Y229 WeakPolarHBondContact CE-OH 3.43Å; K33-D232 IonicContact NZ-OD2 2.69Å; K33-D232 PolarHBondContact NZ-OD2 3.46Å; K33-G273 WeakPolarHBondContact CG-O 3.38Å; K33-N277 HydrophobicContact CD-CB 3.84Å; K33-N277 HydrophobicContact CG-CB 4Å; K33-N277 PolarHBondContact NZ-OD1 3.33Å
34L97.1Very high95.1Very high4 Ų423.8 Ų23.82%0.02113%0.129CC..Hα-helixtrans-62.5-44.1-175.8-72.3170.8000111.5E30 R31 V32 Q37 V38 A142 R236E30-L34 HydrophobicContact CG-CD1 4.46Å; E30-L34 WeakPolarHBondContact O-CG 3.39Å; E30-L34 PolarHBondContact O-N 3.47Å; R31-L34 PolarHBondContact O-N 3.35Å; V32-L34 PolarHBondContact O-N 2.9Å; L34-Q37 PolarHBondContact O-N 3.31Å; L34-V38 WeakPolarHBondContact O-CG2 3.35Å; L34-V38 PolarHBondContact O-N 3.43Å; L34-A142 HydrophobicContact CB-CB 4.13Å; L34-A142 HydrophobicContact CD1-CB 3.51Å; L34-A142 HydrophobicContact CG-CB 4.47Å; L34-R236 HydrophobicContact CD2-CG 4.34Å
35L97.1Very high94.9Very high1 Ų122.2 Ų22.21%0.00512%0.119CC..Hα-helixtrans-59.2-50.9177-75.3168.5000111.4R31 V32 K33 Q37 V38 Q39 I45 Y51 I61 V145R31-L35 HydrophobicContact CG-CD1 4.1Å; R31-L35 HydrophobicContact CG-CG 4.48Å; R31-L35 WeakPolarHBondContact O-CG 3.27Å; R31-L35 PolarHBondContact O-N 3.46Å; V32-L35 PolarHBondContact O-N 3.3Å; K33-L35 PolarHBondContact O-N 3.33Å; L35-Q37 PolarHBondContact O-N 2.86Å; L35-V38 PolarHBondContact O-N 3.02Å; L35-Q39 WeakPolarHBondContact O-CA 3.08Å; L35-Q39 WeakPolarHBondContact O-CB 3.02Å; L35-Q39 WeakPolarHBondContact O-CG 3.41Å; L35-Q39 PolarHBondContact O-N 3.29Å; L35-I45 HydrophobicContact CD2-CD1 4.49Å; L35-Y51 HydrophobicContact CB-CD2 4.29Å; L35-Y51 HydrophobicContact CB-CE2 4.35Å; L35-Y51 HydrophobicContact CD1-CE2 4.06Å; L35-Y51 HydrophobicContact CD2-CE2 4.31Å; L35-Y51 HydrophobicContact CG-CE2 4.49Å; L35-I61 HydrophobicContact CD1-CD1 3.65Å; L35-I61 HydrophobicContact CD1-CG1 4.16Å; L35-V145 HydrophobicContact CD2-CG1 3.63Å
36L96.7Very high94.7Very high16 Ų1622.7 Ų22.78%0.08412%0.116CC..Hα-helixtrans-59.4-37.6177.6-68174.1000112.1V32 K33 I54V32-L36 HydrophobicContact CG1-CD1 3.94Å; V32-L36 HydrophobicContact CG1-CG 4.41Å; V32-L36 WeakPolarHBondContact O-CG 3.29Å; V32-L36 PolarHBondContact O-N 2.94Å; K33-L36 PolarHBondContact O-N 3.47Å; L36-I54 HydrophobicContact CD1-CG1 3.99Å
37Q96.8Very high94.4Very high0 Ų026.3 Ų26.30%015%0.147CC..Hα-helixtrans-70.7-38.7-178-167.7175.427.600112.7K33 L34 L35 D232 T233 R237 K272K33-Q37 VanDerWaalsContact O-CB 3.25Å; K33-Q37 WeakPolarHBondContact O-CB 3.11Å; K33-Q37 PolarHBondContact O-N 3.5Å; L34-Q37 PolarHBondContact O-N 3.31Å; L35-Q37 PolarHBondContact O-N 2.86Å; Q37-D232 PolarHBondContact NE2-OD2 2.86Å; Q37-D232 PolarHBondContact OE1-OD2 2.96Å; Q37-T233 HydrophobicContact CG-CG2 4.2Å; Q37-T233 VanDerWaalsContact NE2-CA 3.31Å; Q37-T233 PolarHBondContact NE2-OG1 3.29Å; Q37-R237 PolarHBondContact O-NE 2.86Å; Q37-R237 PolarHBondContact O-NH2 3.49Å; Q37-K272 WeakPolarHBondContact CA-O 3.16Å; Q37-K272 WeakPolarHBondContact CB-O 3.34Å
38V95.7Very high94.1Very high1 Ų132.2 Ų32.21%0.00618%0.177CC..Hα-helixtrans-114.8-5.8-172.1-49.30000116.1L34 L35 H40 A41 S42 A143 R236 M240L34-V38 WeakPolarHBondContact O-CG2 3.35Å; L34-V38 PolarHBondContact O-N 3.43Å; L35-V38 PolarHBondContact O-N 3.02Å; V38-H40 PolarHBondContact O-N 3.36Å; V38-H40 VanDerWaalsContact O-N 3.13Å; V38-A41 CarbonylContact O-C 3.39Å; V38-A41 WeakPolarHBondContact O-CA 3.43Å; V38-A41 WeakPolarHBondContact O-CB 3.22Å; V38-A41 PolarHBondContact O-N 2.96Å; V38-S42 PolarHBondContact O-N 2.9Å; V38-A143 HydrophobicContact CG2-CB 3.61Å; V38-R236 HydrophobicContact CG1-CB 3.45Å; V38-R236 VanDerWaalsContact CG1-CB 3.45Å; V38-R236 HydrophobicContact CG1-CG 4.46Å; V38-M240 HydrophobicContact CB-CG 3.92Å; V38-M240 HydrophobicContact CB-SD 4.38Å; V38-M240 HydrophobicContact CG1-CG 4.3Å; V38-M240 HydrophobicContact CG2-CE 4.47Å; V38-M240 HydrophobicContact CG2-CG 4.19Å; V38-M240 HydrophobicContact CG2-SD 4Å
39Q95.4Very high93.9Very high12 Ų1236.6 Ų36.66%0.05619%0.194CC..G310 helixtrans-55.9-33.1-176.156.6-178.8-23.400114.4L35 A41 S42 I45 Y51L35-Q39 WeakPolarHBondContact O-CA 3.08Å; L35-Q39 WeakPolarHBondContact O-CB 3.02Å; L35-Q39 WeakPolarHBondContact O-CG 3.41Å; L35-Q39 PolarHBondContact O-N 3.29Å; Q39-A41 PolarHBondContact O-N 2.96Å; Q39-S42 VanDerWaalsContact O-CB 3.29Å; Q39-S42 WeakPolarHBondContact O-CB 3.38Å; Q39-S42 PolarHBondContact O-N 3.24Å; Q39-I45 HydrophobicContact CB-CD1 3.62Å; Q39-Y51 PolarHBondContact NE2-O 3.46Å; Q39-Y51 VanDerWaalsContact NE2-O 3.11Å
40H92.1Very high93.9Very high70 Ų7037.3 Ų37.332%0.32420%0.196SC..G310 helixtrans-64.2-23.1176.4-165.581.7000112.4V38 E265V38-H40 PolarHBondContact O-N 3.36Å; V38-H40 VanDerWaalsContact O-N 3.13Å; H40-E265 IonicContact CD2-OE1 3.18Å; H40-E265 PolarHBondContact CD2-OE1 3.23Å; H40-E265 IonicContact CD2-OE2 2.64Å; H40-E265 IonicContact CG-OE1 3.06Å; H40-E265 IonicContact CG-OE2 3.48Å; H40-E265 IonicContact NE2-OE1 3.39Å
41A91.3Very high93.9Very high0 Ų037.3 Ų37.30%020%0.196CC..G310 helixtrans-10423.2174.800000112.3V38 Q39 M240 R244 M250 Y251V38-A41 CarbonylContact O-C 3.39Å; V38-A41 WeakPolarHBondContact O-CA 3.43Å; V38-A41 WeakPolarHBondContact O-CB 3.22Å; V38-A41 PolarHBondContact O-N 2.96Å; Q39-A41 PolarHBondContact O-N 2.96Å; A41-M240 HydrophobicContact CB-CB 4.28Å; A41-M240 HydrophobicContact CB-CG 4.47Å; A41-R244 PolarHBondContact O-NH2 3.32Å; A41-M250 HydrophobicContact CB-CE 3.3Å; A41-M250 HydrophobicContact CB-SD 4.41Å; A41-Y251 HydrophobicContact CB-CE2 4.27Å
42S92Very high93.7Very high17 Ų1746.4 Ų46.412%0.11924%0.235CC..  trans-92.5149175.6-1760000111.4V38 Q39 Q44 I45V38-S42 PolarHBondContact O-N 2.9Å; Q39-S42 VanDerWaalsContact O-CB 3.29Å; Q39-S42 WeakPolarHBondContact O-CB 3.38Å; Q39-S42 PolarHBondContact O-N 3.24Å; S42-Q44 PolarHBondContact OG-N 3.43Å; S42-I45 PolarHBondContact OG-N 2.9Å
43K89.7Confident93.6Very high113 Ų11347.4 Ų47.449%0.49125%0.246SC..SBendtrans-85.7-25.4169.3-75.7-171165.7-169.30112.8D248K43-D248 WeakPolarHBondContact CE-OD2 3.45Å; K43-D248 VanDerWaalsContact NZ-CG 3.29Å; K43-D248 IonicContact NZ-OD2 3.9Å; K43-D248 PolarHBondContact NZ-OD2 3.29Å
44Q89.7Confident93.5Very high61 Ų6148.8 Ų48.829%0.28525%0.254SS..SBendtrans-90.8-19.9-174.9-65.5167.4-43.800112.4S42 D144 V145 E151S42-Q44 PolarHBondContact OG-N 3.43Å; Q44-D144 PolarHBondContact NE2-OD1 3.32Å; Q44-D144 PolarHBondContact OE1-OD1 3.26Å; Q44-V145 HydrophobicContact CB-CG2 3.39Å; Q44-V145 HydrophobicContact CG-CG2 4.37Å; Q44-E151 PolarHBondContact NE2-O 3.11Å
45I91.6Very high93.4Very high14 Ų1455.9 Ų55.97%0.07229%0.289CS..  trans-102.4105-178.7-53.7170.6000108.5L35 Q39 S42 K49 Q50 Y51 V145L35-I45 HydrophobicContact CD2-CD1 4.49Å; Q39-I45 HydrophobicContact CB-CD1 3.62Å; S42-I45 PolarHBondContact OG-N 2.9Å; I45-K49 HydrophobicContact CG2-CB 4.34Å; I45-Q50 HydrophobicContact CG2-CB 4.43Å; I45-Q50 HydrophobicContact CG2-CG 3.8Å; I45-Y51 HydrophobicContact CD1-CE2 4.38Å; I45-V145 HydrophobicContact CD1-CG1 3.76Å; I45-V145 HydrophobicContact CD1-CG2 4.2Å; I45-V145 HydrophobicContact CG1-CB 4.35Å; I45-V145 HydrophobicContact CG1-CG1 4.03Å; I45-V145 HydrophobicContact CG1-CG2 3.53Å
46T90.6Very high93.4Very high66 Ų6658 Ų5841%0.40530%0.3SS..  trans-71160.8170.154.10000110.7D48 K49 Q50T46-D48 VanDerWaalsContact C-N 3.26Å; T46-D48 WeakPolarHBondContact CB-OD1 3.29Å; T46-D48 PolarHBondContact O-N 3.16Å; T46-D48 PolarHBondContact OG1-OD1 3.36Å; T46-K49 PolarHBondContact O-N 3.26Å; T46-K49 WeakPolarHBondContact OG1-CG 3.47Å; T46-Q50 PolarHBondContact O-N 3.35Å
47A89.3Confident93.3Very high84 Ų8457.2 Ų57.269%0.69430%0.296SS*.G310 helixtrans-56.9-38.1-175.100000113.2K49A47-K49 VanDerWaalsContact C-N 3.29Å; A47-K49 PolarHBondContact O-N 2.96Å
48D90.3Very high93.3Very high130 Ų13060 Ų6070%0.69531%0.313SS*.G310 helixtrans-69.2-23.2176.962.5-58000113.6T46T46-D48 VanDerWaalsContact C-N 3.26Å; T46-D48 WeakPolarHBondContact CB-OD1 3.29Å; T46-D48 PolarHBondContact O-N 3.16Å; T46-D48 PolarHBondContact OG1-OD1 3.36Å
49K92.9Very high93.3Very high120 Ų12064 Ų6452%0.52234%0.337SS..G310 helixtrans-97.80.3-178.2-66.5-176.9-176.3173.80113.8I45 T46 A47 Y51 R60I45-K49 HydrophobicContact CG2-CB 4.34Å; T46-K49 PolarHBondContact O-N 3.26Å; T46-K49 WeakPolarHBondContact OG1-CG 3.47Å; A47-K49 VanDerWaalsContact C-N 3.29Å; A47-K49 PolarHBondContact O-N 2.96Å; K49-Y51 PolarHBondContact O-N 3.34Å; K49-R60 PolarHBondContact O-NH1 3.13Å; K49-R60 PolarHBondContact O-NH2 2.87Å
50Q95Very high93.4Very high51 Ų5165.7 Ų65.724%0.23834%0.343CS..  trans-58.7139.9177.6-69.5-177.11300111I45 T46 K52 R60I45-Q50 HydrophobicContact CG2-CB 4.43Å; I45-Q50 HydrophobicContact CG2-CG 3.8Å; T46-Q50 PolarHBondContact O-N 3.35Å; Q50-K52 PolarHBondContact O-N 2.84Å; Q50-R60 PolarHBondContact O-NH1 2.82Å
51Y96.1Very high93.5Very high10 Ų1062.3 Ų62.34%0.03933%0.327CS..  trans-69.6128.9175.1-60-69.8000109.9L35 Q39 I45 K49 G53 D56 C57 R60 E64 V145L35-Y51 HydrophobicContact CB-CD2 4.29Å; L35-Y51 HydrophobicContact CB-CE2 4.35Å; L35-Y51 HydrophobicContact CD1-CE2 4.06Å; L35-Y51 HydrophobicContact CD2-CE2 4.31Å; L35-Y51 HydrophobicContact CG-CE2 4.49Å; Q39-Y51 PolarHBondContact NE2-O 3.46Å; Q39-Y51 VanDerWaalsContact NE2-O 3.11Å; I45-Y51 HydrophobicContact CD1-CE2 4.38Å; K49-Y51 PolarHBondContact O-N 3.34Å; Y51-G53 VanDerWaalsContact C-N 3.29Å; Y51-G53 PolarHBondContact O-N 3.01Å; Y51-D56 WeakPolarHBondContact CA-OD2 3.32Å; Y51-C57 HydrophobicContact CD1-CB 4.07Å; Y51-C57 HydrophobicContact CG-CB 4.01Å; Y51-R60 HydrophobicContact CD1-CB 4.33Å; Y51-R60 HydrophobicContact CE1-CB 3.84Å; Y51-E64 PolarHBondContact OH-OE2 3.01Å; Y51-V145 HydrophobicContact CE2-CG1 4.43Å
52K94.4Very high93.8Very high194 Ų19464.3 Ų64.384%0.84334%0.34SS*.  trans-75.4-19.2-175.8-62.3178.3-179.5177.40113.1Q50 D56Q50-K52 PolarHBondContact O-N 2.84Å; K52-D56 HydrophobicContact CB-CB 4.13Å; K52-D56 PolarHBondContact N-OD2 3.35Å
53G94.3Very high93.8Very high23 Ų2371.5 Ų71.524%0.23737%0.369CS..SBendtrans170.9-168-178.700000112.2Y51 C57Y51-G53 VanDerWaalsContact C-N 3.29Å; Y51-G53 PolarHBondContact O-N 3.01Å; G53-C57 VanDerWaalsContact O-CB 3.24Å; G53-C57 WeakPolarHBondContact O-CB 3.42Å; G53-C57 PolarHBondContact O-N 2.86Å
54I94.9Very high94Very high38 Ų3868.7 Ų68.720%0.19536%0.358CS..Hα-helixtrans-61.6-54.2-176.6-60.2178.8000110.7I29 V32 L36 D56 C57 V58 S276 L279I29-I54 HydrophobicContact CD1-CG2 4.05Å; V32-I54 HydrophobicContact CG1-CB 4.32Å; V32-I54 HydrophobicContact CG1-CG1 4.3Å; V32-I54 HydrophobicContact CG1-CG2 4.1Å; L36-I54 HydrophobicContact CD1-CG1 3.99Å; I54-D56 PolarHBondContact O-N 2.94Å; I54-C57 WeakPolarHBondContact O-CB 3.49Å; I54-C57 PolarHBondContact O-N 3.22Å; I54-C57 VanDerWaalsContact O-N 3.15Å; I54-V58 HydrophobicContact CG2-CG2 4.16Å; I54-V58 VanDerWaalsContact O-CG2 3.24Å; I54-V58 WeakPolarHBondContact O-CG2 3.43Å; I54-V58 PolarHBondContact O-N 2.98Å; I54-S276 WeakPolarHBondContact CD1-OG 3.33Å; I54-S276 VanDerWaalsContact CG1-OG 3.26Å; I54-S276 WeakPolarHBondContact CG1-OG 3.1Å; I54-L279 HydrophobicContact CD1-CD1 4.23Å
55M96.3Very high94.2Very high153 Ų15366.6 Ų66.675%0.75435%0.348SS*.Hα-helixtrans-62.5-43.7-175.5-59.1-56.7-101.100111.8C57 V58 V59M55-C57 VanDerWaalsContact C-N 3.32Å; M55-C57 PolarHBondContact O-N 3.41Å; M55-V58 PolarHBondContact O-N 3.44Å; M55-V59 WeakPolarHBondContact O-CB 3.31Å; M55-V59 VanDerWaalsContact O-CG2 3.29Å; M55-V59 WeakPolarHBondContact O-CG2 3.24Å; M55-V59 PolarHBondContact O-N 2.75Å
56D96.6Very high94.3Very high45 Ų4567.5 Ų67.524%0.24136%0.361CS..Hα-helixtrans-57.5-45.3174.9-174.860.1000111.4Y51 K52 I54 V59 R60Y51-D56 WeakPolarHBondContact CA-OD2 3.32Å; K52-D56 HydrophobicContact CB-CB 4.13Å; K52-D56 PolarHBondContact N-OD2 3.35Å; I54-D56 PolarHBondContact O-N 2.94Å; D56-V59 PolarHBondContact O-N 3.36Å; D56-R60 VanDerWaalsContact CG-CD 3.47Å; D56-R60 VanDerWaalsContact O-CB 3.22Å; D56-R60 WeakPolarHBondContact O-CB 3.38Å; D56-R60 WeakPolarHBondContact O-CD 3.5Å; D56-R60 VanDerWaalsContact O-CG 3.23Å; D56-R60 WeakPolarHBondContact O-CG 3.46Å; D56-R60 PolarHBondContact O-N 3.28Å; D56-R60 WeakPolarHBondContact OD1-CD 3.46Å; D56-R60 WeakPolarHBondContact OD2-CD 3.22Å; D56-R60 IonicContact OD2-CZ 3.3Å; D56-R60 IonicContact OD2-NH1 2.82Å; D56-R60 PolarHBondContact OD2-NH1 2.97Å
57C95.1Very high94.5Very high0 Ų070.5 Ų70.50%037%0.369CS..Hα-helixtrans-63.6-47.1178.1-163.60000112.2V32 Y51 G53 I54 M55 V59 R60 I61V32-C57 HydrophobicContact CG1-CB 3.85Å; V32-C57 HydrophobicContact CG2-CB 4.26Å; Y51-C57 HydrophobicContact CD1-CB 4.07Å; Y51-C57 HydrophobicContact CG-CB 4.01Å; G53-C57 VanDerWaalsContact O-CB 3.24Å; G53-C57 WeakPolarHBondContact O-CB 3.42Å; G53-C57 PolarHBondContact O-N 2.86Å; I54-C57 WeakPolarHBondContact O-CB 3.49Å; I54-C57 PolarHBondContact O-N 3.22Å; I54-C57 VanDerWaalsContact O-N 3.15Å; M55-C57 VanDerWaalsContact C-N 3.32Å; M55-C57 PolarHBondContact O-N 3.41Å; C57-V59 VanDerWaalsContact C-N 3.33Å; C57-V59 PolarHBondContact O-N 3.34Å; C57-R60 PolarHBondContact O-N 3.14Å; C57-I61 WeakPolarHBondContact O-CB 3.17Å; C57-I61 WeakPolarHBondContact O-CD1 3.4Å; C57-I61 WeakPolarHBondContact O-CG1 3.29Å; C57-I61 PolarHBondContact O-N 3.11Å; C57-I61 WeakPolarHBondContact SG-CD1 3.3Å
58V95.6Very high94.8Very high59 Ų5973.3 Ų73.336%0.35837%0.371SS..Hα-helixtrans-64.8-36.3-179.6-178.90000111.7V32 I54 M55 P62 F70V32-V58 HydrophobicContact CG2-CG2 3.77Å; I54-V58 HydrophobicContact CG2-CG2 4.16Å; I54-V58 VanDerWaalsContact O-CG2 3.24Å; I54-V58 WeakPolarHBondContact O-CG2 3.43Å; I54-V58 PolarHBondContact O-N 2.98Å; M55-V58 PolarHBondContact O-N 3.44Å; V58-P62 WeakPolarHBondContact O-CD 3.31Å; V58-F70 HydrophobicContact CG1-CZ 4.01Å; V58-F70 WeakPolarHBondContact O-CZ 3.33Å
59V96.9Very high95Very high84 Ų8467.5 Ų67.551%0.50934%0.341SS..Hα-helixtrans-76-37.7178.7171.90000112M55 D56 C57M55-V59 WeakPolarHBondContact O-CB 3.31Å; M55-V59 VanDerWaalsContact O-CG2 3.29Å; M55-V59 WeakPolarHBondContact O-CG2 3.24Å; M55-V59 PolarHBondContact O-N 2.75Å; D56-V59 PolarHBondContact O-N 3.36Å; C57-V59 VanDerWaalsContact C-N 3.33Å; C57-V59 PolarHBondContact O-N 3.34Å
60R96.7Very high95.2Very high47 Ų4762.4 Ų62.418%0.17732%0.319CS..Hα-helixtrans-80.8-39-175-73.9171.757.6-165.1-4113.3K49 Q50 Y51 D56 C57 K63 E64K49-R60 PolarHBondContact O-NH1 3.13Å; K49-R60 PolarHBondContact O-NH2 2.87Å; Q50-R60 PolarHBondContact O-NH1 2.82Å; Y51-R60 HydrophobicContact CD1-CB 4.33Å; Y51-R60 HydrophobicContact CE1-CB 3.84Å; D56-R60 VanDerWaalsContact CG-CD 3.47Å; D56-R60 VanDerWaalsContact O-CB 3.22Å; D56-R60 WeakPolarHBondContact O-CB 3.38Å; D56-R60 WeakPolarHBondContact O-CD 3.5Å; D56-R60 VanDerWaalsContact O-CG 3.23Å; D56-R60 WeakPolarHBondContact O-CG 3.46Å; D56-R60 PolarHBondContact O-N 3.28Å; D56-R60 WeakPolarHBondContact OD1-CD 3.46Å; D56-R60 WeakPolarHBondContact OD2-CD 3.22Å; D56-R60 IonicContact OD2-CZ 3.3Å; D56-R60 IonicContact OD2-NH1 2.82Å; D56-R60 PolarHBondContact OD2-NH1 2.97Å; C57-R60 PolarHBondContact O-N 3.14Å; R60-K63 PolarHBondContact O-N 3.27Å; R60-E64 HydrophobicContact CB-CG 4.46Å; R60-E64 IonicContact CZ-OE1 3.69Å; R60-E64 VanDerWaalsContact CZ-OE1 3.3Å; R60-E64 IonicContact NE-OE1 2.88Å; R60-E64 PolarHBondContact NE-OE1 3.02Å; R60-E64 IonicContact NH2-OE1 3.58Å; R60-E64 PolarHBondContact NH2-OE1 2.78Å; R60-E64 WeakPolarHBondContact O-CB 3.22Å; R60-E64 WeakPolarHBondContact O-CG 3.17Å; R60-E64 PolarHBondContact O-N 3.37Å
61I95.4Very high95.3Very high0 Ų063.9 Ų63.90%032%0.322CS..Hα-helixtrans-50.4-51.2-177.3-79.3166.3000112.9V32 L35 C57 K63 E64 Q65 S69 F70V32-I61 HydrophobicContact CG2-CD1 4.14Å; L35-I61 HydrophobicContact CD1-CD1 3.65Å; L35-I61 HydrophobicContact CD1-CG1 4.16Å; C57-I61 WeakPolarHBondContact O-CB 3.17Å; C57-I61 WeakPolarHBondContact O-CD1 3.4Å; C57-I61 WeakPolarHBondContact O-CG1 3.29Å; C57-I61 PolarHBondContact O-N 3.11Å; C57-I61 WeakPolarHBondContact SG-CD1 3.3Å; I61-K63 VanDerWaalsContact C-N 3.31Å; I61-K63 PolarHBondContact O-N 3.2Å; I61-E64 PolarHBondContact O-N 2.9Å; I61-Q65 PolarHBondContact O-N 3.18Å; I61-S69 WeakPolarHBondContact CG2-OG 3.45Å; I61-F70 HydrophobicContact CB-CE1 3.96Å; I61-F70 HydrophobicContact CB-CZ 4.15Å; I61-F70 HydrophobicContact CD1-CD1 4.14Å; I61-F70 HydrophobicContact CD1-CE1 3.73Å; I61-F70 HydrophobicContact CG1-CE1 4.49Å; I61-F70 HydrophobicContact CG2-CD1 3.91Å; I61-F70 HydrophobicContact CG2-CD2 4.49Å; I61-F70 HydrophobicContact CG2-CE1 3.75Å; I61-F70 HydrophobicContact CG2-CE2 4.38Å; I61-F70 HydrophobicContact CG2-CG 4.26Å; I61-F70 HydrophobicContact CG2-CZ 4Å
62P95.8Very high95.3Very high41 Ų4165.5 Ų65.527%0.26633%0.328SS..Hα-helixtrans-63.7-36.8-179.3-25.236.6000113V58 G66 F67 F70V58-P62 WeakPolarHBondContact O-CD 3.31Å; P62-G66 WeakPolarHBondContact O-CA 3.48Å; P62-G66 PolarHBondContact O-N 2.87Å; P62-F67 HydrophobicContact CG-CD2 4.4Å; P62-F70 HydrophobicContact CG-CE2 3.52Å; P62-F70 HydrophobicContact CG-CZ 3.81Å
63K93.8Very high95.3Very high168 Ų16856.8 Ų56.873%0.7329%0.293SS*.Hα-helixtrans-72.4-37.2179.5-62-179.3-178.5-176.90112R60 I61R60-K63 PolarHBondContact O-N 3.27Å; I61-K63 VanDerWaalsContact C-N 3.31Å; I61-K63 PolarHBondContact O-N 3.2Å
64E93.1Very high95.4Very high54 Ų5456.4 Ų56.425%0.25229%0.286SS..Hα-helixtrans-79.9-41-177.6-71174.3-18000111.5Y51 R60 I61 K147Y51-E64 PolarHBondContact OH-OE2 3.01Å; R60-E64 HydrophobicContact CB-CG 4.46Å; R60-E64 IonicContact CZ-OE1 3.69Å; R60-E64 VanDerWaalsContact CZ-OE1 3.3Å; R60-E64 IonicContact NE-OE1 2.88Å; R60-E64 PolarHBondContact NE-OE1 3.02Å; R60-E64 IonicContact NH2-OE1 3.58Å; R60-E64 PolarHBondContact NH2-OE1 2.78Å; R60-E64 WeakPolarHBondContact O-CB 3.22Å; R60-E64 WeakPolarHBondContact O-CG 3.17Å; R60-E64 PolarHBondContact O-N 3.37Å; I61-E64 PolarHBondContact O-N 2.9Å; E64-K147 VanDerWaalsContact O-CD 3.26Å; E64-K147 WeakPolarHBondContact O-CD 3.2Å; E64-K147 WeakPolarHBondContact O-CE 3.25Å; E64-K147 WeakPolarHBondContact O-CG 3.44Å
65Q92.9Very high95.4Very high17 Ų1759.6 Ų59.68%0.07930%0.303CS..Hα-helixtrans-132.8-0.5-164.5-51.4-177.5-79.700115.2R31 I61 D144 V145 G146R31-Q65 VanDerWaalsContact CZ-OE1 3.28Å; I61-Q65 PolarHBondContact O-N 3.18Å; Q65-D144 PolarHBondContact NE2-O 3.26Å; Q65-V145 PolarHBondContact NE2-O 3Å; Q65-G146 PolarHBondContact NE2-O 2.93Å
66G94.2Very high95.3Very high34 Ų3452.4 Ų52.435%0.35127%0.267SS..  trans87.4151.3-172.900000113.5P62 L68 S69P62-G66 WeakPolarHBondContact O-CA 3.48Å; P62-G66 PolarHBondContact O-N 2.87Å; G66-L68 PolarHBondContact O-N 2.81Å; G66-S69 WeakPolarHBondContact O-CB 3.48Å; G66-S69 PolarHBondContact O-N 3.28Å; G66-S69 VanDerWaalsContact O-N 3.11Å; G66-S69 PolarHBondContact O-OG 2.93Å
67F95.1Very high94.9Very high129 Ų12950.7 Ų50.757%0.56626%0.258SS*.G310 helixtrans-58.9-42.1-174.6-177.8-102.8000113.8P62 S69 F70 W71P62-F67 HydrophobicContact CG-CD2 4.4Å; F67-S69 PolarHBondContact O-N 3.36Å; F67-F70 HydrophobicContact CD2-CD2 4.21Å; F67-F70 HydrophobicContact CD2-CE2 4.16Å; F67-F70 HydrophobicContact CE2-CD2 4.25Å; F67-F70 HydrophobicContact CE2-CE2 4.2Å; F67-F70 VanDerWaalsContact O-CD2 3.29Å; F67-F70 WeakPolarHBondContact O-CD2 3.49Å; F67-F70 PolarHBondContact O-N 3.39Å; F67-W71 HydrophobicContact CD1-CZ3 4.29Å; F67-W71 HydrophobicContact CE1-CH2 4.09Å; F67-W71 AromaticContact CE1-CZ3 3.87Å; F67-W71 HydrophobicContact CE1-CZ3 3.87Å; F67-W71 HydrophobicContact CZ-CH2 4.28Å; F67-W71 HydrophobicContact CZ-CZ3 4.32Å
68L95.2Very high94.9Very high142 Ų14252.5 Ų52.574%0.74327%0.269SS*.G310 helixtrans-63.4-15.4179.9-64.7178.5000113.5G66 F70 W71G66-L68 PolarHBondContact O-N 2.81Å; L68-F70 PolarHBondContact O-N 3.38Å; L68-W71 PolarHBondContact O-N 3.35Å; L68-W71 VanDerWaalsContact O-N 3.14Å
69S95.3Very high94.8Very high8 Ų853 Ų536%0.05627%0.269CS..G310 helixtrans-64.1-18.7177.972.50000113.1R31 I61 G66 F67 W71 R72R31-S69 WeakPolarHBondContact CD-O 3.34Å; R31-S69 PolarHBondContact NE-O 3.45Å; R31-S69 VanDerWaalsContact NE-O 3.12Å; R31-S69 VanDerWaalsContact NH1-C 3.27Å; R31-S69 PolarHBondContact NH1-O 3.1Å; R31-S69 PolarHBondContact NH1-OG 2.74Å; I61-S69 WeakPolarHBondContact CG2-OG 3.45Å; G66-S69 WeakPolarHBondContact O-CB 3.48Å; G66-S69 PolarHBondContact O-N 3.28Å; G66-S69 VanDerWaalsContact O-N 3.11Å; G66-S69 PolarHBondContact O-OG 2.93Å; F67-S69 PolarHBondContact O-N 3.36Å; S69-W71 PolarHBondContact O-N 3.37Å; S69-W71 VanDerWaalsContact O-N 3.15Å; S69-R72 WeakPolarHBondContact O-CB 3.39Å; S69-R72 PolarHBondContact O-N 3.02Å
70F96.8Very high94.6Very high13 Ų1351.8 Ų51.86%0.05726%0.256CS..G310 helixtrans-54.7-30171.3-80.6-57000113.7P28 R31 V32 V58 I61 P62 F67 L68P28-F70 HydrophobicContact CB-CB 3.84Å; P28-F70 HydrophobicContact CB-CD1 3.82Å; P28-F70 HydrophobicContact CB-CG 3.85Å; P28-F70 HydrophobicContact CG-CB 3.97Å; P28-F70 HydrophobicContact CG-CG 4.4Å; R31-F70 WeakPolarHBondContact CD-O 3.22Å; V32-F70 HydrophobicContact CG2-CE1 4.41Å; V58-F70 HydrophobicContact CG1-CZ 4.01Å; V58-F70 WeakPolarHBondContact O-CZ 3.33Å; I61-F70 HydrophobicContact CB-CE1 3.96Å; I61-F70 HydrophobicContact CB-CZ 4.15Å; I61-F70 HydrophobicContact CD1-CD1 4.14Å; I61-F70 HydrophobicContact CD1-CE1 3.73Å; I61-F70 HydrophobicContact CG1-CE1 4.49Å; I61-F70 HydrophobicContact CG2-CD1 3.91Å; I61-F70 HydrophobicContact CG2-CD2 4.49Å; I61-F70 HydrophobicContact CG2-CE1 3.75Å; I61-F70 HydrophobicContact CG2-CE2 4.38Å; I61-F70 HydrophobicContact CG2-CG 4.26Å; I61-F70 HydrophobicContact CG2-CZ 4Å; P62-F70 HydrophobicContact CG-CE2 3.52Å; P62-F70 HydrophobicContact CG-CZ 3.81Å; F67-F70 HydrophobicContact CD2-CD2 4.21Å; F67-F70 HydrophobicContact CD2-CE2 4.16Å; F67-F70 HydrophobicContact CE2-CD2 4.25Å; F67-F70 HydrophobicContact CE2-CE2 4.2Å; F67-F70 VanDerWaalsContact O-CD2 3.29Å; F67-F70 WeakPolarHBondContact O-CD2 3.49Å; F67-F70 PolarHBondContact O-N 3.39Å; L68-F70 PolarHBondContact O-N 3.38Å
71W97.6Very high94.3Very high82 Ų8252 Ų5231%0.31126%0.257SS..G310 helixtrans-94.612178.5-69.4-92.1000113.6T24 A27 P28 F67 L68 S69 G73 N74T24-W71 PolarHBondContact O-NE1 2.89Å; A27-W71 HydrophobicContact CB-CG 4.28Å; P28-W71 HydrophobicContact CG-CH2 3.94Å; P28-W71 HydrophobicContact CG-CZ2 3.61Å; F67-W71 HydrophobicContact CD1-CZ3 4.29Å; F67-W71 HydrophobicContact CE1-CH2 4.09Å; F67-W71 AromaticContact CE1-CZ3 3.87Å; F67-W71 HydrophobicContact CE1-CZ3 3.87Å; F67-W71 HydrophobicContact CZ-CH2 4.28Å; F67-W71 HydrophobicContact CZ-CZ3 4.32Å; L68-W71 PolarHBondContact O-N 3.35Å; L68-W71 VanDerWaalsContact O-N 3.14Å; S69-W71 PolarHBondContact O-N 3.37Å; S69-W71 VanDerWaalsContact O-N 3.15Å; W71-G73 PolarHBondContact O-N 3.08Å; W71-G73 VanDerWaalsContact O-N 3.14Å; W71-N74 HydrophobicContact CB-CB 4.09Å; W71-N74 WeakPolarHBondContact O-CB 3.19Å; W71-N74 PolarHBondContact O-N 3.12Å
72R95.9Very high94Very high45 Ų4555.3 Ų55.317%0.1727%0.271CS..THydrogen-bonded Turntrans-62119.2178.6-165.1176.4-179.880.56110.3S69 L141 D144 R152 F154S69-R72 WeakPolarHBondContact O-CB 3.39Å; S69-R72 PolarHBondContact O-N 3.02Å; R72-L141 WeakPolarHBondContact CD-O 3.41Å; R72-L141 HydrophobicContact CG-CB 4.38Å; R72-L141 VanDerWaalsContact CG-O 3.22Å; R72-L141 WeakPolarHBondContact CG-O 3.41Å; R72-L141 PolarHBondContact NE-O 3Å; R72-D144 IonicContact CZ-OD2 3.48Å; R72-D144 IonicContact NE-OD2 3.58Å; R72-D144 IonicContact NH2-OD2 2.66Å; R72-D144 PolarHBondContact NH2-OD2 3.03Å; R72-R152 VanDerWaalsContact CD-NH1 3.27Å; R72-R152 VanDerWaalsContact CZ-CD 3.48Å; R72-R152 VanDerWaalsContact NE-NH1 3.15Å; R72-R152 VanDerWaalsContact NH1-NE 3.1Å; R72-R152 VanDerWaalsContact NH1-NH1 3.15Å; R72-R152 VanDerWaalsContact NH2-CD 3.31Å; R72-F154 PolarHBondContact NH2-O 3.45Å
73G94.4Very high93.9Very high10 Ų1055.5 Ų55.510%0.10327%0.272CS..THydrogen-bonded Turntrans88.6-0.8-173.700000115.1W71 L75 A76W71-G73 PolarHBondContact O-N 3.08Å; W71-G73 VanDerWaalsContact O-N 3.14Å; G73-L75 VanDerWaalsContact C-N 3.3Å; G73-L75 PolarHBondContact O-N 3.22Å; G73-A76 PolarHBondContact O-N 2.92Å
74N96.3Very high93.7Very high15 Ų1548.4 Ų48.48%0.0824%0.243CC..Hα-helixtrans-66.6-28.4-176.9-171.251.4000114T24 A27 W71 A76 N77 V78T24-N74 PolarHBondContact OG1-ND2 3.41Å; A27-N74 HydrophobicContact CB-CB 4.2Å; W71-N74 HydrophobicContact CB-CB 4.09Å; W71-N74 WeakPolarHBondContact O-CB 3.19Å; W71-N74 PolarHBondContact O-N 3.12Å; N74-A76 PolarHBondContact O-N 3.42Å; N74-N77 WeakPolarHBondContact O-CA 3.32Å; N74-N77 VanDerWaalsContact O-CB 3.23Å; N74-N77 WeakPolarHBondContact O-CB 3.49Å; N74-N77 PolarHBondContact O-N 3.5Å; N74-N77 PolarHBondContact OD1-ND2 3.47Å; N74-V78 PolarHBondContact O-N 2.79Å
75L94.8Very high93.5Very high106 Ų10649 Ų4956%0.55525%0.246SC*.Hα-helixtrans-53.2-41.2177-18062000112.2G73 N77 V78 I79 L157G73-L75 VanDerWaalsContact C-N 3.3Å; G73-L75 PolarHBondContact O-N 3.22Å; L75-N77 PolarHBondContact O-N 2.9Å; L75-V78 PolarHBondContact O-N 3.46Å; L75-I79 HydrophobicContact CD1-CD1 3.88Å; L75-I79 HydrophobicContact CD1-CG1 4.22Å; L75-I79 HydrophobicContact CD2-CD1 4.39Å; L75-I79 HydrophobicContact CG-CD1 3.77Å; L75-I79 HydrophobicContact CG-CG1 4.46Å; L75-I79 WeakPolarHBondContact O-CG1 3.24Å; L75-I79 PolarHBondContact O-N 3.04Å; L75-L157 HydrophobicContact CD2-CB 4.33Å; L75-L157 HydrophobicContact CD2-CD2 4.26Å; L75-L157 HydrophobicContact CG-CD2 4.27Å
76A93.8Very high93.3Very high1 Ų150.8 Ų50.81%0.00826%0.263CS..Hα-helixtrans-62.6-30.3176.900000112.5G73 N74 R80 R138 L157G73-A76 PolarHBondContact O-N 2.92Å; N74-A76 PolarHBondContact O-N 3.42Å; A76-R80 WeakPolarHBondContact O-CB 3.3Å; A76-R80 PolarHBondContact O-N 3.08Å; A76-R138 HydrophobicContact CB-CB 3.78Å; A76-R138 HydrophobicContact CB-CG 4.35Å; A76-L157 HydrophobicContact CB-CD1 4.11Å; A76-L157 HydrophobicContact CB-CD2 4.28Å
77N89.3Confident93.2Very high9 Ų950.3 Ų50.35%0.04825%0.253CS..Hα-helixtrans-69-43.5178.8-58.3-30.4000112.5K23 N74 L75 R138K23-N77 HydrophobicContact CB-CB 4.11Å; K23-N77 HydrophobicContact CG-CB 4.4Å; N74-N77 WeakPolarHBondContact O-CA 3.32Å; N74-N77 VanDerWaalsContact O-CB 3.23Å; N74-N77 WeakPolarHBondContact O-CB 3.49Å; N74-N77 PolarHBondContact O-N 3.5Å; N74-N77 PolarHBondContact OD1-ND2 3.47Å; L75-N77 PolarHBondContact O-N 2.9Å; N77-R138 PolarHBondContact ND2-NE 3.25Å; N77-R138 PolarHBondContact ND2-NH2 3.44Å; N77-R138 WeakPolarHBondContact OD1-CD 3.41Å; N77-R138 WeakPolarHBondContact OD1-CG 3.37Å; N77-R138 PolarHBondContact OD1-NE 2.96Å; N77-R138 PolarHBondContact OD1-NH2 2.98Å
78V93.5Very high92.8Very high39 Ų3946.1 Ų46.124%0.23624%0.236CC..Hα-helixtrans-66.3-50179.9176.50000109A20 N74 L75 R80 Y81A20-V78 HydrophobicContact CB-CB 4.43Å; A20-V78 HydrophobicContact CB-CG1 3.74Å; A20-V78 HydrophobicContact CB-CG2 4.12Å; N74-V78 PolarHBondContact O-N 2.79Å; L75-V78 PolarHBondContact O-N 3.46Å; V78-R80 PolarHBondContact O-N 3.33Å; V78-Y81 PolarHBondContact O-N 2.68Å
79I94.6Very high92.3Very high70 Ų7046.1 Ų46.136%0.35923%0.231SC..Hα-helixtrans-62-43.5-179.8-66.7172.9000111.3L75 Y81 F82 P83 L134 L157L75-I79 HydrophobicContact CD1-CD1 3.88Å; L75-I79 HydrophobicContact CD1-CG1 4.22Å; L75-I79 HydrophobicContact CD2-CD1 4.39Å; L75-I79 HydrophobicContact CG-CD1 3.77Å; L75-I79 HydrophobicContact CG-CG1 4.46Å; L75-I79 WeakPolarHBondContact O-CG1 3.24Å; L75-I79 PolarHBondContact O-N 3.04Å; I79-Y81 PolarHBondContact O-N 3.1Å; I79-F82 PolarHBondContact O-N 3.26Å; I79-P83 WeakPolarHBondContact O-CD 3.47Å; I79-L134 HydrophobicContact CG2-CD1 4.01Å; I79-L157 HydrophobicContact CD1-CD2 3.9Å
80R92.4Very high92Very high58 Ų5848.2 Ų48.222%0.21925%0.248CC..Hα-helixtrans-58.2-27.1-172.8-173.5-179.774.781.81.4113.8A76 V78 P83 T84 V131 L134 D135A76-R80 WeakPolarHBondContact O-CB 3.3Å; A76-R80 PolarHBondContact O-N 3.08Å; V78-R80 PolarHBondContact O-N 3.33Å; R80-P83 WeakPolarHBondContact O-CD 3.49Å; R80-T84 VanDerWaalsContact O-CB 3.28Å; R80-T84 WeakPolarHBondContact O-CB 3.38Å; R80-T84 PolarHBondContact O-N 3.12Å; R80-T84 PolarHBondContact O-OG1 2.93Å; R80-V131 HydrophobicContact CG-CB 4.15Å; R80-V131 HydrophobicContact CG-CG2 4.26Å; R80-L134 HydrophobicContact CB-CD1 4.1Å; R80-L134 HydrophobicContact CG-CD1 4.46Å; R80-D135 WeakPolarHBondContact CD-OD1 3.17Å; R80-D135 IonicContact NE-OD1 3.99Å; R80-D135 PolarHBondContact NE-OD1 2.62Å
81Y89.8Confident91.7Very high52 Ų5251.2 Ų51.220%0.20426%0.262CS..Hα-helixtrans-57.5-53.6-179.5178.8-89.7000111.9G15 A19 V78 I79 T84 Q85G15-Y81 VanDerWaalsContact C-OH 3.26Å; G15-Y81 WeakPolarHBondContact CA-OH 3.18Å; G15-Y81 PolarHBondContact O-OH 3.4Å; A19-Y81 HydrophobicContact CB-CD2 3.25Å; A19-Y81 HydrophobicContact CB-CE2 3.51Å; A19-Y81 HydrophobicContact CB-CG 3.82Å; V78-Y81 PolarHBondContact O-N 2.68Å; I79-Y81 PolarHBondContact O-N 3.1Å; Y81-T84 PolarHBondContact O-N 3.03Å; Y81-Q85 HydrophobicContact CD1-CG 3.96Å; Y81-Q85 HydrophobicContact CD2-CG 4.16Å; Y81-Q85 HydrophobicContact CE1-CB 4.39Å; Y81-Q85 HydrophobicContact CE1-CG 3.52Å; Y81-Q85 HydrophobicContact CE2-CG 3.77Å; Y81-Q85 VanDerWaalsContact CE2-NE2 3.34Å; Y81-Q85 HydrophobicContact CG-CG 4.27Å; Y81-Q85 VanDerWaalsContact CZ-CG 3.43Å; Y81-Q85 WeakPolarHBondContact O-CG 3.39Å; Y81-Q85 PolarHBondContact O-N 3.36Å
82F90.4Very high91.1Very high68 Ų6851.6 Ų51.630%0.29827%0.265SS..Hα-helixtrans-58.4-54.6-173.5-60.3-76.3000114.1F12 I79 T84 Q85 A86F12-F82 HydrophobicContact CD1-CD1 4.29Å; F12-F82 HydrophobicContact CE1-CB 4.49Å; F12-F82 AromaticContact CE1-CD1 3.53Å; F12-F82 HydrophobicContact CE1-CD1 3.53Å; F12-F82 HydrophobicContact CE1-CE1 4.27Å; F12-F82 HydrophobicContact CE1-CG 4.48Å; F12-F82 HydrophobicContact CZ-CB 4.08Å; F12-F82 AromaticContact CZ-CD1 3.79Å; F12-F82 HydrophobicContact CZ-CD1 3.79Å; F12-F82 HydrophobicContact CZ-CG 4.45Å; I79-F82 PolarHBondContact O-N 3.26Å; F82-T84 VanDerWaalsContact C-N 3.31Å; F82-T84 PolarHBondContact O-N 2.9Å; F82-Q85 PolarHBondContact O-N 3.09Å; F82-A86 PolarHBondContact O-N 2.84Å
83P92.9Very high90.7Very high45 Ų4554.3 Ų54.329%0.29228%0.283SS..Hα-helixtrans-66.1-34.2178.327.2-33.2000111.8I79 R80 Q85 A86 L87 V131 L134I79-P83 WeakPolarHBondContact O-CD 3.47Å; R80-P83 WeakPolarHBondContact O-CD 3.49Å; P83-Q85 VanDerWaalsContact C-N 3.34Å; P83-Q85 PolarHBondContact O-N 2.94Å; P83-A86 PolarHBondContact O-N 3.24Å; P83-L87 WeakPolarHBondContact O-CB 3.49Å; P83-L87 WeakPolarHBondContact O-CD1 3.37Å; P83-L87 WeakPolarHBondContact O-CG 3.2Å; P83-L87 PolarHBondContact O-N 2.7Å; P83-V131 HydrophobicContact CB-CG1 3.83Å; P83-V131 HydrophobicContact CG-CG1 3.74Å; P83-L134 HydrophobicContact CG-CD1 4.41Å
84T90.1Very high90.7Very high20 Ų2060.6 Ų60.612%0.12331%0.308CS..Hα-helixtrans-63.2-42.4175.8-55.80000111R80 Y81 F82 L87 N88R80-T84 VanDerWaalsContact O-CB 3.28Å; R80-T84 WeakPolarHBondContact O-CB 3.38Å; R80-T84 PolarHBondContact O-N 3.12Å; R80-T84 PolarHBondContact O-OG1 2.93Å; Y81-T84 PolarHBondContact O-N 3.03Å; F82-T84 VanDerWaalsContact C-N 3.31Å; F82-T84 PolarHBondContact O-N 2.9Å; T84-L87 PolarHBondContact O-N 3.02Å; T84-N88 WeakPolarHBondContact O-CB 3.22Å; T84-N88 VanDerWaalsContact O-CG 3.28Å; T84-N88 PolarHBondContact O-N 3.05Å; T84-N88 PolarHBondContact O-ND2 3.12Å
85Q87.8Confident90.5Very high67 Ų6762.1 Ų62.131%0.31331%0.313SS..Hα-helixtrans-70.7-38.7178.7-68.8-55.4-500112.7F12 Y81 F82 P83 L87 N88 F89F12-Q85 HydrophobicContact CD2-CB 4.29Å; F12-Q85 HydrophobicContact CE2-CB 3.67Å; Y81-Q85 HydrophobicContact CD1-CG 3.96Å; Y81-Q85 HydrophobicContact CD2-CG 4.16Å; Y81-Q85 HydrophobicContact CE1-CB 4.39Å; Y81-Q85 HydrophobicContact CE1-CG 3.52Å; Y81-Q85 HydrophobicContact CE2-CG 3.77Å; Y81-Q85 VanDerWaalsContact CE2-NE2 3.34Å; Y81-Q85 HydrophobicContact CG-CG 4.27Å; Y81-Q85 VanDerWaalsContact CZ-CG 3.43Å; Y81-Q85 WeakPolarHBondContact O-CG 3.39Å; Y81-Q85 PolarHBondContact O-N 3.36Å; F82-Q85 PolarHBondContact O-N 3.09Å; P83-Q85 VanDerWaalsContact C-N 3.34Å; P83-Q85 PolarHBondContact O-N 2.94Å; Q85-L87 VanDerWaalsContact C-N 3.32Å; Q85-L87 PolarHBondContact O-N 2.87Å; Q85-N88 PolarHBondContact O-N 3.01Å; Q85-F89 WeakPolarHBondContact O-CB 3.37Å; Q85-F89 PolarHBondContact O-N 3.32Å
86A89.9Confident90.3Very high53 Ų5361.2 Ų61.244%0.43830%0.304SS..Hα-helixtrans-58.5-44.9173.200000111.5F82 P83 F89 A90F82-A86 PolarHBondContact O-N 2.84Å; P83-A86 PolarHBondContact O-N 3.24Å; A86-F89 PolarHBondContact O-N 2.92Å; A86-A90 PolarHBondContact O-N 2.76Å
87L91.1Very high90.3Very high24 Ų2467.8 Ų67.813%0.12633%0.333CS..Hα-helixtrans-68-40.1177.3-67.6165.2000112.2P83 T84 Q85 F89 A90 F91 F130 V131P83-L87 WeakPolarHBondContact O-CB 3.49Å; P83-L87 WeakPolarHBondContact O-CD1 3.37Å; P83-L87 WeakPolarHBondContact O-CG 3.2Å; P83-L87 PolarHBondContact O-N 2.7Å; T84-L87 PolarHBondContact O-N 3.02Å; Q85-L87 VanDerWaalsContact C-N 3.32Å; Q85-L87 PolarHBondContact O-N 2.87Å; L87-F89 VanDerWaalsContact C-N 3.33Å; L87-F89 PolarHBondContact O-N 3Å; L87-A90 PolarHBondContact O-N 2.98Å; L87-F91 HydrophobicContact CB-CD2 4.47Å; L87-F91 HydrophobicContact CD2-CD2 4.15Å; L87-F91 HydrophobicContact CD2-CE2 3.78Å; L87-F91 WeakPolarHBondContact O-CB 3.39Å; L87-F91 VanDerWaalsContact O-CD2 3.31Å; L87-F91 WeakPolarHBondContact O-CD2 3.2Å; L87-F91 PolarHBondContact O-N 3.34Å; L87-F130 HydrophobicContact CD1-CB 3.73Å; L87-F130 HydrophobicContact CD1-CD2 3.7Å; L87-F130 HydrophobicContact CD1-CG 3.96Å; L87-F130 HydrophobicContact CD2-CD2 3.77Å; L87-F130 HydrophobicContact CD2-CE2 3.96Å; L87-F130 HydrophobicContact CD2-CG 4.37Å; L87-F130 HydrophobicContact CG-CD2 4.42Å; L87-V131 HydrophobicContact CD1-CG1 4.31Å
88N86.6Confident90.6Very high42 Ų4272.9 Ų72.923%0.22536%0.359CS..Hα-helixtrans-60.2-45.1173.8-79.1-31.3000111.3T84 Q85 A90 F91 K92T84-N88 WeakPolarHBondContact O-CB 3.22Å; T84-N88 VanDerWaalsContact O-CG 3.28Å; T84-N88 PolarHBondContact O-N 3.05Å; T84-N88 PolarHBondContact O-ND2 3.12Å; Q85-N88 PolarHBondContact O-N 3.01Å; N88-A90 VanDerWaalsContact C-N 3.31Å; N88-A90 PolarHBondContact O-N 3.42Å; N88-F91 PolarHBondContact O-N 3.2Å; N88-K92 WeakPolarHBondContact O-CB 3.38Å; N88-K92 PolarHBondContact O-N 3.39Å
89F85.3Confident90.6Very high142 Ų14274 Ų7462%0.62336%0.361SS*.Hα-helixtrans-60.5-42.1177.1-178-100.6000111.6F8 Q85 A86 L87F8-F89 AromaticContact CE2-CD2 3.94Å; F8-F89 HydrophobicContact CE2-CD2 3.94Å; F8-F89 AromaticContact CE2-CE2 3.86Å; F8-F89 HydrophobicContact CE2-CE2 3.86Å; F8-F89 HydrophobicContact CE2-CG 4.39Å; F8-F89 HydrophobicContact CE2-CZ 4.24Å; F8-F89 HydrophobicContact CZ-CD2 4.44Å; F8-F89 HydrophobicContact CZ-CG 4.45Å; Q85-F89 WeakPolarHBondContact O-CB 3.37Å; Q85-F89 PolarHBondContact O-N 3.32Å; A86-F89 PolarHBondContact O-N 2.92Å; L87-F89 VanDerWaalsContact C-N 3.33Å; L87-F89 PolarHBondContact O-N 3Å
90A89.5Confident90.5Very high52 Ų5272 Ų7243%0.4335%0.35SS..Hα-helixtrans-69.3-41.1179.700000113.9A86 L87 N88A86-A90 PolarHBondContact O-N 2.76Å; L87-A90 PolarHBondContact O-N 2.98Å; N88-A90 VanDerWaalsContact C-N 3.31Å; N88-A90 PolarHBondContact O-N 3.42Å
91F90.2Very high90.6Very high76 Ų7674.6 Ų74.633%0.33337%0.368SS..Hα-helixtrans-114.5-24.2-164.4-65.7-72.5000115.5L87 N88 D93 K94 Y95 T126L87-F91 HydrophobicContact CB-CD2 4.47Å; L87-F91 HydrophobicContact CD2-CD2 4.15Å; L87-F91 HydrophobicContact CD2-CE2 3.78Å; L87-F91 WeakPolarHBondContact O-CB 3.39Å; L87-F91 VanDerWaalsContact O-CD2 3.31Å; L87-F91 WeakPolarHBondContact O-CD2 3.2Å; L87-F91 PolarHBondContact O-N 3.34Å; N88-F91 PolarHBondContact O-N 3.2Å; F91-D93 PolarHBondContact O-N 2.89Å; F91-K94 PolarHBondContact O-N 3.24Å; F91-Y95 HydrophobicContact CB-CD2 4Å; F91-Y95 HydrophobicContact CB-CE2 3.74Å; F91-Y95 HydrophobicContact CG-CE2 4.41Å; F91-Y95 WeakPolarHBondContact O-CD2 3.44Å; F91-Y95 PolarHBondContact O-N 3.25Å; F91-T126 HydrophobicContact CD1-CG2 4.47Å; F91-T126 HydrophobicContact CD2-CG2 3.85Å; F91-T126 HydrophobicContact CE2-CG2 4.05Å; F91-T126 HydrophobicContact CG-CG2 4.09Å; F91-T126 HydrophobicContact CZ-CG2 4.44Å
92K84.9Confident90.6Very high89 Ų8975.6 Ų75.639%0.38740%0.395SS..Hα-helixtrans-60.8-46.8-171.2-176-178.9179.2-174.70112.1N88 Y95 K96N88-K92 WeakPolarHBondContact O-CB 3.38Å; N88-K92 PolarHBondContact O-N 3.39Å; K92-Y95 PolarHBondContact O-N 2.74Å; K92-K96 WeakPolarHBondContact O-CG 3.23Å; K92-K96 PolarHBondContact O-N 3.01Å
93D88.2Confident90.6Very high102 Ų10273.5 Ų73.555%0.54539%0.387SS..Hα-helixtrans-75-30.7-178.3-64.6-29.9000112F91 K96 K97F91-D93 PolarHBondContact O-N 2.89Å; D93-K96 PolarHBondContact O-N 3.18Å; D93-K96 IonicContact OD1-NZ 3.74Å; D93-K97 WeakPolarHBondContact O-CB 3.18Å; D93-K97 PolarHBondContact O-N 3.06Å
94K92.9Very high90.3Very high143 Ų14375.1 Ų75.162%0.62239%0.394SS*.Hα-helixtrans-60.7-48.2170.5-64.5-65.2-174.3179.40111.2F91 K97 I98F91-K94 PolarHBondContact O-N 3.24Å; K94-K97 PolarHBondContact O-N 3.05Å; K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.41Å; K94-I98 PolarHBondContact O-N 3.46Å
95Y93.4Very high90.1Very high46 Ų4678.3 Ų78.318%0.1841%0.406CS..Hα-helixtrans-66.9-39.3177.1-72.4-51.8000112.7F91 K92 K97 I98 F99 A122 A123 T126F91-Y95 HydrophobicContact CB-CD2 4Å; F91-Y95 HydrophobicContact CB-CE2 3.74Å; F91-Y95 HydrophobicContact CG-CE2 4.41Å; F91-Y95 WeakPolarHBondContact O-CD2 3.44Å; F91-Y95 PolarHBondContact O-N 3.25Å; K92-Y95 PolarHBondContact O-N 2.74Å; Y95-K97 VanDerWaalsContact C-N 3.31Å; Y95-K97 PolarHBondContact O-N 3.4Å; Y95-I98 HydrophobicContact CD1-CD1 4.36Å; Y95-I98 PolarHBondContact O-N 2.87Å; Y95-F99 HydrophobicContact CD1-CD2 4.44Å; Y95-F99 AromaticContact CD1-CE2 3.79Å; Y95-F99 HydrophobicContact CD1-CE2 3.79Å; Y95-F99 HydrophobicContact CG-CE2 4.46Å; Y95-F99 WeakPolarHBondContact O-CD2 3.5Å; Y95-F99 PolarHBondContact O-N 3.39Å; Y95-A122 HydrophobicContact CD1-CB 3.75Å; Y95-A122 HydrophobicContact CD2-CB 4.21Å; Y95-A122 HydrophobicContact CE1-CB 3.75Å; Y95-A122 HydrophobicContact CE2-CB 4.18Å; Y95-A122 HydrophobicContact CG-CB 4Å; Y95-A123 HydrophobicContact CD2-CB 3.81Å; Y95-A123 HydrophobicContact CE2-CB 4.38Å; Y95-T126 PolarHBondContact OH-OG1 2.92Å
96K90.8Very high89.9Confident87 Ų8786.5 Ų86.538%0.37843%0.434SS..Hα-helixtrans-57.6-46.6172.4-77.1178174.8-179.30111.1K92 D93 F99 L100 S119K92-K96 WeakPolarHBondContact O-CG 3.23Å; K92-K96 PolarHBondContact O-N 3.01Å; D93-K96 PolarHBondContact O-N 3.18Å; D93-K96 IonicContact OD1-NZ 3.74Å; K96-F99 PolarHBondContact O-N 3.08Å; K96-L100 WeakPolarHBondContact O-CA 3.48Å; K96-L100 VanDerWaalsContact O-CB 3.22Å; K96-L100 WeakPolarHBondContact O-CB 3.36Å; K96-L100 PolarHBondContact O-N 3.24Å; K96-S119 WeakPolarHBondContact CA-OG 3.47Å; K96-S119 PolarHBondContact N-OG 3.35Å
97K93.2Very high89.9Confident139 Ų13989.1 Ų89.160%0.60444%0.444SS*.Hα-helixtrans-59.9-49.3176.1-167.1173.7-177.41750111.2D93 K94 Y95 F99 D101D93-K97 WeakPolarHBondContact O-CB 3.18Å; D93-K97 PolarHBondContact O-N 3.06Å; K94-K97 PolarHBondContact O-N 3.05Å; Y95-K97 VanDerWaalsContact C-N 3.31Å; Y95-K97 PolarHBondContact O-N 3.4Å; K97-F99 VanDerWaalsContact C-N 3.3Å; K97-F99 PolarHBondContact O-N 2.59Å; K97-D101 WeakPolarHBondContact CE-OD2 3.37Å; K97-D101 HydrophobicContact CG-CB 4.02Å; K97-D101 WeakPolarHBondContact O-CB 3.47Å; K97-D101 PolarHBondContact O-N 3.03Å; K97-D101 VanDerWaalsContact O-N 3.09Å
98I95.3Very high89.8Confident117 Ų11792.3 Ų92.360%0.646%0.459SS*.Hα-helixtrans-57.6-41-179.7-68.9163.7000112.7K94 Y95K94-I98 VanDerWaalsContact O-CG1 3.27Å; K94-I98 WeakPolarHBondContact O-CG1 3.41Å; K94-I98 PolarHBondContact O-N 3.46Å; Y95-I98 HydrophobicContact CD1-CD1 4.36Å; Y95-I98 PolarHBondContact O-N 2.87Å
99F93Very high89.9Confident63 Ų6394.3 Ų94.328%0.27647%0.466SS..Hα-helixtrans-102.3-18.2-170.4-65-66.6000115.5Y95 K96 K97 R111 G115 A118 S119 A122Y95-F99 HydrophobicContact CD1-CD2 4.44Å; Y95-F99 AromaticContact CD1-CE2 3.79Å; Y95-F99 HydrophobicContact CD1-CE2 3.79Å; Y95-F99 HydrophobicContact CG-CE2 4.46Å; Y95-F99 WeakPolarHBondContact O-CD2 3.5Å; Y95-F99 PolarHBondContact O-N 3.39Å; K96-F99 PolarHBondContact O-N 3.08Å; K97-F99 VanDerWaalsContact C-N 3.3Å; K97-F99 PolarHBondContact O-N 2.59Å; F99-R111 PolarHBondContact O-NH1 2.94Å; F99-G115 WeakPolarHBondContact CB-O 3.47Å; F99-A118 HydrophobicContact CD1-CB 3.76Å; F99-A118 HydrophobicContact CD2-CB 4.31Å; F99-A118 HydrophobicContact CE1-CB 3.96Å; F99-A118 HydrophobicContact CE2-CB 4.48Å; F99-A118 HydrophobicContact CG-CB 3.96Å; F99-A118 HydrophobicContact CZ-CB 4.32Å; F99-S119 VanDerWaalsContact CD2-CA 3.47Å; F99-A122 HydrophobicContact CE2-CB 3.95Å
100L93Very high90.1Very high27 Ų2796.8 Ų96.814%0.14147%0.471CS..Hα-helixtrans-127-4.5-173.2-62.6171.8000114.2K96 G102 V103 Y112 N116K96-L100 WeakPolarHBondContact O-CA 3.48Å; K96-L100 VanDerWaalsContact O-CB 3.22Å; K96-L100 WeakPolarHBondContact O-CB 3.36Å; K96-L100 PolarHBondContact O-N 3.24Å; L100-G102 PolarHBondContact O-N 3.33Å; L100-V103 PolarHBondContact O-N 2.87Å; L100-V103 VanDerWaalsContact O-N 3.12Å; L100-Y112 HydrophobicContact CD1-CE2 4.42Å; L100-Y112 HydrophobicContact CD2-CD2 3.86Å; L100-Y112 HydrophobicContact CD2-CE2 4.12Å; L100-Y112 HydrophobicContact CD2-CG 4.37Å; L100-Y112 WeakPolarHBondContact CD2-O 2.94Å; L100-N116 HydrophobicContact CD1-CB 4.33Å; L100-N116 HydrophobicContact CD2-CB 4.39Å
101D93.6Very high90.3Very high112 Ų112100.4 Ų100.460%0.59947%0.473SS*.THydrogen-bonded Turntrans-62131.9176.3-164.216.9000110.4K97 V103K97-D101 WeakPolarHBondContact CE-OD2 3.37Å; K97-D101 HydrophobicContact CG-CB 4.02Å; K97-D101 WeakPolarHBondContact O-CB 3.47Å; K97-D101 PolarHBondContact O-N 3.03Å; K97-D101 VanDerWaalsContact O-N 3.09Å; D101-V103 VanDerWaalsContact C-N 3.27Å; D101-V103 PolarHBondContact O-N 3.33Å
102G90.2Very high90.3Very high73 Ų7399.8 Ų99.875%0.75347%0.469SS*.THydrogen-bonded Turntrans70.67.4-174.300000116.7L100L100-G102 PolarHBondContact O-N 3.33Å
103V90.4Very high90.5Very high24 Ų2497.4 Ų97.415%0.14546%0.459CS..  trans-98.3117.3179.2-176.10000111.2L100 D101 Q108 R111 Y112L100-V103 PolarHBondContact O-N 2.87Å; L100-V103 VanDerWaalsContact O-N 3.12Å; D101-V103 VanDerWaalsContact C-N 3.27Å; D101-V103 PolarHBondContact O-N 3.33Å; V103-Q108 HydrophobicContact CG1-CB 4.33Å; V103-R111 HydrophobicContact CG1-CB 4.13Å; V103-R111 HydrophobicContact CG1-CG 3.82Å; V103-R111 HydrophobicContact CG2-CG 4Å; V103-Y112 HydrophobicContact CG1-CD2 4.39Å
104D88.1Confident90.7Very high79 Ų7995 Ų9542%0.42245%0.454SS..  trans-86.4122.4175.9-173.3-24000111.2R106 T107 Q108D104-R106 VanDerWaalsContact C-N 3.26Å; D104-R106 PolarHBondContact O-N 3.25Å; D104-R106 WeakPolarHBondContact OD1-CB 3.25Å; D104-R106 PolarHBondContact OD1-N 3.13Å; D104-T107 WeakPolarHBondContact CB-OG1 3.49Å; D104-Q108 WeakPolarHBondContact O-CA 3.4Å; D104-Q108 WeakPolarHBondContact O-CB 3.46Å; D104-Q108 PolarHBondContact O-N 3.39Å
105K84.8Confident90.7Very high88 Ų8888.3 Ų88.338%0.38343%0.425SS..THydrogen-bonded Turntrans-60.5-32.3178.8-177.6176.5179.7178.20112.7Y112 D196K105-Y112 HydrophobicContact CB-CD1 4.29Å; K105-Y112 HydrophobicContact CB-CD2 3.91Å; K105-Y112 HydrophobicContact CB-CE1 4.47Å; K105-Y112 HydrophobicContact CB-CE2 4.1Å; K105-Y112 HydrophobicContact CB-CG 4.01Å; K105-Y112 HydrophobicContact CD-CD1 4.22Å; K105-Y112 HydrophobicContact CD-CE1 3.85Å; K105-Y112 HydrophobicContact CG-CD1 3.89Å; K105-Y112 HydrophobicContact CG-CD2 4.42Å; K105-Y112 HydrophobicContact CG-CE1 4.03Å; K105-Y112 HydrophobicContact CG-CG 4.1Å; K105-D196 IonicContact NZ-OD1 3.95Å; K105-D196 PolarHBondContact NZ-OD1 3.04Å; K105-D196 VanDerWaalsContact NZ-OD1 3.1Å; K105-D196 IonicContact NZ-OD2 3.35Å
106R83.2Confident90.5Very high238 Ų23886.7 Ų86.790%0.89842%0.419SS*.THydrogen-bonded Turntrans-80-38-173.4-63.5-174.4178.9-167.71.1112.6D104D104-R106 VanDerWaalsContact C-N 3.26Å; D104-R106 PolarHBondContact O-N 3.25Å; D104-R106 WeakPolarHBondContact OD1-CB 3.25Å; D104-R106 PolarHBondContact OD1-N 3.13Å
107T89.5Confident90.6Very high108 Ų10883.8 Ų83.866%0.66341%0.408SS*.THydrogen-bonded Turntrans-96.8-26.8-177.159.10000112.6D104D104-T107 WeakPolarHBondContact CB-OG1 3.49Å
108Q90.1Very high90.6Very high91 Ų9179 Ų7943%0.42539%0.394SS..  trans-125.354.7-172.8-56.6178.4-55.200112.6V103 D104 W110 R111 Y112V103-Q108 HydrophobicContact CG1-CB 4.33Å; D104-Q108 WeakPolarHBondContact O-CA 3.4Å; D104-Q108 WeakPolarHBondContact O-CB 3.46Å; D104-Q108 PolarHBondContact O-N 3.39Å; Q108-W110 PolarHBondContact O-N 2.9Å; Q108-R111 HydrophobicContact CB-CB 4.03Å; Q108-R111 PolarHBondContact O-N 3.29Å; Q108-R111 VanDerWaalsContact O-N 3.13Å; Q108-Y112 PolarHBondContact O-N 3.34Å
109F88.5Confident90.4Very high84 Ų8473.7 Ų73.737%0.36837%0.368SS..Hα-helixtrans-48.7-52.9-175.3177.1-96.7000113.9R111 Y112 F113F109-R111 PolarHBondContact O-N 2.93Å; F109-Y112 PolarHBondContact O-N 3.06Å; F109-F113 WeakPolarHBondContact O-CB 3.48Å; F109-F113 PolarHBondContact O-N 3.39Å
110W90.1Very high90.2Very high194 Ų19470.7 Ų70.774%0.73535%0.354SS*.Hα-helixtrans-67.1-35-177.3-70.2117.6000113.3Q108 F113 A114Q108-W110 PolarHBondContact O-N 2.9Å; W110-F113 HydrophobicContact CE3-CD1 4.26Å; W110-F113 HydrophobicContact CZ3-CD1 4.27Å; W110-F113 PolarHBondContact O-N 2.91Å; W110-A114 WeakPolarHBondContact O-CB 3.42Å; W110-A114 PolarHBondContact O-N 2.71Å
111R91.9Very high90.2Very high128 Ų12869.7 Ų69.748%0.48335%0.35SS..Hα-helixtrans-67.6-42175.5-177.362.7179.192.80.4111F99 V103 Q108 F109 G115F99-R111 PolarHBondContact O-NH1 2.94Å; V103-R111 HydrophobicContact CG1-CB 4.13Å; V103-R111 HydrophobicContact CG1-CG 3.82Å; V103-R111 HydrophobicContact CG2-CG 4Å; Q108-R111 HydrophobicContact CB-CB 4.03Å; Q108-R111 PolarHBondContact O-N 3.29Å; Q108-R111 VanDerWaalsContact O-N 3.13Å; F109-R111 PolarHBondContact O-N 2.93Å; R111-G115 PolarHBondContact O-N 2.91Å
112Y90.4Very high90.2Very high63 Ų6365.4 Ų65.425%0.24733%0.331CS..Hα-helixtrans-63.7-46.4174.8-178.3-91.2000111L100 V103 K105 Q108 F109 G115 N116L100-Y112 HydrophobicContact CD1-CE2 4.42Å; L100-Y112 HydrophobicContact CD2-CD2 3.86Å; L100-Y112 HydrophobicContact CD2-CE2 4.12Å; L100-Y112 HydrophobicContact CD2-CG 4.37Å; L100-Y112 WeakPolarHBondContact CD2-O 2.94Å; V103-Y112 HydrophobicContact CG1-CD2 4.39Å; K105-Y112 HydrophobicContact CB-CD1 4.29Å; K105-Y112 HydrophobicContact CB-CD2 3.91Å; K105-Y112 HydrophobicContact CB-CE1 4.47Å; K105-Y112 HydrophobicContact CB-CE2 4.1Å; K105-Y112 HydrophobicContact CB-CG 4.01Å; K105-Y112 HydrophobicContact CD-CD1 4.22Å; K105-Y112 HydrophobicContact CD-CE1 3.85Å; K105-Y112 HydrophobicContact CG-CD1 3.89Å; K105-Y112 HydrophobicContact CG-CD2 4.42Å; K105-Y112 HydrophobicContact CG-CE1 4.03Å; K105-Y112 HydrophobicContact CG-CG 4.1Å; Q108-Y112 PolarHBondContact O-N 3.34Å; F109-Y112 PolarHBondContact O-N 3.06Å; Y112-G115 PolarHBondContact O-N 3.26Å; Y112-N116 HydrophobicContact CE1-CB 4.49Å; Y112-N116 VanDerWaalsContact O-CB 3.23Å; Y112-N116 WeakPolarHBondContact O-CB 3.31Å; Y112-N116 PolarHBondContact O-N 3.05Å
113F89.6Confident90.2Very high40 Ų4062.2 Ų62.218%0.17530%0.297CS..Hα-helixtrans-58.9-52.2178.2-176.3-103.5000111.2F109 W110 G115 N116 L117 A189 F192F109-F113 WeakPolarHBondContact O-CB 3.48Å; F109-F113 PolarHBondContact O-N 3.39Å; W110-F113 HydrophobicContact CE3-CD1 4.26Å; W110-F113 HydrophobicContact CZ3-CD1 4.27Å; W110-F113 PolarHBondContact O-N 2.91Å; F113-G115 PolarHBondContact O-N 3.45Å; F113-N116 PolarHBondContact O-N 3.48Å; F113-L117 HydrophobicContact CD1-CD1 4Å; F113-L117 HydrophobicContact CD1-CG 4.45Å; F113-L117 HydrophobicContact CE1-CD1 3.48Å; F113-L117 VanDerWaalsContact CE1-CD1 3.48Å; F113-L117 HydrophobicContact CE1-CG 4.21Å; F113-L117 HydrophobicContact CZ-CD1 3.86Å; F113-L117 HydrophobicContact CZ-CD2 4.43Å; F113-L117 HydrophobicContact CZ-CG 4.32Å; F113-L117 WeakPolarHBondContact O-CG 3.39Å; F113-L117 PolarHBondContact O-N 3.28Å; F113-A189 HydrophobicContact CZ-CB 3.99Å; F113-F192 HydrophobicContact CE2-CB 4.19Å
114A92.7Very high90.2Very high52 Ų5261.7 Ų61.743%0.4330%0.297SS..Hα-helixtrans-60.1-43.917700000112.4W110 N116 L117 A118W110-A114 WeakPolarHBondContact O-CB 3.42Å; W110-A114 PolarHBondContact O-N 2.71Å; A114-N116 VanDerWaalsContact C-N 3.33Å; A114-N116 PolarHBondContact O-N 3.09Å; A114-L117 PolarHBondContact O-N 3.1Å; A114-A118 WeakPolarHBondContact O-CB 3.49Å; A114-A118 PolarHBondContact O-N 3.17Å
115G92.8Very high90.5Very high1 Ų159 Ų591%0.0129%0.285CS..Hα-helixtrans-63.1-37.4177.100000112.9F99 R111 Y112 F113 A118 S119F99-G115 WeakPolarHBondContact CB-O 3.47Å; R111-G115 PolarHBondContact O-N 2.91Å; Y112-G115 PolarHBondContact O-N 3.26Å; F113-G115 PolarHBondContact O-N 3.45Å; G115-A118 PolarHBondContact O-N 2.88Å; G115-S119 WeakPolarHBondContact O-CB 3.14Å; G115-S119 PolarHBondContact O-N 2.88Å
116N89.8Confident91Very high13 Ų1356 Ų567%0.0727%0.274CS..Hα-helixtrans-72.3-36.5177.9-177.452.2000111.8L100 Y112 F113 A114 G120 F192L100-N116 HydrophobicContact CD1-CB 4.33Å; L100-N116 HydrophobicContact CD2-CB 4.39Å; Y112-N116 HydrophobicContact CE1-CB 4.49Å; Y112-N116 VanDerWaalsContact O-CB 3.23Å; Y112-N116 WeakPolarHBondContact O-CB 3.31Å; Y112-N116 PolarHBondContact O-N 3.05Å; F113-N116 PolarHBondContact O-N 3.48Å; A114-N116 VanDerWaalsContact C-N 3.33Å; A114-N116 PolarHBondContact O-N 3.09Å; N116-G120 PolarHBondContact O-N 3.43Å; N116-F192 WeakPolarHBondContact ND2-CD2 3.31Å; N116-F192 WeakPolarHBondContact ND2-CE2 3.46Å; N116-F192 WeakPolarHBondContact ND2-CZ 3.48Å
117L91.9Very high91.4Very high25 Ų2545 Ų4513%0.13123%0.234CC..Hα-helixtrans-64.5-45.6170.4-66.2-173.1000111.9F113 A114 G120 G121 R188 A189F113-L117 HydrophobicContact CD1-CD1 4Å; F113-L117 HydrophobicContact CD1-CG 4.45Å; F113-L117 HydrophobicContact CE1-CD1 3.48Å; F113-L117 VanDerWaalsContact CE1-CD1 3.48Å; F113-L117 HydrophobicContact CE1-CG 4.21Å; F113-L117 HydrophobicContact CZ-CD1 3.86Å; F113-L117 HydrophobicContact CZ-CD2 4.43Å; F113-L117 HydrophobicContact CZ-CG 4.32Å; F113-L117 WeakPolarHBondContact O-CG 3.39Å; F113-L117 PolarHBondContact O-N 3.28Å; A114-L117 PolarHBondContact O-N 3.1Å; L117-G120 PolarHBondContact O-N 3.07Å; L117-G121 PolarHBondContact O-N 2.88Å; L117-R188 HydrophobicContact CD2-CB 3.85Å; L117-A189 HydrophobicContact CD1-CB 3.96Å; L117-A189 HydrophobicContact CD2-CB 3.85Å
118A93.4Very high91.6Very high39 Ų3940.5 Ų40.532%0.32221%0.206SC..Hα-helixtrans-64.2-48.4178.300000111.7F99 A114 G115 G120 G121 A122F99-A118 HydrophobicContact CD1-CB 3.76Å; F99-A118 HydrophobicContact CD2-CB 4.31Å; F99-A118 HydrophobicContact CE1-CB 3.96Å; F99-A118 HydrophobicContact CE2-CB 4.48Å; F99-A118 HydrophobicContact CG-CB 3.96Å; F99-A118 HydrophobicContact CZ-CB 4.32Å; A114-A118 WeakPolarHBondContact O-CB 3.49Å; A114-A118 PolarHBondContact O-N 3.17Å; G115-A118 PolarHBondContact O-N 2.88Å; A118-G120 VanDerWaalsContact C-N 3.27Å; A118-G120 PolarHBondContact O-N 2.64Å; A118-G121 PolarHBondContact O-N 3.21Å; A118-A122 VanDerWaalsContact O-CB 3.24Å; A118-A122 WeakPolarHBondContact O-CB 3.39Å; A118-A122 PolarHBondContact O-N 3.41Å
119S92.1Very high91.9Very high6 Ų639.1 Ų39.14%0.04221%0.206CC..Hα-helixtrans-55.6-45.7174178.60000111.3K96 F99 G115 A123K96-S119 WeakPolarHBondContact CA-OG 3.47Å; K96-S119 PolarHBondContact N-OG 3.35Å; F99-S119 VanDerWaalsContact CD2-CA 3.47Å; G115-S119 WeakPolarHBondContact O-CB 3.14Å; G115-S119 PolarHBondContact O-N 2.88Å; S119-A123 VanDerWaalsContact O-CB 3.32Å; S119-A123 WeakPolarHBondContact O-CB 3.36Å; S119-A123 PolarHBondContact O-N 3.26Å
120G88.4Confident92.2Very high0 Ų041.4 Ų41.40%022%0.215CC..Hα-helixtrans-69.2-42.9-179.600000114.5N116 L117 A118 G124 R188N116-G120 PolarHBondContact O-N 3.43Å; L117-G120 PolarHBondContact O-N 3.07Å; A118-G120 VanDerWaalsContact C-N 3.27Å; A118-G120 PolarHBondContact O-N 2.64Å; G120-G124 PolarHBondContact O-N 3.41Å; G120-R188 PolarHBondContact O-NH1 3.16Å
121G91.6Very high92.4Very high5 Ų532.3 Ų32.35%0.05218%0.182CC..Hα-helixtrans-64-45.6176.500000111.4L117 A118 G124 A125L117-G121 PolarHBondContact O-N 2.88Å; A118-G121 PolarHBondContact O-N 3.21Å; G121-G124 PolarHBondContact O-N 3.09Å; G121-A125 VanDerWaalsContact O-CB 3.31Å; G121-A125 WeakPolarHBondContact O-CB 3.49Å; G121-A125 PolarHBondContact O-N 3.04Å
122A93.7Very high92.7Very high23 Ų2326.2 Ų26.219%0.1916%0.159CC..Hα-helixtrans-63-49.6177.600000111.9Y95 F99 A118 G124 A125 T126Y95-A122 HydrophobicContact CD1-CB 3.75Å; Y95-A122 HydrophobicContact CD2-CB 4.21Å; Y95-A122 HydrophobicContact CE1-CB 3.75Å; Y95-A122 HydrophobicContact CE2-CB 4.18Å; Y95-A122 HydrophobicContact CG-CB 4Å; F99-A122 HydrophobicContact CE2-CB 3.95Å; A118-A122 VanDerWaalsContact O-CB 3.24Å; A118-A122 WeakPolarHBondContact O-CB 3.39Å; A118-A122 PolarHBondContact O-N 3.41Å; A122-G124 VanDerWaalsContact C-N 3.28Å; A122-G124 PolarHBondContact O-N 3.16Å; A122-A125 PolarHBondContact O-N 2.96Å; A122-T126 WeakPolarHBondContact O-CB 3.41Å; A122-T126 PolarHBondContact O-N 2.96Å; A122-T126 PolarHBondContact O-OG1 3.02Å; A122-T126 VanDerWaalsContact O-OG1 3.05Å
123A91Very high93Very high6 Ų624.1 Ų24.15%0.0515%0.152CC..Hα-helixtrans-59.7-39.8176.600000112.5Y95 S119 S127Y95-A123 HydrophobicContact CD2-CB 3.81Å; Y95-A123 HydrophobicContact CE2-CB 4.38Å; S119-A123 VanDerWaalsContact O-CB 3.32Å; S119-A123 WeakPolarHBondContact O-CB 3.36Å; S119-A123 PolarHBondContact O-N 3.26Å; A123-S127 WeakPolarHBondContact O-CB 3.41Å; A123-S127 PolarHBondContact O-N 2.78Å; A123-S127 PolarHBondContact O-OG 3.37Å
124G89.9Confident93.4Very high13 Ų1323.5 Ų23.513%0.13415%0.151CC..Hα-helixtrans-65.7-48.6176.300000112.5G120 G121 A122 S127 L128G120-G124 PolarHBondContact O-N 3.41Å; G121-G124 PolarHBondContact O-N 3.09Å; A122-G124 VanDerWaalsContact C-N 3.28Å; A122-G124 PolarHBondContact O-N 3.16Å; G124-S127 PolarHBondContact O-N 3.45Å; G124-L128 WeakPolarHBondContact O-CB 3.45Å; G124-L128 VanDerWaalsContact O-CG 3.32Å; G124-L128 WeakPolarHBondContact O-CG 3.35Å; G124-L128 PolarHBondContact O-N 3.01Å
125A94.6Very high93.5Very high21 Ų2121.4 Ų21.417%0.17413%0.132CC..Hα-helixtrans-60.6-47.6177.800000111.5G121 A122 S127 L128 C129 V181G121-A125 VanDerWaalsContact O-CB 3.31Å; G121-A125 WeakPolarHBondContact O-CB 3.49Å; G121-A125 PolarHBondContact O-N 3.04Å; A122-A125 PolarHBondContact O-N 2.96Å; A125-S127 VanDerWaalsContact C-N 3.32Å; A125-S127 PolarHBondContact O-N 3.19Å; A125-L128 CarbonylContact O-C 3.6Å; A125-L128 PolarHBondContact O-N 3.38Å; A125-L128 VanDerWaalsContact O-N 3.13Å; A125-C129 PolarHBondContact O-N 2.92Å; A125-C129 PolarHBondContact O-SG 3.27Å; A125-V181 HydrophobicContact CB-CG1 4.13Å; A125-V181 HydrophobicContact CB-CG2 3.91Å
126T94.9Very high93.8Very high25 Ų2521.3 Ų21.315%0.15313%0.132CC..Hα-helixtrans-59.6-43.6177.4-61.90000111.4F91 Y95 A122 L128 C129 F130F91-T126 HydrophobicContact CD1-CG2 4.47Å; F91-T126 HydrophobicContact CD2-CG2 3.85Å; F91-T126 HydrophobicContact CE2-CG2 4.05Å; F91-T126 HydrophobicContact CG-CG2 4.09Å; F91-T126 HydrophobicContact CZ-CG2 4.44Å; Y95-T126 PolarHBondContact OH-OG1 2.92Å; A122-T126 WeakPolarHBondContact O-CB 3.41Å; A122-T126 PolarHBondContact O-N 2.96Å; A122-T126 PolarHBondContact O-OG1 3.02Å; A122-T126 VanDerWaalsContact O-OG1 3.05Å; T126-L128 PolarHBondContact O-N 3.29Å; T126-C129 WeakPolarHBondContact O-CB 3.28Å; T126-C129 PolarHBondContact O-N 3.2Å; T126-F130 VanDerWaalsContact O-CD2 3.23Å; T126-F130 WeakPolarHBondContact O-CD2 3.23Å
127S92.5Very high94.1Very high9 Ų920.7 Ų20.76%0.06313%0.129CC..Hα-helixtrans-60.8-47.4175.2-65.70000111.2A123 G124 A125 C129 F130 V131A123-S127 WeakPolarHBondContact O-CB 3.41Å; A123-S127 PolarHBondContact O-N 2.78Å; A123-S127 PolarHBondContact O-OG 3.37Å; G124-S127 PolarHBondContact O-N 3.45Å; A125-S127 VanDerWaalsContact C-N 3.32Å; A125-S127 PolarHBondContact O-N 3.19Å; S127-C129 VanDerWaalsContact C-N 3.27Å; S127-C129 PolarHBondContact O-N 3.36Å; S127-F130 PolarHBondContact O-N 3.18Å; S127-F130 VanDerWaalsContact O-N 3.1Å; S127-V131 WeakPolarHBondContact O-CG2 3.28Å; S127-V131 PolarHBondContact O-N 3.06Å
128L93.8Very high94.4Very high12 Ų1220.3 Ų20.36%0.06313%0.125CC..Hα-helixtrans-62.4-30.6177.9-70.3-179.6000112.6G124 A125 T126 F130 V131 Y132 F177 S180 V181 I184G124-L128 WeakPolarHBondContact O-CB 3.45Å; G124-L128 VanDerWaalsContact O-CG 3.32Å; G124-L128 WeakPolarHBondContact O-CG 3.35Å; G124-L128 PolarHBondContact O-N 3.01Å; A125-L128 CarbonylContact O-C 3.6Å; A125-L128 PolarHBondContact O-N 3.38Å; A125-L128 VanDerWaalsContact O-N 3.13Å; T126-L128 PolarHBondContact O-N 3.29Å; L128-F130 PolarHBondContact O-N 3.01Å; L128-V131 HydrophobicContact CD2-CG2 4.37Å; L128-V131 PolarHBondContact O-N 3.33Å; L128-Y132 HydrophobicContact CB-CD2 4.26Å; L128-Y132 HydrophobicContact CD1-CD2 4.31Å; L128-Y132 HydrophobicContact CD2-CD2 4.06Å; L128-Y132 HydrophobicContact CG-CD2 4.44Å; L128-Y132 WeakPolarHBondContact O-CB 3.33Å; L128-Y132 PolarHBondContact O-N 3.1Å; L128-F177 HydrophobicContact CB-CD2 4.24Å; L128-F177 HydrophobicContact CB-CE2 3.53Å; L128-F177 HydrophobicContact CB-CZ 4.3Å; L128-S180 WeakPolarHBondContact CD1-OG 3.4Å; L128-V181 HydrophobicContact CD1-CG2 4.49Å; L128-I184 HydrophobicContact CD1-CD1 3.58Å; L128-I184 HydrophobicContact CG-CD1 4.37Å
129C95.1Very high94.6Very high63 Ų6318.4 Ų18.443%0.42611%0.11SC..Hα-helixtrans-55.7-21.1174.1-68.80000113.5A125 T126 S127 Y174A125-C129 PolarHBondContact O-N 2.92Å; A125-C129 PolarHBondContact O-SG 3.27Å; T126-C129 WeakPolarHBondContact O-CB 3.28Å; T126-C129 PolarHBondContact O-N 3.2Å; S127-C129 VanDerWaalsContact C-N 3.27Å; S127-C129 PolarHBondContact O-N 3.36Å; C129-Y174 PolarHBondContact O-OH 2.93Å
130F95.1Very high94.8Very high131 Ų13118.3 Ų18.358%0.57511%0.108SC*.Hα-helixtrans-109.7-41.8176.9-60.6-87.2000112.5L87 T126 S127 L128L87-F130 HydrophobicContact CD1-CB 3.73Å; L87-F130 HydrophobicContact CD1-CD2 3.7Å; L87-F130 HydrophobicContact CD1-CG 3.96Å; L87-F130 HydrophobicContact CD2-CD2 3.77Å; L87-F130 HydrophobicContact CD2-CE2 3.96Å; L87-F130 HydrophobicContact CD2-CG 4.37Å; L87-F130 HydrophobicContact CG-CD2 4.42Å; T126-F130 VanDerWaalsContact O-CD2 3.23Å; T126-F130 WeakPolarHBondContact O-CD2 3.23Å; S127-F130 PolarHBondContact O-N 3.18Å; S127-F130 VanDerWaalsContact O-N 3.1Å; L128-F130 PolarHBondContact O-N 3.01Å
131V95.6Very high95.2Very high4 Ų418.6 Ų18.62%0.02411%0.11CC..Hα-helixtrans-96.5-5.9-170.8-54.70000114.5R80 P83 L87 S127 L128 P133 L134 D135R80-V131 HydrophobicContact CG-CB 4.15Å; R80-V131 HydrophobicContact CG-CG2 4.26Å; P83-V131 HydrophobicContact CB-CG1 3.83Å; P83-V131 HydrophobicContact CG-CG1 3.74Å; L87-V131 HydrophobicContact CD1-CG1 4.31Å; S127-V131 WeakPolarHBondContact O-CG2 3.28Å; S127-V131 PolarHBondContact O-N 3.06Å; L128-V131 HydrophobicContact CD2-CG2 4.37Å; L128-V131 PolarHBondContact O-N 3.33Å; V131-P133 VanDerWaalsContact C-CD 3.46Å; V131-L134 WeakPolarHBondContact O-CB 3.4Å; V131-L134 PolarHBondContact O-N 3.31Å; V131-D135 PolarHBondContact O-N 3.4Å
132Y97.2Very high95.4Very high0 Ų018.5 Ų18.50%011%0.109CC..Hα-helixtrans-59.4-36.4-179.4-165.6-80.8000114.1L128 L134 D135 F136 L173 Y174 Q175 G176 F177 S180 R235 M239L128-Y132 HydrophobicContact CB-CD2 4.26Å; L128-Y132 HydrophobicContact CD1-CD2 4.31Å; L128-Y132 HydrophobicContact CD2-CD2 4.06Å; L128-Y132 HydrophobicContact CG-CD2 4.44Å; L128-Y132 WeakPolarHBondContact O-CB 3.33Å; L128-Y132 PolarHBondContact O-N 3.1Å; Y132-L134 PolarHBondContact O-N 3.45Å; Y132-D135 WeakPolarHBondContact O-CB 3.47Å; Y132-D135 PolarHBondContact O-N 3.25Å; Y132-F136 PolarHBondContact O-N 2.74Å; Y132-L173 WeakPolarHBondContact CD1-O 3.4Å; Y132-L173 WeakPolarHBondContact CE1-O 3.35Å; Y132-Y174 HydrophobicContact CD1-CD1 4.08Å; Y132-Y174 HydrophobicContact CD1-CG 4.36Å; Y132-Y174 HydrophobicContact CG-CD1 4.15Å; Y132-Y174 HydrophobicContact CG-CE1 4.46Å; Y132-Q175 WeakPolarHBondContact CE1-O 3.35Å; Y132-Q175 PolarHBondContact OH-O 3.4Å; Y132-G176 WeakPolarHBondContact OH-CA 3.49Å; Y132-G176 PolarHBondContact OH-O 2.72Å; Y132-F177 AromaticContact CD2-CD2 3.76Å; Y132-F177 HydrophobicContact CD2-CD2 3.76Å; Y132-F177 HydrophobicContact CE2-CB 4.3Å; Y132-F177 HydrophobicContact CE2-CD2 4.2Å; Y132-F177 HydrophobicContact CG-CD2 4.1Å; Y132-F177 PolarHBondContact OH-N 3.28Å; Y132-S180 WeakPolarHBondContact CE2-OG 3.29Å; Y132-R235 VanDerWaalsContact CE2-NH2 3.34Å; Y132-M239 HydrophobicContact CD1-CE 4.47Å; Y132-M239 HydrophobicContact CE1-CE 3.64Å; Y132-M239 HydrophobicContact CE2-CE 3.98Å; Y132-M239 WeakPolarHBondContact OH-CE 3.4Å
133P97.8Very high95.5Very high18 Ų1817.5 Ų17.512%0.11710%0.101CC..Hα-helixtrans-57.1-33.9173.4-28.737.9000113.6V131 F136 A137 L161 L173 Y174V131-P133 VanDerWaalsContact C-CD 3.46Å; P133-F136 WeakPolarHBondContact O-CB 3.43Å; P133-F136 PolarHBondContact O-N 3.3Å; P133-A137 WeakPolarHBondContact O-CB 3.36Å; P133-A137 PolarHBondContact O-N 3.21Å; P133-L161 HydrophobicContact CB-CD2 3.78Å; P133-L161 WeakPolarHBondContact O-CD2 3.48Å; P133-L173 HydrophobicContact CB-CB 4.41Å; P133-L173 HydrophobicContact CB-CD1 4.28Å; P133-L173 HydrophobicContact CG-CB 4.39Å; P133-L173 HydrophobicContact CG-CD1 4.49Å; P133-Y174 WeakPolarHBondContact CD-OH 3.29Å; P133-Y174 HydrophobicContact CG-CE1 4.49Å; P133-Y174 HydrophobicContact CG-CE2 3.64Å; P133-Y174 WeakPolarHBondContact CG-OH 3.34Å
134L97.1Very high95.7Very high27 Ų2717.2 Ų17.214%0.14110%0.098CC..Hα-helixtrans-67.8-43.2175.2-60.3175.9000111.1I79 R80 P83 V131 Y132 F136 A137 R138 L157I79-L134 HydrophobicContact CG2-CD1 4.01Å; R80-L134 HydrophobicContact CB-CD1 4.1Å; R80-L134 HydrophobicContact CG-CD1 4.46Å; P83-L134 HydrophobicContact CG-CD1 4.41Å; V131-L134 WeakPolarHBondContact O-CB 3.4Å; V131-L134 PolarHBondContact O-N 3.31Å; Y132-L134 PolarHBondContact O-N 3.45Å; L134-F136 VanDerWaalsContact C-N 3.3Å; L134-F136 PolarHBondContact O-N 3.39Å; L134-A137 PolarHBondContact O-N 3.4Å; L134-R138 VanDerWaalsContact O-CB 3.22Å; L134-R138 WeakPolarHBondContact O-CB 3.23Å; L134-R138 PolarHBondContact O-N 3.45Å; L134-L157 HydrophobicContact CD2-CD1 4.25Å; L134-L157 HydrophobicContact CD2-CD2 4.15Å
135D95.9Very high95.9Very high8 Ų817.6 Ų17.64%0.04310%0.098CC..Hα-helixtrans-62.3-39174.6-83.2-18.1000112.1R80 V131 Y132 T139 R235 M239R80-D135 WeakPolarHBondContact CD-OD1 3.17Å; R80-D135 IonicContact NE-OD1 3.99Å; R80-D135 PolarHBondContact NE-OD1 2.62Å; V131-D135 PolarHBondContact O-N 3.4Å; Y132-D135 WeakPolarHBondContact O-CB 3.47Å; Y132-D135 PolarHBondContact O-N 3.25Å; D135-T139 PolarHBondContact O-N 3.49Å; D135-T139 VanDerWaalsContact O-N 3.15Å; D135-T139 PolarHBondContact O-OG1 3.31Å; D135-R235 IonicContact OD2-CZ 2.71Å; D135-R235 IonicContact OD2-NH1 4Å; D135-R235 IonicContact OD2-NH2 3.64Å; D135-R235 PolarHBondContact OD2-NH2 3.09Å; D135-M239 HydrophobicContact CB-CE 4.3Å
136F97.7Very high95.7Very high0 Ų016.9 Ų16.90%09%0.092CC..Hα-helixtrans-62-56.4175.8170.7-88.3000110.7Y132 P133 L134 R138 T139 R140 I164 G172 L173 M239 S242Y132-F136 PolarHBondContact O-N 2.74Å; P133-F136 WeakPolarHBondContact O-CB 3.43Å; P133-F136 PolarHBondContact O-N 3.3Å; L134-F136 VanDerWaalsContact C-N 3.3Å; L134-F136 PolarHBondContact O-N 3.39Å; F136-R138 VanDerWaalsContact C-N 3.31Å; F136-R138 PolarHBondContact O-N 3.41Å; F136-T139 WeakPolarHBondContact O-CB 3.31Å; F136-T139 PolarHBondContact O-N 3Å; F136-R140 HydrophobicContact CD1-CG 4.34Å; F136-R140 HydrophobicContact CE1-CG 3.84Å; F136-R140 HydrophobicContact CE2-CG 4.07Å; F136-R140 HydrophobicContact CZ-CG 3.67Å; F136-R140 WeakPolarHBondContact O-CG 3.48Å; F136-R140 PolarHBondContact O-N 2.92Å; F136-I164 HydrophobicContact CE1-CB 4.13Å; F136-I164 HydrophobicContact CE1-CG1 3.84Å; F136-I164 HydrophobicContact CE1-CG2 3.98Å; F136-I164 HydrophobicContact CZ-CB 4.34Å; F136-I164 HydrophobicContact CZ-CD1 4.5Å; F136-I164 HydrophobicContact CZ-CG1 3.94Å; F136-I164 HydrophobicContact CZ-CG2 3.84Å; F136-G172 WeakPolarHBondContact CE2-O 3.32Å; F136-L173 WeakPolarHBondContact CB-O 3.22Å; F136-L173 HydrophobicContact CD1-CD2 3.74Å; F136-L173 HydrophobicContact CE1-CD2 3.8Å; F136-M239 HydrophobicContact CD2-CB 3.86Å; F136-M239 HydrophobicContact CD2-CG 3.94Å; F136-M239 HydrophobicContact CE2-CB 4.13Å; F136-M239 VanDerWaalsContact CE2-O 3.25Å; F136-M239 WeakPolarHBondContact CE2-O 3.46Å; F136-S242 WeakPolarHBondContact CE2-OG 3.24Å
137A97.6Very high95.2Very high0 Ų021.5 Ų21.50%011%0.11CC..Hα-helixtrans-63.8-37.9-176.900000112.1P133 L134 T139 R140 L141 L157 C160 L161P133-A137 WeakPolarHBondContact O-CB 3.36Å; P133-A137 PolarHBondContact O-N 3.21Å; L134-A137 PolarHBondContact O-N 3.4Å; A137-T139 VanDerWaalsContact C-N 3.31Å; A137-T139 PolarHBondContact O-N 3.1Å; A137-R140 PolarHBondContact O-N 3.48Å; A137-L141 WeakPolarHBondContact O-CB 3.45Å; A137-L141 WeakPolarHBondContact O-CD1 3.33Å; A137-L141 VanDerWaalsContact O-CG 3.23Å; A137-L141 WeakPolarHBondContact O-CG 2.98Å; A137-L141 PolarHBondContact O-N 3.47Å; A137-L157 HydrophobicContact CB-CD1 3.3Å; A137-C160 HydrophobicContact CB-CB 4.15Å; A137-L161 HydrophobicContact CB-CD2 3.88Å; A137-L161 HydrophobicContact CB-CG 4.15Å
138R96.9Very high94.4Very high16 Ų1624.2 Ų24.26%0.0613%0.133CC..Hα-helixtrans-53.1-49.3170.5-174.8-147-178.6153.735.1111.7E30 A76 N77 L134 F136 A142E30-R138 IonicContact OE1-CZ 3.32Å; E30-R138 IonicContact OE1-NE 2.63Å; E30-R138 IonicContact OE1-NH1 3.61Å; E30-R138 PolarHBondContact OE1-NH1 2.89Å; E30-R138 IonicContact OE1-NH2 2.72Å; E30-R138 PolarHBondContact OE1-NH2 3.32Å; E30-R138 IonicContact OE2-CZ 2.67Å; E30-R138 IonicContact OE2-NH1 3.72Å; E30-R138 IonicContact OE2-NH2 2.64Å; E30-R138 PolarHBondContact OE2-NH2 2.91Å; A76-R138 HydrophobicContact CB-CB 3.78Å; A76-R138 HydrophobicContact CB-CG 4.35Å; N77-R138 PolarHBondContact ND2-NE 3.25Å; N77-R138 PolarHBondContact ND2-NH2 3.44Å; N77-R138 WeakPolarHBondContact OD1-CD 3.41Å; N77-R138 WeakPolarHBondContact OD1-CG 3.37Å; N77-R138 PolarHBondContact OD1-NE 2.96Å; N77-R138 PolarHBondContact OD1-NH2 2.98Å; L134-R138 VanDerWaalsContact O-CB 3.22Å; L134-R138 WeakPolarHBondContact O-CB 3.23Å; L134-R138 PolarHBondContact O-N 3.45Å; F136-R138 VanDerWaalsContact C-N 3.31Å; F136-R138 PolarHBondContact O-N 3.41Å; R138-A142 VanDerWaalsContact O-CB 3.3Å; R138-A142 WeakPolarHBondContact O-CB 3.18Å; R138-A142 PolarHBondContact O-N 3.33Å
139T97.1Very high93.8Very high0 Ų026.8 Ų26.80%016%0.163CC..Hα-helixtrans-64.3-45.5-177.6-55.20000110.9D135 F136 A137 A142 A143 R236 M239D135-T139 PolarHBondContact O-N 3.49Å; D135-T139 VanDerWaalsContact O-N 3.15Å; D135-T139 PolarHBondContact O-OG1 3.31Å; F136-T139 WeakPolarHBondContact O-CB 3.31Å; F136-T139 PolarHBondContact O-N 3Å; A137-T139 VanDerWaalsContact C-N 3.31Å; A137-T139 PolarHBondContact O-N 3.1Å; T139-A142 PolarHBondContact O-N 2.9Å; T139-A143 WeakPolarHBondContact O-CB 3.26Å; T139-A143 PolarHBondContact O-N 2.88Å; T139-R236 HydrophobicContact CG2-CB 4.24Å; T139-R236 HydrophobicContact CG2-CG 4.4Å; T139-R236 PolarHBondContact OG1-NH1 3.29Å; T139-M239 HydrophobicContact CG2-SD 4.02Å; T139-M239 PolarHBondContact OG1-SD 3.1Å; T139-M239 VanDerWaalsContact OG1-SD 3.4Å
140R97.4Very high93Very high3 Ų330.8 Ų30.81%0.01119%0.185CC..Hα-helixtrans-64.9-43.6179.7-67.7-61-70.2-90.1-1.6112.6F136 A137 A143 D144 E153 F154 M239 S242F136-R140 HydrophobicContact CD1-CG 4.34Å; F136-R140 HydrophobicContact CE1-CG 3.84Å; F136-R140 HydrophobicContact CE2-CG 4.07Å; F136-R140 HydrophobicContact CZ-CG 3.67Å; F136-R140 WeakPolarHBondContact O-CG 3.48Å; F136-R140 PolarHBondContact O-N 2.92Å; A137-R140 PolarHBondContact O-N 3.48Å; R140-A143 PolarHBondContact O-N 3.38Å; R140-D144 PolarHBondContact O-N 2.83Å; R140-D144 VanDerWaalsContact O-N 3.1Å; R140-E153 IonicContact CZ-OE1 2.87Å; R140-E153 IonicContact NH2-OE1 2.95Å; R140-E153 PolarHBondContact NH2-OE1 2.96Å; R140-E153 IonicContact NH2-OE2 3.92Å; R140-F154 HydrophobicContact CB-CD2 4.27Å; R140-F154 HydrophobicContact CB-CE2 3.81Å; R140-F154 HydrophobicContact CG-CE2 4.5Å; R140-M239 PolarHBondContact NH1-O 3.37Å; R140-S242 VanDerWaalsContact CZ-O 3.3Å; R140-S242 PolarHBondContact NH1-O 2.95Å; R140-S242 PolarHBondContact NH2-O 3.34Å
141L96.9Very high92.6Very high7 Ų729.7 Ų29.74%0.03718%0.182CC..Hα-helixtrans-64.6-40.5175.1-71.3168.1000112.1R72 A137 A143 D144 F154 L157R72-L141 WeakPolarHBondContact CD-O 3.41Å; R72-L141 HydrophobicContact CG-CB 4.38Å; R72-L141 VanDerWaalsContact CG-O 3.22Å; R72-L141 WeakPolarHBondContact CG-O 3.41Å; R72-L141 PolarHBondContact NE-O 3Å; A137-L141 WeakPolarHBondContact O-CB 3.45Å; A137-L141 WeakPolarHBondContact O-CD1 3.33Å; A137-L141 VanDerWaalsContact O-CG 3.23Å; A137-L141 WeakPolarHBondContact O-CG 2.98Å; A137-L141 PolarHBondContact O-N 3.47Å; L141-A143 VanDerWaalsContact C-N 3.33Å; L141-A143 PolarHBondContact O-N 3.3Å; L141-D144 PolarHBondContact O-N 3.02Å; L141-F154 HydrophobicContact CD2-CB 3.77Å; L141-L157 HydrophobicContact CD1-CB 4.35Å
142A96.3Very high92.4Very high3 Ų331.5 Ų31.53%0.02519%0.188CC..Hα-helixtrans-64.6-38.8177.900000112.2R31 L34 R138 T139 D144R31-A142 HydrophobicContact CG-CB 4.37Å; R31-A142 PolarHBondContact NE-O 3.44Å; L34-A142 HydrophobicContact CB-CB 4.13Å; L34-A142 HydrophobicContact CD1-CB 3.51Å; L34-A142 HydrophobicContact CG-CB 4.47Å; R138-A142 VanDerWaalsContact O-CB 3.3Å; R138-A142 WeakPolarHBondContact O-CB 3.18Å; R138-A142 PolarHBondContact O-N 3.33Å; T139-A142 PolarHBondContact O-N 2.9Å; A142-D144 VanDerWaalsContact C-N 3.32Å
143A96.1Very high92.2Very high2 Ų234.1 Ų34.12%0.01720%0.201CC..Hα-helixtrans-74.6-18.117900000114.1V38 T139 R140 L141 V145 M240V38-A143 HydrophobicContact CG2-CB 3.61Å; T139-A143 WeakPolarHBondContact O-CB 3.26Å; T139-A143 PolarHBondContact O-N 2.88Å; R140-A143 PolarHBondContact O-N 3.38Å; L141-A143 VanDerWaalsContact C-N 3.33Å; L141-A143 PolarHBondContact O-N 3.3Å; A143-V145 PolarHBondContact O-N 3.48Å; A143-M240 HydrophobicContact CB-CE 3.6Å; A143-M240 HydrophobicContact CB-SD 3.78Å
144D95Very high92Very high0 Ų033.3 Ų33.30%020%0.195CC..  trans-70.9110.1179-178.4-3.7000110.8R31 Q44 Q65 R72 R140 L141 A142 G146 R152 E153 F154R31-D144 PolarHBondContact NH2-O 3.11Å; Q44-D144 PolarHBondContact NE2-OD1 3.32Å; Q44-D144 PolarHBondContact OE1-OD1 3.26Å; Q65-D144 PolarHBondContact NE2-O 3.26Å; R72-D144 IonicContact CZ-OD2 3.48Å; R72-D144 IonicContact NE-OD2 3.58Å; R72-D144 IonicContact NH2-OD2 2.66Å; R72-D144 PolarHBondContact NH2-OD2 3.03Å; R140-D144 PolarHBondContact O-N 2.83Å; R140-D144 VanDerWaalsContact O-N 3.1Å; L141-D144 PolarHBondContact O-N 3.02Å; A142-D144 VanDerWaalsContact C-N 3.32Å; D144-G146 PolarHBondContact OD1-N 3.34Å; D144-R152 PolarHBondContact O-NH1 3.22Å; D144-E153 HydrophobicContact CB-CB 4.49Å; D144-E153 PolarHBondContact OD1-N 3.05Å; D144-E153 PolarHBondContact OD2-N 3.44Å; D144-F154 PolarHBondContact OD2-N 2.86Å
145V92.9Very high91.8Very high20 Ų2041 Ų4112%0.12123%0.228CC..  trans-97.43.7-177.8-65.80000114L35 Q44 I45 Y51 Q65 A143L35-V145 HydrophobicContact CD2-CG1 3.63Å; Q44-V145 HydrophobicContact CB-CG2 3.39Å; Q44-V145 HydrophobicContact CG-CG2 4.37Å; I45-V145 HydrophobicContact CD1-CG1 3.76Å; I45-V145 HydrophobicContact CD1-CG2 4.2Å; I45-V145 HydrophobicContact CG1-CB 4.35Å; I45-V145 HydrophobicContact CG1-CG1 4.03Å; I45-V145 HydrophobicContact CG1-CG2 3.53Å; Y51-V145 HydrophobicContact CE2-CG1 4.43Å; Q65-V145 PolarHBondContact NE2-O 3Å; A143-V145 PolarHBondContact O-N 3.48Å
146G90.6Very high91.8Very high6 Ų641.7 Ų41.76%0.06224%0.237CC..  trans-56.8155.8177.600000112.3Q65 D144 E151 R152Q65-G146 PolarHBondContact NE2-O 2.93Å; D144-G146 PolarHBondContact OD1-N 3.34Å; G146-E151 WeakPolarHBondContact CA-O 3.47Å; G146-R152 VanDerWaalsContact O-CD 3.31Å; G146-R152 WeakPolarHBondContact O-CD 3.46Å; G146-R152 PolarHBondContact O-NE 3.13Å; G146-R152 PolarHBondContact O-NH1 3.49Å; G146-R152 PolarHBondContact O-NH2 2.83Å
147K83.8Confident91.7Very high123 Ų12342.7 Ų42.754%0.53524%0.242SC..  trans-85.5-57.6-177.7-55.1-171.5175.21740111.8E64 E151 R152E64-K147 VanDerWaalsContact O-CD 3.26Å; E64-K147 WeakPolarHBondContact O-CD 3.2Å; E64-K147 WeakPolarHBondContact O-CE 3.25Å; E64-K147 WeakPolarHBondContact O-CG 3.44Å; K147-E151 WeakPolarHBondContact CB-OE2 3.37Å; K147-E151 WeakPolarHBondContact CG-OE2 3.29Å; K147-E151 PolarHBondContact N-OE2 2.8Å; K147-R152 VanDerWaalsContact O-CZ 3.32Å; K147-R152 PolarHBondContact O-NE 2.98Å; K147-R152 VanDerWaalsContact O-NE 3.14Å; K147-R152 PolarHBondContact O-NH2 2.97Å
148A77.1Confident91.6Very high66 Ų6644.8 Ų44.855%0.54526%0.264SS..SBendtrans-156.6167.518000000111.9T150 E151A148-T150 PolarHBondContact O-N 3.21Å; A148-E151 WeakPolarHBondContact O-CB 3.43Å; A148-E151 PolarHBondContact O-N 3.27Å; A148-E151 VanDerWaalsContact O-N 3.12Å
149G79.9Confident91.6Very high66 Ų6646.9 Ų46.968%0.6828%0.276SS*.G310 helixtrans54.8-122.6171.200000113.7E151 R152G149-E151 VanDerWaalsContact C-N 3.29Å; G149-E151 PolarHBondContact O-N 3.47Å; G149-R152 PolarHBondContact O-N 3.2Å
150T78.6Confident91.6Very high147 Ų14746.9 Ų46.990%0.90228%0.276SS*.G310 helixtrans-72-17.1-176.350.20000114.1A148 R152A148-T150 PolarHBondContact O-N 3.21Å; T150-R152 VanDerWaalsContact C-N 3.28Å; T150-R152 PolarHBondContact O-N 2.98Å
151E87Confident91.6Very high107 Ų10748.5 Ų48.550%0.529%0.285SS..G310 helixtrans-74.8-19.9176.1-63-176.3-176.800112.7Q44 G146 K147 A148 G149Q44-E151 PolarHBondContact NE2-O 3.11Å; G146-E151 WeakPolarHBondContact CA-O 3.47Å; K147-E151 WeakPolarHBondContact CB-OE2 3.37Å; K147-E151 WeakPolarHBondContact CG-OE2 3.29Å; K147-E151 PolarHBondContact N-OE2 2.8Å; A148-E151 WeakPolarHBondContact O-CB 3.43Å; A148-E151 PolarHBondContact O-N 3.27Å; A148-E151 VanDerWaalsContact O-N 3.12Å; G149-E151 VanDerWaalsContact C-N 3.29Å; G149-E151 PolarHBondContact O-N 3.47Å
152R91.7Very high91.7Very high42 Ų4251.8 Ų51.816%0.15831%0.305CS..  trans-74.1131.8176.5-64.4-56.3-164.1168.8-11.5109.8R72 D144 G146 K147 G149 T150 F154R72-R152 VanDerWaalsContact CD-NH1 3.27Å; R72-R152 VanDerWaalsContact CZ-CD 3.48Å; R72-R152 VanDerWaalsContact NE-NH1 3.15Å; R72-R152 VanDerWaalsContact NH1-NE 3.1Å; R72-R152 VanDerWaalsContact NH1-NH1 3.15Å; R72-R152 VanDerWaalsContact NH2-CD 3.31Å; D144-R152 PolarHBondContact O-NH1 3.22Å; G146-R152 VanDerWaalsContact O-CD 3.31Å; G146-R152 WeakPolarHBondContact O-CD 3.46Å; G146-R152 PolarHBondContact O-NE 3.13Å; G146-R152 PolarHBondContact O-NH1 3.49Å; G146-R152 PolarHBondContact O-NH2 2.83Å; K147-R152 VanDerWaalsContact O-CZ 3.32Å; K147-R152 PolarHBondContact O-NE 2.98Å; K147-R152 VanDerWaalsContact O-NE 3.14Å; K147-R152 PolarHBondContact O-NH2 2.97Å; G149-R152 PolarHBondContact O-N 3.2Å; T150-R152 VanDerWaalsContact C-N 3.28Å; T150-R152 PolarHBondContact O-N 2.98Å; R152-F154 VanDerWaalsContact C-N 3.28Å; R152-F154 PolarHBondContact O-N 3.4Å
153E92.2Very high91.7Very high56 Ų5656.4 Ų56.426%0.26233%0.325SS..SBendtrans-66.7-36.5174.1-166.8-175.7175.900111R140 D144 K163R140-E153 IonicContact CZ-OE1 2.87Å; R140-E153 IonicContact NH2-OE1 2.95Å; R140-E153 PolarHBondContact NH2-OE1 2.96Å; R140-E153 IonicContact NH2-OE2 3.92Å; D144-E153 HydrophobicContact CB-CB 4.49Å; D144-E153 PolarHBondContact OD1-N 3.05Å; D144-E153 PolarHBondContact OD2-N 3.44Å; E153-K163 PolarHBondContact O-NZ 2.63Å
154F94.4Very high91.8Very high1 Ų156.5 Ų56.50%0.00433%0.325CS..  trans-136.7141.9179.8-53-73.2000111.9R72 R140 L141 D144 R152 D159 C160 K163 I164R72-F154 PolarHBondContact NH2-O 3.45Å; R140-F154 HydrophobicContact CB-CD2 4.27Å; R140-F154 HydrophobicContact CB-CE2 3.81Å; R140-F154 HydrophobicContact CG-CE2 4.5Å; L141-F154 HydrophobicContact CD2-CB 3.77Å; D144-F154 PolarHBondContact OD2-N 2.86Å; R152-F154 VanDerWaalsContact C-N 3.28Å; R152-F154 PolarHBondContact O-N 3.4Å; F154-D159 WeakPolarHBondContact CA-OD2 3.47Å; F154-C160 HydrophobicContact CB-CB 4.07Å; F154-C160 VanDerWaalsContact CD1-CA 3.44Å; F154-C160 HydrophobicContact CD1-CB 3.8Å; F154-C160 HydrophobicContact CD2-CB 4.37Å; F154-C160 HydrophobicContact CE1-CB 4.32Å; F154-C160 HydrophobicContact CG-CB 3.81Å; F154-K163 HydrophobicContact CD1-CB 4.45Å; F154-K163 HydrophobicContact CD1-CD 3.95Å; F154-K163 HydrophobicContact CE1-CB 4.27Å; F154-K163 HydrophobicContact CE1-CD 3.87Å; F154-K163 HydrophobicContact CE1-CG 4.29Å; F154-I164 HydrophobicContact CE1-CD1 4.16Å; F154-I164 HydrophobicContact CE1-CG1 4.06Å; F154-I164 HydrophobicContact CZ-CD1 4.02Å; F154-I164 HydrophobicContact CZ-CG1 4.14Å
155K93.2Very high91.9Very high188 Ų18858.6 Ų58.682%0.81734%0.34SS*.SBendtrans-75.8-26.1176-63.7-179-179.5179.70112.7D159K155-D159 HydrophobicContact CB-CB 4.03Å; K155-D159 PolarHBondContact N-OD2 3Å
156G94.6Very high92Very high23 Ų2366 Ų6624%0.23737%0.37CS..SBendtrans174.7-167.3-178.600000113C160G156-C160 WeakPolarHBondContact O-CB 3.34Å; G156-C160 PolarHBondContact O-N 2.94Å
157L95.9Very high92.2Very high20 Ų2068 Ų6811%0.10538%0.383CS..Hα-helixtrans-59.5-54.1-177.4175.157.5000112.4L75 A76 I79 L134 A137 L141 D159 C160 L161L75-L157 HydrophobicContact CD2-CB 4.33Å; L75-L157 HydrophobicContact CD2-CD2 4.26Å; L75-L157 HydrophobicContact CG-CD2 4.27Å; A76-L157 HydrophobicContact CB-CD1 4.11Å; A76-L157 HydrophobicContact CB-CD2 4.28Å; I79-L157 HydrophobicContact CD1-CD2 3.9Å; L134-L157 HydrophobicContact CD2-CD1 4.25Å; L134-L157 HydrophobicContact CD2-CD2 4.15Å; A137-L157 HydrophobicContact CB-CD1 3.3Å; L141-L157 HydrophobicContact CD1-CB 4.35Å; L157-D159 PolarHBondContact O-N 3.4Å; L157-C160 PolarHBondContact O-N 2.9Å; L157-L161 HydrophobicContact CD1-CD1 4.06Å; L157-L161 HydrophobicContact CD1-CG 4.27Å; L157-L161 HydrophobicContact CG-CD1 4.38Å; L157-L161 WeakPolarHBondContact O-CG 3.4Å; L157-L161 PolarHBondContact O-N 3.1Å
158G96.9Very high92.7Very high45 Ų4564.4 Ų64.446%0.46437%0.37SS..Hα-helixtrans-61.5-44.8-179.800000112.5C160 L161 V162G158-C160 PolarHBondContact O-N 3.27Å; G158-L161 PolarHBondContact O-N 3.31Å; G158-V162 WeakPolarHBondContact O-CB 3.4Å; G158-V162 WeakPolarHBondContact O-CG2 3.48Å; G158-V162 PolarHBondContact O-N 3.49Å
159D96.9Very high93.5Very high59 Ų5962.7 Ų62.732%0.31636%0.358SS..Hα-helixtrans-60.1-43.5176.6-176.863.5000112F154 K155 L157 L161 V162 K163F154-D159 WeakPolarHBondContact CA-OD2 3.47Å; K155-D159 HydrophobicContact CB-CB 4.03Å; K155-D159 PolarHBondContact N-OD2 3Å; L157-D159 PolarHBondContact O-N 3.4Å; D159-L161 PolarHBondContact O-N 3.32Å; D159-V162 PolarHBondContact O-N 3.28Å; D159-K163 WeakPolarHBondContact O-CB 3.48Å; D159-K163 PolarHBondContact O-N 2.9Å
160C97.1Very high94.2Very high0 Ų065.7 Ų65.70%036%0.357CS..Hα-helixtrans-59.6-46.4175.2-177.80000112.5A137 F154 G156 L157 G158 I164A137-C160 HydrophobicContact CB-CB 4.15Å; F154-C160 HydrophobicContact CB-CB 4.07Å; F154-C160 VanDerWaalsContact CD1-CA 3.44Å; F154-C160 HydrophobicContact CD1-CB 3.8Å; F154-C160 HydrophobicContact CD2-CB 4.37Å; F154-C160 HydrophobicContact CE1-CB 4.32Å; F154-C160 HydrophobicContact CG-CB 3.81Å; G156-C160 WeakPolarHBondContact O-CB 3.34Å; G156-C160 PolarHBondContact O-N 2.94Å; L157-C160 PolarHBondContact O-N 2.9Å; G158-C160 PolarHBondContact O-N 3.27Å; C160-I164 WeakPolarHBondContact O-CB 3.21Å; C160-I164 WeakPolarHBondContact O-CG1 3.42Å; C160-I164 PolarHBondContact O-N 2.82Å
161L97.5Very high95Very high38 Ų3868.2 Ų68.220%0.19935%0.35CS..Hα-helixtrans-65.4-47.6-179.9-67.5176.5000111.4P133 A137 L157 G158 D159 S165 L173P133-L161 HydrophobicContact CB-CD2 3.78Å; P133-L161 WeakPolarHBondContact O-CD2 3.48Å; A137-L161 HydrophobicContact CB-CD2 3.88Å; A137-L161 HydrophobicContact CB-CG 4.15Å; L157-L161 HydrophobicContact CD1-CD1 4.06Å; L157-L161 HydrophobicContact CD1-CG 4.27Å; L157-L161 HydrophobicContact CG-CD1 4.38Å; L157-L161 WeakPolarHBondContact O-CG 3.4Å; L157-L161 PolarHBondContact O-N 3.1Å; G158-L161 PolarHBondContact O-N 3.31Å; D159-L161 PolarHBondContact O-N 3.32Å; L161-S165 VanDerWaalsContact O-CB 3.26Å; L161-S165 WeakPolarHBondContact O-CB 3.35Å; L161-S165 PolarHBondContact O-N 3.28Å; L161-S165 PolarHBondContact O-OG 3.12Å; L161-L173 HydrophobicContact CD2-CD1 4.37Å; L161-L173 HydrophobicContact CD2-CD2 3.86Å
162V97.6Very high95.3Very high76 Ų7663.2 Ų63.246%0.46133%0.328SS..Hα-helixtrans-65.1-47.7-179.9172.50000111.3G158 D159 I164 S165 K166G158-V162 WeakPolarHBondContact O-CB 3.4Å; G158-V162 WeakPolarHBondContact O-CG2 3.48Å; G158-V162 PolarHBondContact O-N 3.49Å; D159-V162 PolarHBondContact O-N 3.28Å; V162-I164 PolarHBondContact O-N 3.43Å; V162-S165 PolarHBondContact O-N 3.14Å; V162-K166 HydrophobicContact CG1-CD 4.04Å; V162-K166 HydrophobicContact CG1-CG 4.44Å; V162-K166 WeakPolarHBondContact O-CB 3.44Å; V162-K166 WeakPolarHBondContact O-CG 3.4Å; V162-K166 PolarHBondContact O-N 3.29Å
163K96.8Very high95.6Very high100 Ų10061.8 Ų61.844%0.43532%0.323SS..Hα-helixtrans-61-44.2-177.2-174.9170.6175.1-178.30111.8E153 F154 D159 K166 S167E153-K163 PolarHBondContact O-NZ 2.63Å; F154-K163 HydrophobicContact CD1-CB 4.45Å; F154-K163 HydrophobicContact CD1-CD 3.95Å; F154-K163 HydrophobicContact CE1-CB 4.27Å; F154-K163 HydrophobicContact CE1-CD 3.87Å; F154-K163 HydrophobicContact CE1-CG 4.29Å; D159-K163 WeakPolarHBondContact O-CB 3.48Å; D159-K163 PolarHBondContact O-N 2.9Å; K163-K166 PolarHBondContact O-N 2.69Å; K163-S167 PolarHBondContact O-N 3.21Å; K163-S167 VanDerWaalsContact O-N 3.1Å
164I97.3Very high95.9Very high3 Ų362.1 Ų62.12%0.01532%0.323CS..Hα-helixtrans-73.2-37.6178.1-63.1-60.8000111.9F136 F154 C160 V162 K166 S167 D168 L173F136-I164 HydrophobicContact CE1-CB 4.13Å; F136-I164 HydrophobicContact CE1-CG1 3.84Å; F136-I164 HydrophobicContact CE1-CG2 3.98Å; F136-I164 HydrophobicContact CZ-CB 4.34Å; F136-I164 HydrophobicContact CZ-CD1 4.5Å; F136-I164 HydrophobicContact CZ-CG1 3.94Å; F136-I164 HydrophobicContact CZ-CG2 3.84Å; F154-I164 HydrophobicContact CE1-CD1 4.16Å; F154-I164 HydrophobicContact CE1-CG1 4.06Å; F154-I164 HydrophobicContact CZ-CD1 4.02Å; F154-I164 HydrophobicContact CZ-CG1 4.14Å; C160-I164 WeakPolarHBondContact O-CB 3.21Å; C160-I164 WeakPolarHBondContact O-CG1 3.42Å; C160-I164 PolarHBondContact O-N 2.82Å; V162-I164 PolarHBondContact O-N 3.43Å; I164-K166 VanDerWaalsContact C-N 3.26Å; I164-K166 PolarHBondContact O-N 2.93Å; I164-S167 PolarHBondContact O-N 2.76Å; I164-S167 PolarHBondContact O-OG 3.41Å; I164-D168 PolarHBondContact O-N 2.72Å; I164-L173 HydrophobicContact CB-CD2 3.93Å; I164-L173 HydrophobicContact CG2-CD2 3.76Å; I164-L173 HydrophobicContact CG2-CG 4.36Å
165S96.9Very high96Very high45 Ų4564.5 Ų64.532%0.31533%0.333SS..Hα-helixtrans-62.3-37.2175.2-57.50000111.8L161 V162 G169 L173L161-S165 VanDerWaalsContact O-CB 3.26Å; L161-S165 WeakPolarHBondContact O-CB 3.35Å; L161-S165 PolarHBondContact O-N 3.28Å; L161-S165 PolarHBondContact O-OG 3.12Å; V162-S165 PolarHBondContact O-N 3.14Å; S165-G169 WeakPolarHBondContact O-CA 3.3Å; S165-G169 PolarHBondContact O-N 3.22Å; S165-L173 VanDerWaalsContact OG-CD1 3.29Å; S165-L173 WeakPolarHBondContact OG-CD1 3.34Å
166K96.3Very high96.1Very high176 Ų17655.7 Ų55.777%0.76530%0.296SS*.Hα-helixtrans-71.1-34.1175.5-74.2-179175.8-175.60112.9V162 K163 I164V162-K166 HydrophobicContact CG1-CD 4.04Å; V162-K166 HydrophobicContact CG1-CG 4.44Å; V162-K166 WeakPolarHBondContact O-CB 3.44Å; V162-K166 WeakPolarHBondContact O-CG 3.4Å; V162-K166 PolarHBondContact O-N 3.29Å; K163-K166 PolarHBondContact O-N 2.69Å; I164-K166 VanDerWaalsContact C-N 3.26Å; I164-K166 PolarHBondContact O-N 2.93Å
167S94.7Very high96.2Very high46 Ų4656.6 Ų56.632%0.32229%0.294SS..Hα-helixtrans-82.5-41.1-176.773.70000113.5K163 I164K163-S167 PolarHBondContact O-N 3.21Å; K163-S167 VanDerWaalsContact O-N 3.1Å; I164-S167 PolarHBondContact O-N 2.76Å; I164-S167 PolarHBondContact O-OG 3.41Å
168D93.6Very high96.2Very high49 Ų4960.9 Ų60.926%0.26232%0.317SS..Hα-helixtrans-128.60.1-166.2-66.628.5000112.7I164 S242 G243I164-D168 PolarHBondContact O-N 2.72Å; D168-S242 VanDerWaalsContact OD2-CA 3.23Å; D168-S242 WeakPolarHBondContact OD2-CA 3.4Å; D168-G243 VanDerWaalsContact CG-N 3.3Å; D168-G243 WeakPolarHBondContact OD1-CA 3.35Å; D168-G243 PolarHBondContact OD1-N 2.96Å; D168-G243 PolarHBondContact OD2-N 3.2Å
169G95.1Very high96.2Very high30 Ų3058.7 Ų58.731%0.30930%0.295SS..Hα-helixtrans67.3-166.2-172.400000113.2S165 R171 G172S165-G169 WeakPolarHBondContact O-CA 3.3Å; S165-G169 PolarHBondContact O-N 3.22Å; G169-R171 PolarHBondContact O-N 3.07Å; G169-G172 PolarHBondContact O-N 3.3Å
170I94.4Very high96.2Very high128 Ų12856.2 Ų56.266%0.65628%0.282SS*.Hα-helixtrans-60.9-35.6178.4-63.8172.2000110.6G172 L173 Y174I170-G172 PolarHBondContact O-N 3.02Å; I170-L173 WeakPolarHBondContact O-CB 3.22Å; I170-L173 PolarHBondContact O-N 3.19Å; I170-Y174 HydrophobicContact CG2-CD2 3.8Å; I170-Y174 HydrophobicContact CG2-CE2 3.76Å; I170-Y174 WeakPolarHBondContact O-CD2 3.23Å; I170-Y174 PolarHBondContact O-N 3.23Å
171R93.9Very high96.1Very high200 Ų20057.5 Ų57.576%0.75529%0.289SS*.Hα-helixtrans-56.3-36.2179.3-172.8177.6177.4-179.3-0.7112.4G169 L173 Y174 Q175G169-R171 PolarHBondContact O-N 3.07Å; R171-L173 VanDerWaalsContact C-N 3.31Å; R171-L173 PolarHBondContact O-N 2.92Å; R171-Y174 PolarHBondContact O-N 3.4Å; R171-Q175 PolarHBondContact O-N 2.75Å
172G94.7Very high96Very high2 Ų260.1 Ų60.12%0.02130%0.301CS..Hα-helixtrans-60.1-37.7175.400000113.3F136 G169 I170 Y174 S242F136-G172 WeakPolarHBondContact CE2-O 3.32Å; G169-G172 PolarHBondContact O-N 3.3Å; I170-G172 PolarHBondContact O-N 3.02Å; G172-Y174 VanDerWaalsContact C-N 3.28Å; G172-Y174 PolarHBondContact O-N 2.74Å; G172-S242 WeakPolarHBondContact O-CB 2.95Å; G172-S242 PolarHBondContact O-OG 2.96Å
173L97.1Very high96Very high13 Ų1357 Ų577%0.06828%0.284CS..Hα-helixtrans-72.7-20179.1-62.2179.5000113.4Y132 P133 F136 L161 I164 S165 I170 R171Y132-L173 WeakPolarHBondContact CD1-O 3.4Å; Y132-L173 WeakPolarHBondContact CE1-O 3.35Å; P133-L173 HydrophobicContact CB-CB 4.41Å; P133-L173 HydrophobicContact CB-CD1 4.28Å; P133-L173 HydrophobicContact CG-CB 4.39Å; P133-L173 HydrophobicContact CG-CD1 4.49Å; F136-L173 WeakPolarHBondContact CB-O 3.22Å; F136-L173 HydrophobicContact CD1-CD2 3.74Å; F136-L173 HydrophobicContact CE1-CD2 3.8Å; L161-L173 HydrophobicContact CD2-CD1 4.37Å; L161-L173 HydrophobicContact CD2-CD2 3.86Å; I164-L173 HydrophobicContact CB-CD2 3.93Å; I164-L173 HydrophobicContact CG2-CD2 3.76Å; I164-L173 HydrophobicContact CG2-CG 4.36Å; S165-L173 VanDerWaalsContact OG-CD1 3.29Å; S165-L173 WeakPolarHBondContact OG-CD1 3.34Å; I170-L173 WeakPolarHBondContact O-CB 3.22Å; I170-L173 PolarHBondContact O-N 3.19Å; R171-L173 VanDerWaalsContact C-N 3.31Å; R171-L173 PolarHBondContact O-N 2.92Å
174Y97.8Very high95.8Very high63 Ų6354.1 Ų54.125%0.24727%0.273CS..THydrogen-bonded Turntrans-107.112.7-176.2-73.5-97.4000113.6C129 Y132 P133 I170 R171 G172 G176 F177C129-Y174 PolarHBondContact O-OH 2.93Å; Y132-Y174 HydrophobicContact CD1-CD1 4.08Å; Y132-Y174 HydrophobicContact CD1-CG 4.36Å; Y132-Y174 HydrophobicContact CG-CD1 4.15Å; Y132-Y174 HydrophobicContact CG-CE1 4.46Å; P133-Y174 WeakPolarHBondContact CD-OH 3.29Å; P133-Y174 HydrophobicContact CG-CE1 4.49Å; P133-Y174 HydrophobicContact CG-CE2 3.64Å; P133-Y174 WeakPolarHBondContact CG-OH 3.34Å; I170-Y174 HydrophobicContact CG2-CD2 3.8Å; I170-Y174 HydrophobicContact CG2-CE2 3.76Å; I170-Y174 WeakPolarHBondContact O-CD2 3.23Å; I170-Y174 PolarHBondContact O-N 3.23Å; R171-Y174 PolarHBondContact O-N 3.4Å; G172-Y174 VanDerWaalsContact C-N 3.28Å; G172-Y174 PolarHBondContact O-N 2.74Å; Y174-G176 PolarHBondContact O-N 3.11Å; Y174-F177 AromaticContact CD1-CD2 3.88Å; Y174-F177 HydrophobicContact CD1-CD2 3.88Å; Y174-F177 HydrophobicContact CD1-CE2 4.41Å; Y174-F177 HydrophobicContact CE1-CD2 4.49Å; Y174-F177 VanDerWaalsContact O-CB 3.25Å; Y174-F177 WeakPolarHBondContact O-CB 3.02Å; Y174-F177 PolarHBondContact O-N 2.61Å
175Q97.3Very high95.7Very high50 Ų5057 Ų5723%0.23429%0.288CS..THydrogen-bonded Turntrans-58.1126.9175.5-77.4-71.411.900111.4Y132 R171 M239 S242Y132-Q175 WeakPolarHBondContact CE1-O 3.35Å; Y132-Q175 PolarHBondContact OH-O 3.4Å; R171-Q175 PolarHBondContact O-N 2.75Å; Q175-M239 WeakPolarHBondContact O-CG 3.25Å; Q175-S242 VanDerWaalsContact CG-OG 3.29Å; Q175-S242 WeakPolarHBondContact CG-OG 3.4Å
176G96.1Very high95.6Very high4 Ų457.8 Ų57.84%0.04129%0.287CS..THydrogen-bonded Turntrans885-175.500000115.5Y132 Y174 N178 V179 S180Y132-G176 WeakPolarHBondContact OH-CA 3.49Å; Y132-G176 PolarHBondContact OH-O 2.72Å; Y174-G176 PolarHBondContact O-N 3.11Å; G176-N178 PolarHBondContact O-N 3.46Å; G176-V179 WeakPolarHBondContact O-CG1 3.28Å; G176-V179 PolarHBondContact O-N 3.37Å; G176-S180 WeakPolarHBondContact O-CB 3.42Å; G176-S180 PolarHBondContact O-N 2.67Å
177F96.9Very high95.6Very high41 Ų4153.1 Ų53.118%0.1827%0.266CS..Hα-helixtrans-55.2-49.5-179.1-176.4-91.5000112.7L128 Y132 Y174 V179 S180 V181L128-F177 HydrophobicContact CB-CD2 4.24Å; L128-F177 HydrophobicContact CB-CE2 3.53Å; L128-F177 HydrophobicContact CB-CZ 4.3Å; Y132-F177 AromaticContact CD2-CD2 3.76Å; Y132-F177 HydrophobicContact CD2-CD2 3.76Å; Y132-F177 HydrophobicContact CE2-CB 4.3Å; Y132-F177 HydrophobicContact CE2-CD2 4.2Å; Y132-F177 HydrophobicContact CG-CD2 4.1Å; Y132-F177 PolarHBondContact OH-N 3.28Å; Y174-F177 AromaticContact CD1-CD2 3.88Å; Y174-F177 HydrophobicContact CD1-CD2 3.88Å; Y174-F177 HydrophobicContact CD1-CE2 4.41Å; Y174-F177 HydrophobicContact CE1-CD2 4.49Å; Y174-F177 VanDerWaalsContact O-CB 3.25Å; Y174-F177 WeakPolarHBondContact O-CB 3.02Å; Y174-F177 PolarHBondContact O-N 2.61Å; F177-V179 PolarHBondContact O-N 3.23Å; F177-S180 WeakPolarHBondContact O-CA 3.42Å; F177-S180 WeakPolarHBondContact O-CB 3.42Å; F177-S180 PolarHBondContact O-N 2.89Å; F177-S180 PolarHBondContact O-OG 3.03Å; F177-V181 HydrophobicContact CD1-CG2 4.2Å; F177-V181 HydrophobicContact CE1-CG2 3.79Å; F177-V181 HydrophobicContact CZ-CG2 4.06Å; F177-V181 PolarHBondContact O-N 3.41Å; F177-V181 VanDerWaalsContact O-N 3.08Å
178N95.4Very high95.4Very high110 Ų11054.2 Ų54.259%0.58826%0.263SS*.Hα-helixtrans-60.1-47.3-176.6-65-8.7000112.8G176 S180 V181 Q182G176-N178 PolarHBondContact O-N 3.46Å; N178-S180 PolarHBondContact O-N 2.87Å; N178-V181 PolarHBondContact O-N 3.32Å; N178-Q182 WeakPolarHBondContact O-CG 3.47Å; N178-Q182 PolarHBondContact O-N 3.07Å; N178-Q182 VanDerWaalsContact O-N 3.13Å
179V96.9Very high95.3Very high0 Ų053 Ų530%026%0.26CS..Hα-helixtrans-68.1-27178.365.70000111.7G176 F177 G183 F231 V234 R235 T254 W258G176-V179 WeakPolarHBondContact O-CG1 3.28Å; G176-V179 PolarHBondContact O-N 3.37Å; F177-V179 PolarHBondContact O-N 3.23Å; V179-G183 PolarHBondContact O-N 2.97Å; V179-F231 HydrophobicContact CG2-CB 4.11Å; V179-F231 HydrophobicContact CG2-CD1 3.8Å; V179-F231 HydrophobicContact CG2-CG 4.4Å; V179-V234 HydrophobicContact CG1-CG1 4.28Å; V179-V234 HydrophobicContact CG2-CB 4.22Å; V179-V234 HydrophobicContact CG2-CG1 4.15Å; V179-R235 HydrophobicContact CG1-CB 3.85Å; V179-T254 HydrophobicContact CB-CG2 3.73Å; V179-T254 HydrophobicContact CG1-CG2 4.28Å; V179-T254 HydrophobicContact CG2-CG2 4.1Å; V179-W258 HydrophobicContact CG2-CZ2 4.31Å
180S96.1Very high95.2Very high6 Ų652.4 Ų52.44%0.04225%0.252CS..Hα-helixtrans-68-39.9173.8820000112.8L128 Y132 G176 F177 N178 G183 I184 R235L128-S180 WeakPolarHBondContact CD1-OG 3.4Å; Y132-S180 WeakPolarHBondContact CE2-OG 3.29Å; G176-S180 WeakPolarHBondContact O-CB 3.42Å; G176-S180 PolarHBondContact O-N 2.67Å; F177-S180 WeakPolarHBondContact O-CA 3.42Å; F177-S180 WeakPolarHBondContact O-CB 3.42Å; F177-S180 PolarHBondContact O-N 2.89Å; F177-S180 PolarHBondContact O-OG 3.03Å; N178-S180 PolarHBondContact O-N 2.87Å; S180-G183 PolarHBondContact O-N 3.18Å; S180-I184 WeakPolarHBondContact O-CG1 3.41Å; S180-I184 PolarHBondContact O-N 3.07Å; S180-R235 VanDerWaalsContact CB-CD 3.41Å; S180-R235 VanDerWaalsContact CB-NE 3.35Å
181V95.6Very high95Very high27 Ų2749.2 Ų49.216%0.16423%0.232CC..Hα-helixtrans-67.1-43.5176.4176.40000110.4A125 L128 F177 N178 G183 I184 I185A125-V181 HydrophobicContact CB-CG1 4.13Å; A125-V181 HydrophobicContact CB-CG2 3.91Å; L128-V181 HydrophobicContact CD1-CG2 4.49Å; F177-V181 HydrophobicContact CD1-CG2 4.2Å; F177-V181 HydrophobicContact CE1-CG2 3.79Å; F177-V181 HydrophobicContact CZ-CG2 4.06Å; F177-V181 PolarHBondContact O-N 3.41Å; F177-V181 VanDerWaalsContact O-N 3.08Å; N178-V181 PolarHBondContact O-N 3.32Å; V181-G183 VanDerWaalsContact C-N 3.32Å; V181-G183 PolarHBondContact O-N 3.2Å; V181-I184 WeakPolarHBondContact O-CB 3.39Å; V181-I184 PolarHBondContact O-N 3.47Å; V181-I185 HydrophobicContact CG1-CD1 4.39Å; V181-I185 PolarHBondContact O-N 3.24Å; V181-I185 VanDerWaalsContact O-N 3.16Å
182Q96.3Very high94.7Very high93 Ų9342 Ų4244%0.43521%0.206SC..Hα-helixtrans-57.1-46.8172.4-67.3169.14.900111.1N178 I184 I185 I186 F231N178-Q182 WeakPolarHBondContact O-CG 3.47Å; N178-Q182 PolarHBondContact O-N 3.07Å; N178-Q182 VanDerWaalsContact O-N 3.13Å; Q182-I184 VanDerWaalsContact C-N 3.3Å; Q182-I184 PolarHBondContact O-N 3.25Å; Q182-I185 PolarHBondContact O-N 3.24Å; Q182-I185 VanDerWaalsContact O-N 3.11Å; Q182-I186 WeakPolarHBondContact O-CG1 3.21Å; Q182-I186 PolarHBondContact O-N 3.4Å; Q182-F231 HydrophobicContact CB-CD1 3.89Å; Q182-F231 HydrophobicContact CB-CE1 3.9Å
183G96Very high94.2Very high10 Ų1043.3 Ų43.310%0.10322%0.22CC..Hα-helixtrans-58.3-37.7176.600000113.5V179 S180 V181 Y187V179-G183 PolarHBondContact O-N 2.97Å; S180-G183 PolarHBondContact O-N 3.18Å; V181-G183 VanDerWaalsContact C-N 3.32Å; V181-G183 PolarHBondContact O-N 3.2Å; G183-Y187 WeakPolarHBondContact O-CB 3.23Å; G183-Y187 PolarHBondContact O-N 2.98Å
184I93.7Very high93.7Very high41 Ų4145.1 Ų45.121%0.2123%0.229CC..Hα-helixtrans-63.3-43.7174.8-71.6167.6000111.3L128 S180 V181 Q182 R188L128-I184 HydrophobicContact CD1-CD1 3.58Å; L128-I184 HydrophobicContact CG-CD1 4.37Å; S180-I184 WeakPolarHBondContact O-CG1 3.41Å; S180-I184 PolarHBondContact O-N 3.07Å; V181-I184 WeakPolarHBondContact O-CB 3.39Å; V181-I184 PolarHBondContact O-N 3.47Å; Q182-I184 VanDerWaalsContact C-N 3.3Å; Q182-I184 PolarHBondContact O-N 3.25Å; I184-R188 WeakPolarHBondContact O-CB 3.37Å; I184-R188 PolarHBondContact O-N 3.33Å
185I94.4Very high93.1Very high63 Ų6345.4 Ų45.432%0.32323%0.23SC..Hα-helixtrans-65.2-47.3179.9-64.2167.3000109.9V181 Q182 R188 A189V181-I185 HydrophobicContact CG1-CD1 4.39Å; V181-I185 PolarHBondContact O-N 3.24Å; V181-I185 VanDerWaalsContact O-N 3.16Å; Q182-I185 PolarHBondContact O-N 3.24Å; Q182-I185 VanDerWaalsContact O-N 3.11Å; I185-R188 PolarHBondContact O-N 3.44Å; I185-A189 WeakPolarHBondContact O-CB 3.46Å; I185-A189 PolarHBondContact O-N 2.93Å
186I95.9Very high92.2Very high61 Ų6145 Ų4531%0.31323%0.229SC..Hα-helixtrans-62.2-44.6177.4-62.8-59.4000111.4Q182 R188 A189 A190 T227 F231Q182-I186 WeakPolarHBondContact O-CG1 3.21Å; Q182-I186 PolarHBondContact O-N 3.4Å; I186-R188 VanDerWaalsContact C-N 3.33Å; I186-R188 PolarHBondContact O-N 3.43Å; I186-A189 PolarHBondContact O-N 3.01Å; I186-A190 WeakPolarHBondContact O-CB 3.41Å; I186-A190 PolarHBondContact O-N 3.5Å; I186-T227 HydrophobicContact CG2-CG2 4.11Å; I186-F231 HydrophobicContact CB-CE2 4.47Å; I186-F231 HydrophobicContact CG1-CE1 4.46Å; I186-F231 HydrophobicContact CG1-CE2 3.99Å; I186-F231 HydrophobicContact CG1-CZ 3.93Å; I186-F231 HydrophobicContact CG2-CE2 4.34Å
187Y94.8Very high91.6Very high79 Ų7949 Ų4931%0.3125%0.253SS..Hα-helixtrans-57.2-47.1175.6174.6-94.1000111.2G183 Y191 A224G183-Y187 WeakPolarHBondContact O-CB 3.23Å; G183-Y187 PolarHBondContact O-N 2.98Å; Y187-Y191 VanDerWaalsContact O-CB 3.22Å; Y187-Y191 WeakPolarHBondContact O-CB 3.1Å; Y187-Y191 PolarHBondContact O-N 2.88Å; Y187-A224 HydrophobicContact CD2-CB 3.97Å; Y187-A224 HydrophobicContact CE2-CB 3.85Å
188R90.4Very high90.8Very high68 Ų6848.1 Ų48.126%0.25725%0.253SS..Hα-helixtrans-65.4-43.6178.2-84.9-172.5137.2129.8-9.5112.3L117 G120 I184 I185 I186 A190 Y191 F192L117-R188 HydrophobicContact CD2-CB 3.85Å; G120-R188 PolarHBondContact O-NH1 3.16Å; I184-R188 WeakPolarHBondContact O-CB 3.37Å; I184-R188 PolarHBondContact O-N 3.33Å; I185-R188 PolarHBondContact O-N 3.44Å; I186-R188 VanDerWaalsContact C-N 3.33Å; I186-R188 PolarHBondContact O-N 3.43Å; R188-A190 PolarHBondContact O-N 2.94Å; R188-Y191 PolarHBondContact O-N 3.5Å; R188-F192 HydrophobicContact CB-CD2 4.46Å; R188-F192 VanDerWaalsContact O-CD2 3.29Å; R188-F192 WeakPolarHBondContact O-CD2 3.34Å; R188-F192 PolarHBondContact O-N 3.16Å
189A91.9Very high89.8Confident25 Ų2547.3 Ų47.321%0.20725%0.245CC..Hα-helixtrans-58.5-48.917800000111.4F113 L117 I185 I186 G193F113-A189 HydrophobicContact CZ-CB 3.99Å; L117-A189 HydrophobicContact CD1-CB 3.96Å; L117-A189 HydrophobicContact CD2-CB 3.85Å; I185-A189 WeakPolarHBondContact O-CB 3.46Å; I185-A189 PolarHBondContact O-N 2.93Å; I186-A189 PolarHBondContact O-N 3.01Å; A189-G193 PolarHBondContact O-N 3.43Å
190A93.6Very high88.7Confident17 Ų1750.6 Ų50.614%0.1428%0.279CS..Hα-helixtrans-62.5-46.7175.500000111.5I186 R188 F192 G193 I194 A224 T227I186-A190 WeakPolarHBondContact O-CB 3.41Å; I186-A190 PolarHBondContact O-N 3.5Å; R188-A190 PolarHBondContact O-N 2.94Å; A190-F192 PolarHBondContact O-N 3.4Å; A190-G193 PolarHBondContact O-N 3.45Å; A190-I194 HydrophobicContact CB-CD1 4.34Å; A190-I194 WeakPolarHBondContact O-CB 3.24Å; A190-I194 VanDerWaalsContact O-CD1 3.29Å; A190-I194 WeakPolarHBondContact O-CD1 3.42Å; A190-I194 WeakPolarHBondContact O-CG1 3.34Å; A190-I194 PolarHBondContact O-N 3.49Å; A190-A224 HydrophobicContact CB-CB 3.98Å; A190-T227 HydrophobicContact CB-CG2 4.13Å
191Y91.1Very high87.8Confident60 Ų6057.6 Ų57.624%0.23531%0.312CS..Hα-helixtrans-57.8-52.4-179.7-174.1-85000111.8Y187 R188 Y195 V220 A224Y187-Y191 VanDerWaalsContact O-CB 3.22Å; Y187-Y191 WeakPolarHBondContact O-CB 3.1Å; Y187-Y191 PolarHBondContact O-N 2.88Å; R188-Y191 PolarHBondContact O-N 3.5Å; Y191-Y195 WeakPolarHBondContact O-CB 3.29Å; Y191-Y195 PolarHBondContact O-N 3.43Å; Y191-V220 HydrophobicContact CD2-CG1 3.68Å; Y191-V220 HydrophobicContact CE2-CG1 3.77Å; Y191-V220 HydrophobicContact CG-CG1 4.09Å; Y191-A224 HydrophobicContact CD2-CB 4.36Å
192F85.9Confident86.9Confident50 Ų5058.1 Ų58.122%0.21931%0.314CS..Hα-helixtrans-68.2-43.4-179.1-80.8-75.2000112.3F113 N116 R188 A190 I194 Y195 D196F113-F192 HydrophobicContact CE2-CB 4.19Å; N116-F192 WeakPolarHBondContact ND2-CD2 3.31Å; N116-F192 WeakPolarHBondContact ND2-CE2 3.46Å; N116-F192 WeakPolarHBondContact ND2-CZ 3.48Å; R188-F192 HydrophobicContact CB-CD2 4.46Å; R188-F192 VanDerWaalsContact O-CD2 3.29Å; R188-F192 WeakPolarHBondContact O-CD2 3.34Å; R188-F192 PolarHBondContact O-N 3.16Å; A190-F192 PolarHBondContact O-N 3.4Å; F192-I194 PolarHBondContact O-N 3.24Å; F192-Y195 PolarHBondContact O-N 3.27Å; F192-D196 WeakPolarHBondContact O-CB 3.46Å; F192-D196 PolarHBondContact O-N 3.49Å
193G84.5Confident85.6Confident29 Ų2960 Ų6030%0.29933%0.334SS..Hα-helixtrans-59.9-45.6178.700000112.5A189 A190 T197A189-G193 PolarHBondContact O-N 3.43Å; A190-G193 PolarHBondContact O-N 3.45Å; G193-T197 WeakPolarHBondContact O-CB 3.24Å; G193-T197 PolarHBondContact O-N 2.93Å; G193-T197 PolarHBondContact O-OG1 3.43Å
194I87.2Confident84.6Confident51 Ų5162.6 Ų62.626%0.26235%0.346SS..Hα-helixtrans-71.6-41.4179.1-58.3162.9000110.4A190 F192 T197 A198 V220 V223A190-I194 HydrophobicContact CB-CD1 4.34Å; A190-I194 WeakPolarHBondContact O-CB 3.24Å; A190-I194 VanDerWaalsContact O-CD1 3.29Å; A190-I194 WeakPolarHBondContact O-CD1 3.42Å; A190-I194 WeakPolarHBondContact O-CG1 3.34Å; A190-I194 PolarHBondContact O-N 3.49Å; F192-I194 PolarHBondContact O-N 3.24Å; I194-T197 PolarHBondContact O-N 3Å; I194-A198 VanDerWaalsContact O-CB 3.22Å; I194-A198 WeakPolarHBondContact O-CB 3.45Å; I194-A198 PolarHBondContact O-N 2.89Å; I194-V220 HydrophobicContact CB-CG1 4.41Å; I194-V220 HydrophobicContact CG2-CB 4.48Å; I194-V220 HydrophobicContact CG2-CG1 4.48Å; I194-V220 HydrophobicContact CG2-CG2 3.95Å; I194-V223 HydrophobicContact CD1-CB 3.81Å; I194-V223 HydrophobicContact CD1-CG1 3.38Å
195Y84.3Confident83.2Confident69 Ų6964 Ų6427%0.27136%0.358SS..Hα-helixtrans-64.7-44.2-179.7-171-102000112.8Y191 F192 T197 A198 K199 V220Y191-Y195 WeakPolarHBondContact O-CB 3.29Å; Y191-Y195 PolarHBondContact O-N 3.43Å; F192-Y195 PolarHBondContact O-N 3.27Å; Y195-T197 VanDerWaalsContact C-N 3.35Å; Y195-A198 PolarHBondContact O-N 3.44Å; Y195-K199 HydrophobicContact CD1-CD 4.09Å; Y195-K199 HydrophobicContact CD1-CG 4.49Å; Y195-K199 HydrophobicContact CE1-CD 3.57Å; Y195-K199 HydrophobicContact CE1-CG 4.24Å; Y195-K199 VanDerWaalsContact CE1-NZ 3.28Å; Y195-K199 WeakPolarHBondContact O-CB 3.09Å; Y195-K199 PolarHBondContact O-N 3.33Å; Y195-K199 WeakPolarHBondContact OH-CE 3.46Å; Y195-K199 PolarHBondContact OH-NZ 2.91Å; Y195-V220 HydrophobicContact CD2-CG1 4.38Å; Y195-V220 HydrophobicContact CD2-CG2 4.28Å
196D80.3Confident82Confident40 Ų4070.2 Ų70.221%0.21438%0.382CS..Hα-helixtrans-65.7-39.8177.7-77.2-27.1000110.5K105 F192 K199 G200K105-D196 IonicContact NZ-OD1 3.95Å; K105-D196 PolarHBondContact NZ-OD1 3.04Å; K105-D196 VanDerWaalsContact NZ-OD1 3.1Å; K105-D196 IonicContact NZ-OD2 3.35Å; F192-D196 WeakPolarHBondContact O-CB 3.46Å; F192-D196 PolarHBondContact O-N 3.49Å; D196-K199 PolarHBondContact O-N 2.9Å; D196-G200 PolarHBondContact O-N 3.15Å; D196-G200 VanDerWaalsContact O-N 3.08Å
197T81.8Confident81Confident88 Ų8873.7 Ų73.754%0.5440%0.402SS..Hα-helixtrans-63.7-48.2174-53.60000111.6G193 I194 Y195 K199 G200 M201G193-T197 WeakPolarHBondContact O-CB 3.24Å; G193-T197 PolarHBondContact O-N 2.93Å; G193-T197 PolarHBondContact O-OG1 3.43Å; I194-T197 PolarHBondContact O-N 3Å; Y195-T197 VanDerWaalsContact C-N 3.35Å; T197-K199 VanDerWaalsContact C-N 3.29Å; T197-K199 PolarHBondContact O-N 3.21Å; T197-G200 PolarHBondContact O-N 3.33Å; T197-G200 VanDerWaalsContact O-N 3.11Å; T197-M201 HydrophobicContact CG2-SD 4.23Å; T197-M201 WeakPolarHBondContact O-CG 3.2Å; T197-M201 PolarHBondContact O-N 3Å; T197-M201 VanDerWaalsContact O-N 3.15Å
198A80.3Confident80Confident23 Ų2371.4 Ų71.419%0.1940%0.396CS..Hα-helixtrans-61.2-37.8179.400000112I194 Y195 M201 L202 I216I194-A198 VanDerWaalsContact O-CB 3.22Å; I194-A198 WeakPolarHBondContact O-CB 3.45Å; I194-A198 PolarHBondContact O-N 2.89Å; Y195-A198 PolarHBondContact O-N 3.44Å; A198-M201 PolarHBondContact O-N 3.38Å; A198-L202 PolarHBondContact O-N 3.1Å; A198-I216 HydrophobicContact CB-CG2 4.09Å
199K74.9Confident79.5Confident94 Ų9473.8 Ų73.841%0.40941%0.41SS..Hα-helixtrans-66.2-38.7173.5-84.8-169.3165.3176.70113.4Y195 D196 T197 M201 L202Y195-K199 HydrophobicContact CD1-CD 4.09Å; Y195-K199 HydrophobicContact CD1-CG 4.49Å; Y195-K199 HydrophobicContact CE1-CD 3.57Å; Y195-K199 HydrophobicContact CE1-CG 4.24Å; Y195-K199 VanDerWaalsContact CE1-NZ 3.28Å; Y195-K199 WeakPolarHBondContact O-CB 3.09Å; Y195-K199 PolarHBondContact O-N 3.33Å; Y195-K199 WeakPolarHBondContact OH-CE 3.46Å; Y195-K199 PolarHBondContact OH-NZ 2.91Å; D196-K199 PolarHBondContact O-N 2.9Å; T197-K199 VanDerWaalsContact C-N 3.29Å; T197-K199 PolarHBondContact O-N 3.21Å; K199-M201 PolarHBondContact O-N 3.4Å; K199-L202 PolarHBondContact O-N 3.23Å
200G74.6Confident78.9Confident69 Ų6978.9 Ų78.971%0.71143%0.432SS*.Hα-helixtrans-66.4-24.8176.900000113.6D196 T197D196-G200 PolarHBondContact O-N 3.15Å; D196-G200 VanDerWaalsContact O-N 3.08Å; T197-G200 PolarHBondContact O-N 3.33Å; T197-G200 VanDerWaalsContact O-N 3.11Å
201M77Confident78.3Confident152 Ų15283 Ų8375%0.74945%0.451SS*.THydrogen-bonded Turntrans-87.8-9.4177.8-64178.174.200113.8T197 A198 K199T197-M201 HydrophobicContact CG2-SD 4.23Å; T197-M201 WeakPolarHBondContact O-CG 3.2Å; T197-M201 PolarHBondContact O-N 3Å; T197-M201 VanDerWaalsContact O-N 3.15Å; A198-M201 PolarHBondContact O-N 3.38Å; K199-M201 PolarHBondContact O-N 3.4Å
202L76.6Confident77.9Confident38 Ų3882.9 Ų82.920%0.19946%0.456CS..  trans-79.7127.2179.5-81.9170.1000110.7A198 K199 D204 P205 T208 I216A198-L202 PolarHBondContact O-N 3.1Å; K199-L202 PolarHBondContact O-N 3.23Å; L202-D204 VanDerWaalsContact C-N 3.34Å; L202-D204 PolarHBondContact O-N 2.85Å; L202-P205 HydrophobicContact CB-CG 4.08Å; L202-T208 HydrophobicContact CD2-CG2 4.5Å; L202-I216 HydrophobicContact CD1-CD1 3.81Å; L202-I216 HydrophobicContact CD2-CD1 3.69Å; L202-I216 HydrophobicContact CG-CD1 4.09Å
203P69.3Low77.7Confident132 Ų13282.9 Ų82.986%0.85746%0.463SS*.SBendtrans-61.2-38.8-179.3-22.231.4000113.5
204D73.6Confident77.6Confident66 Ų6685.3 Ų85.335%0.35346%0.463SS..  trans-142.793.8172.9-172.8-16.7000110.7L202 K206 N207 T208L202-D204 VanDerWaalsContact C-N 3.34Å; L202-D204 PolarHBondContact O-N 2.85Å; D204-K206 PolarHBondContact O-N 3.41Å; D204-K206 VanDerWaalsContact O-N 3.14Å; D204-K206 PolarHBondContact OD1-N 2.98Å; D204-N207 PolarHBondContact O-N 3.31Å; D204-N207 PolarHBondContact OD1-N 2.95Å; D204-N207 VanDerWaalsContact OD1-N 3.1Å; D204-N207 WeakPolarHBondContact OD2-CB 3.34Å; D204-N207 PolarHBondContact OD2-ND2 3.36Å; D204-T208 PolarHBondContact O-N 3.22Å; D204-T208 PolarHBondContact O-OG1 3.37Å
205P65.8Low77.6Confident70 Ų7087.7 Ų87.746%0.45547%0.474SS..THydrogen-bonded Turntrans-63.3-17.2180-21.131.7000114.5L202L202-P205 HydrophobicContact CB-CG 4.08Å
206K67.9Low77.7Confident194 Ų19486.3 Ų86.384%0.84347%0.471SS*.THydrogen-bonded Turntrans-93.4-31.2-176.7-70.3-176.7178.2179.70112.6D204D204-K206 PolarHBondContact O-N 3.41Å; D204-K206 VanDerWaalsContact O-N 3.14Å; D204-K206 PolarHBondContact OD1-N 2.98Å
207N74.2Confident78Confident134 Ų13485.7 Ų85.772%0.71747%0.472SS*.THydrogen-bonded Turntrans-104.913178.6-64.6-43.2000114D204 H209D204-N207 PolarHBondContact O-N 3.31Å; D204-N207 PolarHBondContact OD1-N 2.95Å; D204-N207 VanDerWaalsContact OD1-N 3.1Å; D204-N207 WeakPolarHBondContact OD2-CB 3.34Å; D204-N207 PolarHBondContact OD2-ND2 3.36Å; N207-H209 PolarHBondContact O-N 2.94Å
208T75Confident78.4Confident31 Ų3182.6 Ų82.619%0.1945%0.451CS..  trans-66.5129.4176.9-64.30000111.1L202 D204 I210 V212L202-T208 HydrophobicContact CD2-CG2 4.5Å; D204-T208 PolarHBondContact O-N 3.22Å; D204-T208 PolarHBondContact O-OG1 3.37Å; T208-I210 PolarHBondContact O-N 3.43Å; T208-V212 HydrophobicContact CG2-CB 3.63Å; T208-V212 HydrophobicContact CG2-CG1 3.59Å
209H80.3Confident78.9Confident118 Ų11885.6 Ų85.655%0.54647%0.467SS..  trans-51.9139.8177.6-170.9-94.9000112N207 L211 V212 S213N207-H209 PolarHBondContact O-N 2.94Å; H209-L211 WeakPolarHBondContact ND1-CB 3.28Å; H209-L211 PolarHBondContact ND1-N 3.23Å; H209-L211 PolarHBondContact O-N 2.94Å; H209-L211 VanDerWaalsContact O-N 3.12Å; H209-V212 HydrophobicContact CB-CG2 4.32Å; H209-V212 WeakPolarHBondContact O-CB 3.33Å; H209-V212 PolarHBondContact O-N 3.41Å; H209-S213 PolarHBondContact O-N 3.49Å; H209-S213 VanDerWaalsContact O-N 3.08Å
210I79.1Confident79.7Confident131 Ų13181.2 Ų81.267%0.67245%0.448SS*.Hα-helixtrans-55.2-37.1-173.1-166.9166.2000113.1T208 S213 W214T208-I210 PolarHBondContact O-N 3.43Å; I210-S213 PolarHBondContact O-N 3.26Å; I210-W214 WeakPolarHBondContact O-CB 3.35Å; I210-W214 PolarHBondContact O-N 3.41Å
211L81.3Confident80.5Confident105 Ų10580 Ų8055%0.5543%0.427SS..Hα-helixtrans-65-39.1176.7-64.6176.1000112.5H209 W214 M215H209-L211 WeakPolarHBondContact ND1-CB 3.28Å; H209-L211 PolarHBondContact ND1-N 3.23Å; H209-L211 PolarHBondContact O-N 2.94Å; H209-L211 VanDerWaalsContact O-N 3.12Å; L211-W214 PolarHBondContact O-N 3.45Å; L211-M215 WeakPolarHBondContact O-CB 3.42Å; L211-M215 VanDerWaalsContact O-CG 3.31Å; L211-M215 WeakPolarHBondContact O-CG 3.45Å; L211-M215 PolarHBondContact O-N 3.37Å
212V82.6Confident81.4Confident56 Ų5673.8 Ų73.834%0.33940%0.4SS..Hα-helixtrans-69-45.3178.8177.60000109.7T208 H209 W214 M215 I216T208-V212 HydrophobicContact CG2-CB 3.63Å; T208-V212 HydrophobicContact CG2-CG1 3.59Å; H209-V212 HydrophobicContact CB-CG2 4.32Å; H209-V212 WeakPolarHBondContact O-CB 3.33Å; H209-V212 PolarHBondContact O-N 3.41Å; V212-W214 VanDerWaalsContact C-N 3.28Å; V212-W214 PolarHBondContact O-N 3.21Å; V212-M215 HydrophobicContact CG2-CE 4.15Å; V212-M215 PolarHBondContact O-N 3.27Å; V212-I216 HydrophobicContact CG1-CD1 3.96Å; V212-I216 VanDerWaalsContact O-CG1 3.31Å; V212-I216 WeakPolarHBondContact O-CG1 3.48Å; V212-I216 PolarHBondContact O-N 2.99Å
213S80.7Confident82.2Confident51 Ų5174.7 Ų74.736%0.35741%0.407SS..Hα-helixtrans-57.7-40.5173.5-67.90000112.2H209 I210 A217H209-S213 PolarHBondContact O-N 3.49Å; H209-S213 VanDerWaalsContact O-N 3.08Å; I210-S213 PolarHBondContact O-N 3.26Å; S213-A217 WeakPolarHBondContact O-CB 3.48Å; S213-A217 PolarHBondContact O-N 3Å
214W83.4Confident83.5Confident80 Ų8068.4 Ų68.430%0.30337%0.366SS..Hα-helixtrans-65.9-47175.2-17988.2000112.1I210 L211 V212 I216 A217 Q218I210-W214 WeakPolarHBondContact O-CB 3.35Å; I210-W214 PolarHBondContact O-N 3.41Å; L211-W214 PolarHBondContact O-N 3.45Å; V212-W214 VanDerWaalsContact C-N 3.28Å; V212-W214 PolarHBondContact O-N 3.21Å; W214-I216 VanDerWaalsContact C-N 3.31Å; W214-I216 PolarHBondContact O-N 3.35Å; W214-A217 WeakPolarHBondContact O-CB 3.3Å; W214-A217 PolarHBondContact O-N 3.49Å; W214-A217 VanDerWaalsContact O-N 3.17Å; W214-Q218 HydrophobicContact CD2-CG 3.9Å; W214-Q218 HydrophobicContact CE3-CG 4.13Å; W214-Q218 HydrophobicContact CH2-CG 3.95Å; W214-Q218 HydrophobicContact CZ2-CG 3.7Å; W214-Q218 HydrophobicContact CZ3-CG 4.16Å; W214-Q218 WeakPolarHBondContact O-CG 3.46Å; W214-Q218 PolarHBondContact O-N 2.99Å
215M86.4Confident84.5Confident101 Ų10165.7 Ų65.750%0.49835%0.354SS..Hα-helixtrans-60.4-39.9177.6-74.8-171.6-64.300112.2L211 V212 Q218 T219L211-M215 WeakPolarHBondContact O-CB 3.42Å; L211-M215 VanDerWaalsContact O-CG 3.31Å; L211-M215 WeakPolarHBondContact O-CG 3.45Å; L211-M215 PolarHBondContact O-N 3.37Å; V212-M215 HydrophobicContact CG2-CE 4.15Å; V212-M215 PolarHBondContact O-N 3.27Å; M215-Q218 PolarHBondContact O-N 2.63Å; M215-T219 WeakPolarHBondContact O-CB 3.01Å; M215-T219 PolarHBondContact O-N 2.97Å; M215-T219 PolarHBondContact O-OG1 2.89Å
216I86.5Confident85.9Confident39 Ų3965.5 Ų65.520%0.235%0.349CS..Hα-helixtrans-64-47.1175-68.5168.9000110.1A198 L202 V212 W214 Q218 T219 V220A198-I216 HydrophobicContact CB-CG2 4.09Å; L202-I216 HydrophobicContact CD1-CD1 3.81Å; L202-I216 HydrophobicContact CD2-CD1 3.69Å; L202-I216 HydrophobicContact CG-CD1 4.09Å; V212-I216 HydrophobicContact CG1-CD1 3.96Å; V212-I216 VanDerWaalsContact O-CG1 3.31Å; V212-I216 WeakPolarHBondContact O-CG1 3.48Å; V212-I216 PolarHBondContact O-N 2.99Å; W214-I216 VanDerWaalsContact C-N 3.31Å; W214-I216 PolarHBondContact O-N 3.35Å; I216-Q218 VanDerWaalsContact C-N 3.3Å; I216-Q218 PolarHBondContact O-N 2.93Å; I216-T219 PolarHBondContact O-N 2.99Å; I216-V220 HydrophobicContact CG2-CG2 4.21Å; I216-V220 WeakPolarHBondContact O-CB 3.11Å; I216-V220 WeakPolarHBondContact O-CG2 3.44Å; I216-V220 PolarHBondContact O-N 3.36Å
217A86.6Confident87.3Confident28 Ų2859.7 Ų59.723%0.23133%0.329CS..Hα-helixtrans-59.4-40.4177.100000112.3S213 W214 T221S213-A217 WeakPolarHBondContact O-CB 3.48Å; S213-A217 PolarHBondContact O-N 3Å; W214-A217 WeakPolarHBondContact O-CB 3.3Å; W214-A217 PolarHBondContact O-N 3.49Å; W214-A217 VanDerWaalsContact O-N 3.17Å; A217-T221 VanDerWaalsContact O-CB 3.3Å; A217-T221 WeakPolarHBondContact O-CB 3.37Å; A217-T221 PolarHBondContact O-N 3Å; A217-T221 PolarHBondContact O-OG1 3.34Å
218Q90.5Very high88.4Confident23 Ų2354 Ų5411%0.10730%0.3CS..Hα-helixtrans-66.3-43.1174.8-65.9-44.7-54.700112W214 M215 I216 T221 A222 A285W214-Q218 HydrophobicContact CD2-CG 3.9Å; W214-Q218 HydrophobicContact CE3-CG 4.13Å; W214-Q218 HydrophobicContact CH2-CG 3.95Å; W214-Q218 HydrophobicContact CZ2-CG 3.7Å; W214-Q218 HydrophobicContact CZ3-CG 4.16Å; W214-Q218 WeakPolarHBondContact O-CG 3.46Å; W214-Q218 PolarHBondContact O-N 2.99Å; M215-Q218 PolarHBondContact O-N 2.63Å; I216-Q218 VanDerWaalsContact C-N 3.3Å; I216-Q218 PolarHBondContact O-N 2.93Å; Q218-T221 PolarHBondContact O-N 3.42Å; Q218-A222 WeakPolarHBondContact O-CB 3.22Å; Q218-A222 PolarHBondContact O-N 3.47Å; Q218-A285 VanDerWaalsContact NE2-CB 3.28Å
219T91.4Very high89.5Confident85 Ų8552.6 Ų52.652%0.52129%0.291SS..Hα-helixtrans-62.5-49179.1-58.10000111M215 I216 T221 A222 V223M215-T219 WeakPolarHBondContact O-CB 3.01Å; M215-T219 PolarHBondContact O-N 2.97Å; M215-T219 PolarHBondContact O-OG1 2.89Å; I216-T219 PolarHBondContact O-N 2.99Å; T219-T221 VanDerWaalsContact C-N 3.3Å; T219-T221 PolarHBondContact O-N 3.45Å; T219-A222 PolarHBondContact O-N 3.37Å; T219-V223 HydrophobicContact CG2-CG2 4.43Å; T219-V223 WeakPolarHBondContact O-CG2 3.23Å; T219-V223 PolarHBondContact O-N 2.64Å
220V91.8Very high90.3Very high2 Ų247.8 Ų47.81%0.01227%0.27CS..Hα-helixtrans-57-45.7175.4172.50000110.6Y191 I194 Y195 I216 A224Y191-V220 HydrophobicContact CD2-CG1 3.68Å; Y191-V220 HydrophobicContact CE2-CG1 3.77Å; Y191-V220 HydrophobicContact CG-CG1 4.09Å; I194-V220 HydrophobicContact CB-CG1 4.41Å; I194-V220 HydrophobicContact CG2-CB 4.48Å; I194-V220 HydrophobicContact CG2-CG1 4.48Å; I194-V220 HydrophobicContact CG2-CG2 3.95Å; Y195-V220 HydrophobicContact CD2-CG1 4.38Å; Y195-V220 HydrophobicContact CD2-CG2 4.28Å; I216-V220 HydrophobicContact CG2-CG2 4.21Å; I216-V220 WeakPolarHBondContact O-CB 3.11Å; I216-V220 WeakPolarHBondContact O-CG2 3.44Å; I216-V220 PolarHBondContact O-N 3.36Å; V220-A224 VanDerWaalsContact O-CB 3.27Å; V220-A224 WeakPolarHBondContact O-CB 3.47Å; V220-A224 PolarHBondContact O-N 3.15Å
221T91.4Very high91.2Very high43 Ų4343.6 Ų43.626%0.26425%0.248SC..Hα-helixtrans-64-41.7179.1-590000111.8A217 Q218 T219 G225A217-T221 VanDerWaalsContact O-CB 3.3Å; A217-T221 WeakPolarHBondContact O-CB 3.37Å; A217-T221 PolarHBondContact O-N 3Å; A217-T221 PolarHBondContact O-OG1 3.34Å; Q218-T221 PolarHBondContact O-N 3.42Å; T219-T221 VanDerWaalsContact C-N 3.3Å; T219-T221 PolarHBondContact O-N 3.45Å; T221-G225 PolarHBondContact O-N 3.44Å
222A94.3Very high92Very high22 Ų2240 Ų4018%0.18223%0.229CC..Hα-helixtrans-64.9-49.1178.400000111.1Q218 T219 G225 L226 V278Q218-A222 WeakPolarHBondContact O-CB 3.22Å; Q218-A222 PolarHBondContact O-N 3.47Å; T219-A222 PolarHBondContact O-N 3.37Å; A222-G225 CarbonylContact O-C 3.56Å; A222-G225 PolarHBondContact O-N 2.84Å; A222-L226 VanDerWaalsContact O-CG 3.3Å; A222-L226 WeakPolarHBondContact O-CG 3.14Å; A222-L226 PolarHBondContact O-N 2.94Å; A222-V278 HydrophobicContact CB-CG1 4.12Å; A222-V278 HydrophobicContact CB-CG2 4.34Å
223V95Very high92.7Very high58 Ų5837.3 Ų37.335%0.35221%0.212SC..Hα-helixtrans-65.1-46.6-179.8-178.80000110.9I194 T219 G225 L226 T227I194-V223 HydrophobicContact CD1-CB 3.81Å; I194-V223 HydrophobicContact CD1-CG1 3.38Å; T219-V223 HydrophobicContact CG2-CG2 4.43Å; T219-V223 WeakPolarHBondContact O-CG2 3.23Å; T219-V223 PolarHBondContact O-N 2.64Å; V223-G225 VanDerWaalsContact C-N 3.26Å; V223-G225 PolarHBondContact O-N 3.4Å; V223-L226 PolarHBondContact O-N 3.03Å; V223-L226 VanDerWaalsContact O-N 3.11Å; V223-T227 PolarHBondContact O-N 2.87Å; V223-T227 PolarHBondContact O-OG1 3.49Å
224A95Very high93.6Very high0 Ų034.9 Ų34.90%020%0.195CC..Hα-helixtrans-60-39.117500000112.2Y187 A190 Y191 V220 S228Y187-A224 HydrophobicContact CD2-CB 3.97Å; Y187-A224 HydrophobicContact CE2-CB 3.85Å; A190-A224 HydrophobicContact CB-CB 3.98Å; Y191-A224 HydrophobicContact CD2-CB 4.36Å; V220-A224 VanDerWaalsContact O-CB 3.27Å; V220-A224 WeakPolarHBondContact O-CB 3.47Å; V220-A224 PolarHBondContact O-N 3.15Å; A224-S228 PolarHBondContact O-N 2.95Å; A224-S228 VanDerWaalsContact O-N 3.09Å; A224-S228 PolarHBondContact O-OG 2.72Å
225G95.1Very high94.3Very high9 Ų932.2 Ų32.29%0.09319%0.185CC..Hα-helixtrans-60.4-44.4173.100000112.7T221 A222 V223 S228 Y229T221-G225 PolarHBondContact O-N 3.44Å; A222-G225 CarbonylContact O-C 3.56Å; A222-G225 PolarHBondContact O-N 2.84Å; V223-G225 VanDerWaalsContact C-N 3.26Å; V223-G225 PolarHBondContact O-N 3.4Å; G225-S228 PolarHBondContact O-OG 2.82Å; G225-Y229 WeakPolarHBondContact O-CA 3.31Å; G225-Y229 WeakPolarHBondContact O-CB 3.23Å; G225-Y229 PolarHBondContact O-N 2.93Å
226L96.4Very high94.8Very high66 Ų6628 Ų2835%0.34616%0.164SC..Hα-helixtrans-66.4-45.1177-71.4171.2000111.9A222 V223 S228 Y229 F271 A274 V278A222-L226 VanDerWaalsContact O-CG 3.3Å; A222-L226 WeakPolarHBondContact O-CG 3.14Å; A222-L226 PolarHBondContact O-N 2.94Å; V223-L226 PolarHBondContact O-N 3.03Å; V223-L226 VanDerWaalsContact O-N 3.11Å; L226-S228 VanDerWaalsContact C-N 3.3Å; L226-S228 PolarHBondContact O-N 3.1Å; L226-Y229 VanDerWaalsContact O-CB 3.24Å; L226-Y229 WeakPolarHBondContact O-CB 3.35Å; L226-Y229 PolarHBondContact O-N 3.38Å; L226-Y229 VanDerWaalsContact O-N 3.1Å; L226-F271 WeakPolarHBondContact O-CE1 3.12Å; L226-A274 HydrophobicContact CD2-CB 3.82Å; L226-V278 HydrophobicContact CD2-CG2 4.26Å; L226-V278 HydrophobicContact CG-CG2 4.34Å
227T96.6Very high95.3Very high71 Ų7126.2 Ų26.244%0.43616%0.155SC..Hα-helixtrans-59.7-41.1178.4-56.20000112.1I186 A190 V223I186-T227 HydrophobicContact CG2-CG2 4.11Å; A190-T227 HydrophobicContact CB-CG2 4.13Å; V223-T227 PolarHBondContact O-N 2.87Å; V223-T227 PolarHBondContact O-OG1 3.49Å
228S96.9Very high95.8Very high14 Ų1425 Ų2510%0.09814%0.144CC..Hα-helixtrans-85-6.7178.464.70000114A224 G225 L226 F231 D232A224-S228 PolarHBondContact O-N 2.95Å; A224-S228 VanDerWaalsContact O-N 3.09Å; A224-S228 PolarHBondContact O-OG 2.72Å; G225-S228 PolarHBondContact O-OG 2.82Å; L226-S228 VanDerWaalsContact C-N 3.3Å; L226-S228 PolarHBondContact O-N 3.1Å; S228-F231 WeakPolarHBondContact O-CB 3.5Å; S228-F231 PolarHBondContact O-N 3.48Å; S228-F231 VanDerWaalsContact O-N 3.12Å; S228-D232 PolarHBondContact O-N 2.97Å
229Y97.6Very high96.2Very high2 Ų224 Ų241%0.00814%0.139CC..Hα-helixtrans-61-39.9-170.7-158.4-93.9000114.6K33 G225 L226 F231 D232 T233 F270 F271 K272 G273 A274 N277K33-Y229 VanDerWaalsContact CE-OH 3.28Å; K33-Y229 WeakPolarHBondContact CE-OH 3.43Å; G225-Y229 WeakPolarHBondContact O-CA 3.31Å; G225-Y229 WeakPolarHBondContact O-CB 3.23Å; G225-Y229 PolarHBondContact O-N 2.93Å; L226-Y229 VanDerWaalsContact O-CB 3.24Å; L226-Y229 WeakPolarHBondContact O-CB 3.35Å; L226-Y229 PolarHBondContact O-N 3.38Å; L226-Y229 VanDerWaalsContact O-N 3.1Å; Y229-F231 PolarHBondContact O-N 3.41Å; Y229-D232 PolarHBondContact O-N 2.71Å; Y229-T233 WeakPolarHBondContact CE1-OG1 3.37Å; Y229-T233 PolarHBondContact O-N 3.46Å; Y229-T233 PolarHBondContact O-OG1 3.48Å; Y229-F270 WeakPolarHBondContact CD1-O 3.48Å; Y229-F271 HydrophobicContact CD1-CD1 4.39Å; Y229-K272 WeakPolarHBondContact CE1-O 3.43Å; Y229-K272 PolarHBondContact OH-O 2.96Å; Y229-K272 VanDerWaalsContact OH-O 3.09Å; Y229-G273 WeakPolarHBondContact OH-CA 3.5Å; Y229-G273 PolarHBondContact OH-O 3.42Å; Y229-A274 HydrophobicContact CD1-CB 3.86Å; Y229-A274 HydrophobicContact CD2-CB 4.33Å; Y229-A274 HydrophobicContact CE1-CB 3.85Å; Y229-A274 HydrophobicContact CE2-CB 4.31Å; Y229-A274 HydrophobicContact CG-CB 4.11Å; Y229-A274 VanDerWaalsContact CZ-CA 3.47Å; Y229-A274 PolarHBondContact OH-N 2.66Å; Y229-N277 HydrophobicContact CD2-CB 4.33Å; Y229-N277 HydrophobicContact CE2-CB 3.56Å
230P98.2Very high96.4Very high17 Ų1720.1 Ų20.111%0.1112%0.115CC..Hα-helixtrans-54.5-36.5175.1-3140000113.7T233 V234 W258 F270 F271P230-T233 PolarHBondContact O-N 2.96Å; P230-V234 PolarHBondContact O-N 3.07Å; P230-W258 HydrophobicContact CB-CH2 3.5Å; P230-W258 HydrophobicContact CB-CZ3 3.73Å; P230-F270 HydrophobicContact CB-CB 3.87Å; P230-F270 HydrophobicContact CB-CD1 4.14Å; P230-F270 HydrophobicContact CB-CG 4.15Å; P230-F270 HydrophobicContact CG-CB 4.01Å; P230-F271 HydrophobicContact CG-CE1 3.96Å; P230-F271 HydrophobicContact CG-CE2 4.06Å; P230-F271 HydrophobicContact CG-CZ 3.59Å
231F98.1Very high96.6Very high44 Ų4420.4 Ų20.419%0.19312%0.117CC..Hα-helixtrans-68.2-39.4175.9-64.8-100.5000112V179 Q182 I186 S228 Y229 T233 R235 W258V179-F231 HydrophobicContact CG2-CB 4.11Å; V179-F231 HydrophobicContact CG2-CD1 3.8Å; V179-F231 HydrophobicContact CG2-CG 4.4Å; Q182-F231 HydrophobicContact CB-CD1 3.89Å; Q182-F231 HydrophobicContact CB-CE1 3.9Å; I186-F231 HydrophobicContact CB-CE2 4.47Å; I186-F231 HydrophobicContact CG1-CE1 4.46Å; I186-F231 HydrophobicContact CG1-CE2 3.99Å; I186-F231 HydrophobicContact CG1-CZ 3.93Å; I186-F231 HydrophobicContact CG2-CE2 4.34Å; S228-F231 WeakPolarHBondContact O-CB 3.5Å; S228-F231 PolarHBondContact O-N 3.48Å; S228-F231 VanDerWaalsContact O-N 3.12Å; Y229-F231 PolarHBondContact O-N 3.41Å; F231-T233 VanDerWaalsContact C-N 3.34Å; F231-R235 VanDerWaalsContact O-CB 3.23Å; F231-R235 WeakPolarHBondContact O-CB 3.23Å; F231-R235 PolarHBondContact O-N 3.44Å; F231-W258 AromaticContact CD1-CZ2 3.99Å; F231-W258 HydrophobicContact CD1-CZ2 3.99Å; F231-W258 HydrophobicContact CD2-CH2 4.37Å; F231-W258 HydrophobicContact CD2-CZ2 4.48Å; F231-W258 HydrophobicContact CE1-CZ2 4.19Å; F231-W258 HydrophobicContact CG-CH2 4.42Å; F231-W258 HydrophobicContact CG-CZ2 4.13Å
232D97.4Very high96.8Very high28 Ų2818.3 Ų18.315%0.1510%0.104CC..Hα-helixtrans-64.3-40.9173.1-175.260.1000110.4K33 Q37 S228 Y229 R235 R236K33-D232 IonicContact NZ-OD2 2.69Å; K33-D232 PolarHBondContact NZ-OD2 3.46Å; Q37-D232 PolarHBondContact NE2-OD2 2.86Å; Q37-D232 PolarHBondContact OE1-OD2 2.96Å; S228-D232 PolarHBondContact O-N 2.97Å; Y229-D232 PolarHBondContact O-N 2.71Å; D232-R235 WeakPolarHBondContact O-CB 3.44Å; D232-R235 PolarHBondContact O-N 2.67Å; D232-R236 VanDerWaalsContact O-CG 3.28Å; D232-R236 WeakPolarHBondContact O-CG 3.47Å; D232-R236 PolarHBondContact O-N 3.35Å; D232-R236 IonicContact OD1-CZ 3.21Å; D232-R236 IonicContact OD1-NE 2.94Å; D232-R236 PolarHBondContact OD1-NE 2.94Å; D232-R236 IonicContact OD1-NH2 2.76Å; D232-R236 PolarHBondContact OD1-NH2 2.92Å
233T97.9Very high96.7Very high0 Ų018.8 Ų18.80%011%0.111CC..Hα-helixtrans-60.1-52177.3-630000111.5Q37 Y229 P230 F231 R235 R236 R237 F270Q37-T233 HydrophobicContact CG-CG2 4.2Å; Q37-T233 VanDerWaalsContact NE2-CA 3.31Å; Q37-T233 PolarHBondContact NE2-OG1 3.29Å; Y229-T233 WeakPolarHBondContact CE1-OG1 3.37Å; Y229-T233 PolarHBondContact O-N 3.46Å; Y229-T233 PolarHBondContact O-OG1 3.48Å; P230-T233 PolarHBondContact O-N 2.96Å; F231-T233 VanDerWaalsContact C-N 3.34Å; T233-R235 VanDerWaalsContact C-N 3.32Å; T233-R235 PolarHBondContact O-N 3.41Å; T233-R236 PolarHBondContact O-N 3.05Å; T233-R237 HydrophobicContact CG2-CG 4.36Å; T233-R237 VanDerWaalsContact O-CG 3.23Å; T233-R237 WeakPolarHBondContact O-CG 3.22Å; T233-R237 PolarHBondContact O-N 3.33Å; T233-F270 WeakPolarHBondContact CB-O 3.45Å; T233-F270 PolarHBondContact OG1-O 3Å
234V98.1Very high96.6Very high0 Ų017.1 Ų17.10%010%0.099CC..Hα-helixtrans-60.9-41.4177174.80000111.6V179 P230 R236 R237 M238 T254 C257 W258 I261 F270V179-V234 HydrophobicContact CG1-CG1 4.28Å; V179-V234 HydrophobicContact CG2-CB 4.22Å; V179-V234 HydrophobicContact CG2-CG1 4.15Å; P230-V234 PolarHBondContact O-N 3.07Å; V234-R236 PolarHBondContact O-N 2.85Å; V234-R237 PolarHBondContact O-N 2.99Å; V234-M238 HydrophobicContact CG1-CG 4.35Å; V234-M238 WeakPolarHBondContact O-CG 3.37Å; V234-M238 PolarHBondContact O-N 2.85Å; V234-T254 HydrophobicContact CG1-CG2 3.96Å; V234-C257 HydrophobicContact CG1-CB 3.95Å; V234-W258 HydrophobicContact CB-CZ2 4.33Å; V234-W258 HydrophobicContact CG2-CD2 3.6Å; V234-W258 HydrophobicContact CG2-CE3 3.91Å; V234-W258 HydrophobicContact CG2-CG 4.05Å; V234-W258 HydrophobicContact CG2-CH2 4.2Å; V234-W258 HydrophobicContact CG2-CZ2 3.91Å; V234-W258 HydrophobicContact CG2-CZ3 4.19Å; V234-I261 HydrophobicContact CG2-CD1 3.95Å; V234-F270 HydrophobicContact CG2-CD1 4.25Å; V234-F270 HydrophobicContact CG2-CE1 3.83Å
235R98.2Very high96.3Very high24 Ų2424.1 Ų24.19%0.09113%0.129CC..Hα-helixtrans-52.7-52.6174179.5-168.3-177.8-175.1-4.2111.3Y132 D135 V179 S180 F231 D232 T233 M238 M239Y132-R235 VanDerWaalsContact CE2-NH2 3.34Å; D135-R235 IonicContact OD2-CZ 2.71Å; D135-R235 IonicContact OD2-NH1 4Å; D135-R235 IonicContact OD2-NH2 3.64Å; D135-R235 PolarHBondContact OD2-NH2 3.09Å; V179-R235 HydrophobicContact CG1-CB 3.85Å; S180-R235 VanDerWaalsContact CB-CD 3.41Å; S180-R235 VanDerWaalsContact CB-NE 3.35Å; F231-R235 VanDerWaalsContact O-CB 3.23Å; F231-R235 WeakPolarHBondContact O-CB 3.23Å; F231-R235 PolarHBondContact O-N 3.44Å; D232-R235 WeakPolarHBondContact O-CB 3.44Å; D232-R235 PolarHBondContact O-N 2.67Å; T233-R235 VanDerWaalsContact C-N 3.32Å; T233-R235 PolarHBondContact O-N 3.41Å; R235-M238 PolarHBondContact O-N 3.42Å; R235-M239 HydrophobicContact CG-CE 4.06Å; R235-M239 WeakPolarHBondContact O-CG 3.09Å; R235-M239 PolarHBondContact O-N 2.91Å; R235-M239 VanDerWaalsContact O-N 3.1Å
236R97.9Very high96Very high14 Ų1426.7 Ų26.75%0.05316%0.155CC..Hα-helixtrans-67.8-38.5-177.3-58.3-58.7166.5-178.8-3.6111.8L34 V38 T139 D232 T233 V234 M238 M239 M240L34-R236 HydrophobicContact CD2-CG 4.34Å; V38-R236 HydrophobicContact CG1-CB 3.45Å; V38-R236 VanDerWaalsContact CG1-CB 3.45Å; V38-R236 HydrophobicContact CG1-CG 4.46Å; T139-R236 HydrophobicContact CG2-CB 4.24Å; T139-R236 HydrophobicContact CG2-CG 4.4Å; T139-R236 PolarHBondContact OG1-NH1 3.29Å; D232-R236 VanDerWaalsContact O-CG 3.28Å; D232-R236 WeakPolarHBondContact O-CG 3.47Å; D232-R236 PolarHBondContact O-N 3.35Å; D232-R236 IonicContact OD1-CZ 3.21Å; D232-R236 IonicContact OD1-NE 2.94Å; D232-R236 PolarHBondContact OD1-NE 2.94Å; D232-R236 IonicContact OD1-NH2 2.76Å; D232-R236 PolarHBondContact OD1-NH2 2.92Å; T233-R236 PolarHBondContact O-N 3.05Å; V234-R236 PolarHBondContact O-N 2.85Å; R236-M238 VanDerWaalsContact C-N 3.32Å; R236-M238 PolarHBondContact O-N 3.22Å; R236-M239 WeakPolarHBondContact O-CB 3.33Å; R236-M239 PolarHBondContact O-N 3.21Å; R236-M240 WeakPolarHBondContact O-CG 3.26Å; R236-M240 PolarHBondContact O-N 3.49Å
237R97.2Very high95.5Very high0 Ų028.7 Ų28.70%018%0.181CC..Hα-helixtrans-62.6-37.5175.5-67.2-60.8-172.185.74112.7Q37 T233 V234 M240 Q241 Y251 I261 E265Q37-R237 PolarHBondContact O-NE 2.86Å; Q37-R237 PolarHBondContact O-NH2 3.49Å; T233-R237 HydrophobicContact CG2-CG 4.36Å; T233-R237 VanDerWaalsContact O-CG 3.23Å; T233-R237 WeakPolarHBondContact O-CG 3.22Å; T233-R237 PolarHBondContact O-N 3.33Å; V234-R237 PolarHBondContact O-N 2.99Å; R237-M240 PolarHBondContact O-N 3.45Å; R237-Q241 PolarHBondContact O-NE2 2.89Å; R237-Y251 HydrophobicContact CB-CD2 4.27Å; R237-Y251 HydrophobicContact CB-CE2 3.78Å; R237-Y251 HydrophobicContact CG-CE2 4.45Å; R237-Y251 PolarHBondContact NH1-OH 3.42Å; R237-I261 HydrophobicContact CB-CD1 4.46Å; R237-I261 HydrophobicContact CG-CD1 4Å; R237-E265 IonicContact CZ-OE1 3.9Å; R237-E265 IonicContact CZ-OE2 2.78Å; R237-E265 IonicContact NH1-OE1 3.74Å; R237-E265 PolarHBondContact NH1-OE1 3.32Å; R237-E265 IonicContact NH1-OE2 3.41Å; R237-E265 IonicContact NH2-OE1 2.74Å; R237-E265 PolarHBondContact NH2-OE1 3.1Å; R237-E265 IonicContact NH2-OE2 3.57Å; R237-E265 PolarHBondContact NH2-OE2 3.36Å
238M97.9Very high95.1Very high4 Ų429.2 Ų29.22%0.0218%0.182CC..Hα-helixtrans-65.7-41.8172.3-71.7-58.5-60.200112.1V234 R235 R236 M240 Q241 C257V234-M238 HydrophobicContact CG1-CG 4.35Å; V234-M238 WeakPolarHBondContact O-CG 3.37Å; V234-M238 PolarHBondContact O-N 2.85Å; R235-M238 PolarHBondContact O-N 3.42Å; R236-M238 VanDerWaalsContact C-N 3.32Å; R236-M238 PolarHBondContact O-N 3.22Å; M238-M240 PolarHBondContact O-N 3.21Å; M238-Q241 WeakPolarHBondContact O-CB 3.4Å; M238-Q241 PolarHBondContact O-N 3.43Å; M238-C257 HydrophobicContact CG-CB 4.33Å; M238-C257 HydrophobicContact SD-CB 3.76Å
239M97.6Very high94.9Very high0 Ų032.3 Ų32.30%020%0.196CC..Hα-helixtrans-59-30.7174.9-66174.916800112.7Y132 D135 F136 T139 R140 Q175 R235 R236 Q241Y132-M239 HydrophobicContact CD1-CE 4.47Å; Y132-M239 HydrophobicContact CE1-CE 3.64Å; Y132-M239 HydrophobicContact CE2-CE 3.98Å; Y132-M239 WeakPolarHBondContact OH-CE 3.4Å; D135-M239 HydrophobicContact CB-CE 4.3Å; F136-M239 HydrophobicContact CD2-CB 3.86Å; F136-M239 HydrophobicContact CD2-CG 3.94Å; F136-M239 HydrophobicContact CE2-CB 4.13Å; F136-M239 VanDerWaalsContact CE2-O 3.25Å; F136-M239 WeakPolarHBondContact CE2-O 3.46Å; T139-M239 HydrophobicContact CG2-SD 4.02Å; T139-M239 PolarHBondContact OG1-SD 3.1Å; T139-M239 VanDerWaalsContact OG1-SD 3.4Å; R140-M239 PolarHBondContact NH1-O 3.37Å; Q175-M239 WeakPolarHBondContact O-CG 3.25Å; R235-M239 HydrophobicContact CG-CE 4.06Å; R235-M239 WeakPolarHBondContact O-CG 3.09Å; R235-M239 PolarHBondContact O-N 2.91Å; R235-M239 VanDerWaalsContact O-N 3.1Å; R236-M239 WeakPolarHBondContact O-CB 3.33Å; R236-M239 PolarHBondContact O-N 3.21Å; M239-Q241 PolarHBondContact O-N 2.64Å
240M96.8Very high94.7Very high4 Ų434.9 Ų34.92%0.0221%0.209CC..THydrogen-bonded Turntrans-71.2-10.6177.2-62.6-50.9-65.200114V38 A41 A143 R236 R237 M238 R244V38-M240 HydrophobicContact CB-CG 3.92Å; V38-M240 HydrophobicContact CB-SD 4.38Å; V38-M240 HydrophobicContact CG1-CG 4.3Å; V38-M240 HydrophobicContact CG2-CE 4.47Å; V38-M240 HydrophobicContact CG2-CG 4.19Å; V38-M240 HydrophobicContact CG2-SD 4Å; A41-M240 HydrophobicContact CB-CB 4.28Å; A41-M240 HydrophobicContact CB-CG 4.47Å; A143-M240 HydrophobicContact CB-CE 3.6Å; A143-M240 HydrophobicContact CB-SD 3.78Å; R236-M240 WeakPolarHBondContact O-CG 3.26Å; R236-M240 PolarHBondContact O-N 3.49Å; R237-M240 PolarHBondContact O-N 3.45Å; M238-M240 PolarHBondContact O-N 3.21Å; M240-R244 PolarHBondContact O-NE 3.41Å
241Q95.9Very high94.6Very high8 Ų834.6 Ų34.64%0.03721%0.206CC..THydrogen-bonded Turntrans-83-24.3179.9-54.9-45-6500113.2R237 M238 M239 R244 M250 Y251R237-Q241 PolarHBondContact O-NE2 2.89Å; M238-Q241 WeakPolarHBondContact O-CB 3.4Å; M238-Q241 PolarHBondContact O-N 3.43Å; M239-Q241 PolarHBondContact O-N 2.64Å; Q241-R244 WeakPolarHBondContact O-CB 3.37Å; Q241-R244 VanDerWaalsContact O-CG 3.3Å; Q241-R244 WeakPolarHBondContact O-CG 3.49Å; Q241-R244 PolarHBondContact O-N 2.96Å; Q241-R244 VanDerWaalsContact O-N 3.11Å; Q241-M250 VanDerWaalsContact NE2-CE 3.31Å; Q241-Y251 HydrophobicContact CG-CD2 3.98Å; Q241-Y251 VanDerWaalsContact NE2-CD2 3.27Å
242S94.6Very high94.3Very high0 Ų037.4 Ų37.40%023%0.231CC..THydrogen-bonded Turntrans-65.4139-177.3-40.30000111.7F136 R140 D168 G172 Q175F136-S242 WeakPolarHBondContact CE2-OG 3.24Å; R140-S242 VanDerWaalsContact CZ-O 3.3Å; R140-S242 PolarHBondContact NH1-O 2.95Å; R140-S242 PolarHBondContact NH2-O 3.34Å; D168-S242 VanDerWaalsContact OD2-CA 3.23Å; D168-S242 WeakPolarHBondContact OD2-CA 3.4Å; G172-S242 WeakPolarHBondContact O-CB 2.95Å; G172-S242 PolarHBondContact O-OG 2.96Å; Q175-S242 VanDerWaalsContact CG-OG 3.29Å; Q175-S242 WeakPolarHBondContact CG-OG 3.4Å
243G91.9Very high94.2Very high32 Ų3237.1 Ų37.133%0.3323%0.234SC..THydrogen-bonded Turntrans80.60.2-173.500000113.8D168D168-G243 VanDerWaalsContact CG-N 3.3Å; D168-G243 WeakPolarHBondContact OD1-CA 3.35Å; D168-G243 PolarHBondContact OD1-N 2.96Å; D168-G243 PolarHBondContact OD2-N 3.2Å
244R93.2Very high94.2Very high23 Ų2338.8 Ų38.89%0.08725%0.245CC..  trans-92.5145.9171.2-54.7-170.7178.7-143.9-6110.3A41 M240 Q241 D248 I249A41-R244 PolarHBondContact O-NH2 3.32Å; M240-R244 PolarHBondContact O-NE 3.41Å; Q241-R244 WeakPolarHBondContact O-CB 3.37Å; Q241-R244 VanDerWaalsContact O-CG 3.3Å; Q241-R244 WeakPolarHBondContact O-CG 3.49Å; Q241-R244 PolarHBondContact O-N 2.96Å; Q241-R244 VanDerWaalsContact O-N 3.11Å; R244-D248 HydrophobicContact CB-CB 4.11Å; R244-D248 WeakPolarHBondContact CD-O 3.34Å; R244-D248 PolarHBondContact NH1-O 2.88Å; R244-D248 VanDerWaalsContact NH1-O 3.07Å; R244-I249 HydrophobicContact CB-CG1 4.02Å
245K89.8Confident94.1Very high147 Ų14744.2 Ų44.264%0.63927%0.272SS*.  trans-131.6149.1-179.1-63.4-172.4177-174.20110.6A247 D248K245-A247 PolarHBondContact O-N 3.31Å; K245-D248 PolarHBondContact O-N 2.92Å
246G88.6Confident94.1Very high62 Ų6244.7 Ų44.764%0.63928%0.277SS*.G310 helixtrans56-129.8174.500000113.1D248 I249G246-D248 PolarHBondContact O-N 3.29Å; G246-D248 VanDerWaalsContact O-N 3.14Å; G246-I249 PolarHBondContact O-N 3.12Å
247A85.6Confident94.1Very high109 Ų10944 Ų4490%0.90127%0.274SS*.G310 helixtrans-63-16.6-175.800000114.7K245 I249K245-A247 PolarHBondContact O-N 3.31Å; A247-I249 VanDerWaalsContact C-N 3.26Å; A247-I249 PolarHBondContact O-N 2.98Å
248D88.1Confident94.1Very high82 Ų8247.4 Ų47.444%0.43929%0.287SS..G310 helixtrans-75.3-15.2178.6-72-30.5000113.8K43 R244 K245 G246 M250K43-D248 WeakPolarHBondContact CE-OD2 3.45Å; K43-D248 VanDerWaalsContact NZ-CG 3.29Å; K43-D248 IonicContact NZ-OD2 3.9Å; K43-D248 PolarHBondContact NZ-OD2 3.29Å; R244-D248 HydrophobicContact CB-CB 4.11Å; R244-D248 WeakPolarHBondContact CD-O 3.34Å; R244-D248 PolarHBondContact NH1-O 2.88Å; R244-D248 VanDerWaalsContact NH1-O 3.07Å; K245-D248 PolarHBondContact O-N 2.92Å; G246-D248 PolarHBondContact O-N 3.29Å; G246-D248 VanDerWaalsContact O-N 3.14Å; D248-M250 PolarHBondContact O-N 2.95Å
249I92.4Very high94.1Very high78 Ų7855.7 Ų55.740%0.432%0.318SS..  trans-74.9111.7179.7-60.9173.6000108.5R244 G246 A247 Y251R244-I249 HydrophobicContact CB-CG1 4.02Å; G246-I249 PolarHBondContact O-N 3.12Å; A247-I249 VanDerWaalsContact C-N 3.26Å; A247-I249 PolarHBondContact O-N 2.98Å; I249-Y251 WeakPolarHBondContact CG2-O 3.44Å
250M93.7Very high94.1Very high56 Ų5658.1 Ų58.128%0.27633%0.329SS..SBendtrans-83.6-31.2179.5-63.6174-58.100112.1A41 Q241 D248 K260A41-M250 HydrophobicContact CB-CE 3.3Å; A41-M250 HydrophobicContact CB-SD 4.41Å; Q241-M250 VanDerWaalsContact NE2-CE 3.31Å; D248-M250 PolarHBondContact O-N 2.95Å; M250-K260 WeakPolarHBondContact O-CD 3.22Å; M250-K260 WeakPolarHBondContact O-CE 3.35Å; M250-K260 PolarHBondContact O-NZ 2.67Å
251Y95.5Very high94.1Very high12 Ų1258 Ų585%0.04733%0.328CS..  trans-128120.2-177.2-46.9-62.3000110.4A41 R237 Q241 I249 G253 D256 C257 K260 I261A41-Y251 HydrophobicContact CB-CE2 4.27Å; R237-Y251 HydrophobicContact CB-CD2 4.27Å; R237-Y251 HydrophobicContact CB-CE2 3.78Å; R237-Y251 HydrophobicContact CG-CE2 4.45Å; R237-Y251 PolarHBondContact NH1-OH 3.42Å; Q241-Y251 HydrophobicContact CG-CD2 3.98Å; Q241-Y251 VanDerWaalsContact NE2-CD2 3.27Å; I249-Y251 WeakPolarHBondContact CG2-O 3.44Å; Y251-G253 VanDerWaalsContact C-N 3.34Å; Y251-D256 WeakPolarHBondContact CA-OD2 3.12Å; Y251-C257 HydrophobicContact CD1-CB 3.94Å; Y251-C257 HydrophobicContact CD2-CB 4.39Å; Y251-C257 HydrophobicContact CG-CB 3.82Å; Y251-K260 HydrophobicContact CD1-CB 4.06Å; Y251-K260 HydrophobicContact CD1-CD 3.88Å; Y251-K260 HydrophobicContact CE1-CB 3.8Å; Y251-K260 HydrophobicContact CE1-CD 4.26Å; Y251-I261 HydrophobicContact CE1-CG1 4.47Å
252S93.1Very high94.2Very high103 Ų10359.9 Ų59.972%0.7235%0.345SS*.SBendtrans-78.4-21178.662.20000112.9D256S252-D256 PolarHBondContact N-OD2 2.97Å; S252-D256 WeakPolarHBondContact OG-CB 3.35Å; S252-D256 PolarHBondContact OG-OD2 2.57Å
253G95.1Very high94.3Very high21 Ų2168.5 Ų68.522%0.21638%0.378CS..SBendtrans-173.7176.7179.900000112.3Y251 I255 D256 C257Y251-G253 VanDerWaalsContact C-N 3.34Å; G253-I255 PolarHBondContact O-N 2.97Å; G253-D256 PolarHBondContact O-N 3.41Å; G253-C257 WeakPolarHBondContact O-CB 3.29Å; G253-C257 PolarHBondContact O-N 2.83Å
254T96.7Very high94.4Very high36 Ų3671.3 Ų71.322%0.22139%0.385CS..Hα-helixtrans-56.5-46-177.3-560000112.8V179 V234 C257 W258V179-T254 HydrophobicContact CB-CG2 3.73Å; V179-T254 HydrophobicContact CG1-CG2 4.28Å; V179-T254 HydrophobicContact CG2-CG2 4.1Å; V234-T254 HydrophobicContact CG1-CG2 3.96Å; T254-C257 WeakPolarHBondContact O-CB 3.46Å; T254-C257 PolarHBondContact O-N 2.87Å; T254-W258 PolarHBondContact O-N 3.41Å
255I97.2Very high94.4Very high113 Ų11372 Ų7258%0.57939%0.389SS*.Hα-helixtrans-66.7-41.5-178.8-61.5173.9000110.7G253 C257 W258 R259G253-I255 PolarHBondContact O-N 2.97Å; I255-C257 VanDerWaalsContact C-N 3.29Å; I255-C257 PolarHBondContact O-N 3.32Å; I255-W258 PolarHBondContact O-N 2.82Å; I255-R259 WeakPolarHBondContact O-CG 3.06Å; I255-R259 PolarHBondContact O-N 3.41Å
256D97.5Very high94.7Very high35 Ų3566.3 Ų66.319%0.18737%0.372CS..Hα-helixtrans-61.5-40.3174.2-176.550.9000111.1Y251 S252 G253 R259 K260Y251-D256 WeakPolarHBondContact CA-OD2 3.12Å; S252-D256 PolarHBondContact N-OD2 2.97Å; S252-D256 WeakPolarHBondContact OG-CB 3.35Å; S252-D256 PolarHBondContact OG-OD2 2.57Å; G253-D256 PolarHBondContact O-N 3.41Å; D256-R259 PolarHBondContact O-N 3.47Å; D256-K260 WeakPolarHBondContact O-CB 3.5Å; D256-K260 WeakPolarHBondContact O-CG 3.23Å; D256-K260 PolarHBondContact O-N 3.39Å; D256-K260 WeakPolarHBondContact OD1-CE 3.41Å; D256-K260 IonicContact OD1-NZ 3.99Å; D256-K260 PolarHBondContact OD1-NZ 3.01Å; D256-K260 WeakPolarHBondContact OD2-CE 3.18Å; D256-K260 IonicContact OD2-NZ 3.1Å; D256-K260 PolarHBondContact OD2-NZ 2.94Å
257C97.6Very high94.9Very high0 Ų065.8 Ų65.80%037%0.367CS..Hα-helixtrans-61.8-46.5175.2-166.70000112.5V234 M238 Y251 G253 T254 I255 R259 I261V234-C257 HydrophobicContact CG1-CB 3.95Å; M238-C257 HydrophobicContact CG-CB 4.33Å; M238-C257 HydrophobicContact SD-CB 3.76Å; Y251-C257 HydrophobicContact CD1-CB 3.94Å; Y251-C257 HydrophobicContact CD2-CB 4.39Å; Y251-C257 HydrophobicContact CG-CB 3.82Å; G253-C257 WeakPolarHBondContact O-CB 3.29Å; G253-C257 PolarHBondContact O-N 2.83Å; T254-C257 WeakPolarHBondContact O-CB 3.46Å; T254-C257 PolarHBondContact O-N 2.87Å; I255-C257 VanDerWaalsContact C-N 3.29Å; I255-C257 PolarHBondContact O-N 3.32Å; C257-R259 PolarHBondContact O-N 2.97Å; C257-I261 WeakPolarHBondContact O-CB 3.46Å; C257-I261 WeakPolarHBondContact O-CD1 3.44Å; C257-I261 WeakPolarHBondContact O-CG1 3.44Å; C257-I261 PolarHBondContact O-N 2.92Å
258W98Very high95.4Very high70 Ų7069.7 Ų69.727%0.26536%0.364SS..Hα-helixtrans-56-49.6172.8-79.1107.6000111.9V179 P230 F231 V234 T254 I255 A262 F270V179-W258 HydrophobicContact CG2-CZ2 4.31Å; P230-W258 HydrophobicContact CB-CH2 3.5Å; P230-W258 HydrophobicContact CB-CZ3 3.73Å; F231-W258 AromaticContact CD1-CZ2 3.99Å; F231-W258 HydrophobicContact CD1-CZ2 3.99Å; F231-W258 HydrophobicContact CD2-CH2 4.37Å; F231-W258 HydrophobicContact CD2-CZ2 4.48Å; F231-W258 HydrophobicContact CE1-CZ2 4.19Å; F231-W258 HydrophobicContact CG-CH2 4.42Å; F231-W258 HydrophobicContact CG-CZ2 4.13Å; V234-W258 HydrophobicContact CB-CZ2 4.33Å; V234-W258 HydrophobicContact CG2-CD2 3.6Å; V234-W258 HydrophobicContact CG2-CE3 3.91Å; V234-W258 HydrophobicContact CG2-CG 4.05Å; V234-W258 HydrophobicContact CG2-CH2 4.2Å; V234-W258 HydrophobicContact CG2-CZ2 3.91Å; V234-W258 HydrophobicContact CG2-CZ3 4.19Å; T254-W258 PolarHBondContact O-N 3.41Å; I255-W258 PolarHBondContact O-N 2.82Å; W258-A262 WeakPolarHBondContact O-CB 3.46Å; W258-A262 PolarHBondContact O-N 3.4Å; W258-A262 VanDerWaalsContact O-N 3.08Å; W258-F270 HydrophobicContact CD2-CE1 4.16Å; W258-F270 AromaticContact CE3-CD1 3.96Å; W258-F270 HydrophobicContact CE3-CD1 3.96Å; W258-F270 AromaticContact CE3-CE1 3.19Å; W258-F270 HydrophobicContact CE3-CE1 3.19Å; W258-F270 HydrophobicContact CE3-CE2 4.38Å; W258-F270 AromaticContact CE3-CZ 3.46Å; W258-F270 HydrophobicContact CE3-CZ 3.46Å; W258-F270 VanDerWaalsContact CE3-CZ 3.46Å; W258-F270 HydrophobicContact CH2-CE1 4.47Å; W258-F270 AromaticContact CZ3-CD1 3.64Å; W258-F270 HydrophobicContact CZ3-CD1 3.64Å; W258-F270 AromaticContact CZ3-CE1 3.39Å; W258-F270 HydrophobicContact CZ3-CE1 3.39Å; W258-F270 HydrophobicContact CZ3-CG 4.33Å; W258-F270 AromaticContact CZ3-CZ 3.88Å; W258-F270 HydrophobicContact CZ3-CZ 3.88Å
259R97.8Very high95.7Very high179 Ų17965.9 Ų65.968%0.67534%0.344SS*.Hα-helixtrans-62.8-48.9-177.7-72.6175.7-179.5171.7-0.2112I255 D256 C257 A262 R263I255-R259 WeakPolarHBondContact O-CG 3.06Å; I255-R259 PolarHBondContact O-N 3.41Å; D256-R259 PolarHBondContact O-N 3.47Å; C257-R259 PolarHBondContact O-N 2.97Å; R259-A262 PolarHBondContact O-N 3.34Å; R259-R263 VanDerWaalsContact O-CB 3.29Å; R259-R263 WeakPolarHBondContact O-CB 3.16Å; R259-R263 PolarHBondContact O-N 3.06Å
260K97.6Very high95.9Very high51 Ų5163.1 Ų63.122%0.22233%0.329CS..Hα-helixtrans-66.7-40.7-178.5-76.2174.6173.1164.30112.4M250 Y251 D256 A262 R263 D264M250-K260 WeakPolarHBondContact O-CD 3.22Å; M250-K260 WeakPolarHBondContact O-CE 3.35Å; M250-K260 PolarHBondContact O-NZ 2.67Å; Y251-K260 HydrophobicContact CD1-CB 4.06Å; Y251-K260 HydrophobicContact CD1-CD 3.88Å; Y251-K260 HydrophobicContact CE1-CB 3.8Å; Y251-K260 HydrophobicContact CE1-CD 4.26Å; D256-K260 WeakPolarHBondContact O-CB 3.5Å; D256-K260 WeakPolarHBondContact O-CG 3.23Å; D256-K260 PolarHBondContact O-N 3.39Å; D256-K260 WeakPolarHBondContact OD1-CE 3.41Å; D256-K260 IonicContact OD1-NZ 3.99Å; D256-K260 PolarHBondContact OD1-NZ 3.01Å; D256-K260 WeakPolarHBondContact OD2-CE 3.18Å; D256-K260 IonicContact OD2-NZ 3.1Å; D256-K260 PolarHBondContact OD2-NZ 2.94Å; K260-A262 VanDerWaalsContact C-N 3.34Å; K260-A262 PolarHBondContact O-N 2.96Å; K260-R263 PolarHBondContact O-N 3.16Å; K260-D264 WeakPolarHBondContact O-CA 3.04Å; K260-D264 WeakPolarHBondContact O-CB 3.45Å; K260-D264 VanDerWaalsContact O-CG 3.25Å; K260-D264 PolarHBondContact O-N 3.2Å
261I96.8Very high96.1Very high0 Ų065 Ų650%034%0.336CS..Iπ-helixtrans-61.1-46.7174.1-66.5168.1000110.3V234 R237 Y251 C257 R263 E265 G266 A269 F270V234-I261 HydrophobicContact CG2-CD1 3.95Å; R237-I261 HydrophobicContact CB-CD1 4.46Å; R237-I261 HydrophobicContact CG-CD1 4Å; Y251-I261 HydrophobicContact CE1-CG1 4.47Å; C257-I261 WeakPolarHBondContact O-CB 3.46Å; C257-I261 WeakPolarHBondContact O-CD1 3.44Å; C257-I261 WeakPolarHBondContact O-CG1 3.44Å; C257-I261 PolarHBondContact O-N 2.92Å; I261-R263 PolarHBondContact O-N 3.3Å; I261-E265 CarbonylContact O-C 3.59Å; I261-E265 WeakPolarHBondContact O-CB 3.28Å; I261-E265 PolarHBondContact O-N 3.5Å; I261-G266 PolarHBondContact O-N 3.39Å; I261-G266 VanDerWaalsContact O-N 3.11Å; I261-A269 HydrophobicContact CG2-CB 3.8Å; I261-F270 HydrophobicContact CB-CE1 3.82Å; I261-F270 HydrophobicContact CB-CZ 3.79Å; I261-F270 HydrophobicContact CD1-CE1 4.03Å; I261-F270 HydrophobicContact CG2-CD1 3.89Å; I261-F270 HydrophobicContact CG2-CD2 4.28Å; I261-F270 HydrophobicContact CG2-CE1 3.55Å; I261-F270 HydrophobicContact CG2-CE2 3.99Å; I261-F270 HydrophobicContact CG2-CG 4.22Å; I261-F270 HydrophobicContact CG2-CZ 3.6Å
262A97Very high96Very high49 Ų4967.5 Ų67.541%0.40535%0.347SS..Iπ-helixtrans-63.6-41.1-179.400000112.6W258 R259 K260 G266 F270W258-A262 WeakPolarHBondContact O-CB 3.46Å; W258-A262 PolarHBondContact O-N 3.4Å; W258-A262 VanDerWaalsContact O-N 3.08Å; R259-A262 PolarHBondContact O-N 3.34Å; K260-A262 VanDerWaalsContact C-N 3.34Å; K260-A262 PolarHBondContact O-N 2.96Å; A262-G266 VanDerWaalsContact O-CA 3.29Å; A262-G266 WeakPolarHBondContact O-CA 3.49Å; A262-G266 PolarHBondContact O-N 3.12Å; A262-F270 HydrophobicContact CB-CE2 4.06Å; A262-F270 HydrophobicContact CB-CZ 4.21Å
263R96.4Very high95.9Very high181 Ų18163 Ų6368%0.68332%0.317SS*.Iπ-helixtrans-78.2-45.7-177.9-172.9-172.765.4-170.8-2.3113R259 K260 I261R259-R263 VanDerWaalsContact O-CB 3.29Å; R259-R263 WeakPolarHBondContact O-CB 3.16Å; R259-R263 PolarHBondContact O-N 3.06Å; K260-R263 PolarHBondContact O-N 3.16Å; I261-R263 PolarHBondContact O-N 3.3Å
264D94.9Very high95.9Very high91 Ų9162.4 Ų62.449%0.48731%0.31SS..Iπ-helixtrans-93.5-26.7-167.4-51.3-24.3000112K260K260-D264 WeakPolarHBondContact O-CA 3.04Å; K260-D264 WeakPolarHBondContact O-CB 3.45Å; K260-D264 VanDerWaalsContact O-CG 3.25Å; K260-D264 PolarHBondContact O-N 3.2Å
265E93.8Very high95.8Very high37 Ų3768.6 Ų68.617%0.17333%0.329CS..Iπ-helixtrans-119.3-11.9-179.9-60173.6-105.500114.2H40 R237 I261 A269 K272H40-E265 IonicContact CD2-OE1 3.18Å; H40-E265 PolarHBondContact CD2-OE1 3.23Å; H40-E265 IonicContact CD2-OE2 2.64Å; H40-E265 IonicContact CG-OE1 3.06Å; H40-E265 IonicContact CG-OE2 3.48Å; H40-E265 IonicContact NE2-OE1 3.39Å; R237-E265 IonicContact CZ-OE1 3.9Å; R237-E265 IonicContact CZ-OE2 2.78Å; R237-E265 IonicContact NH1-OE1 3.74Å; R237-E265 PolarHBondContact NH1-OE1 3.32Å; R237-E265 IonicContact NH1-OE2 3.41Å; R237-E265 IonicContact NH2-OE1 2.74Å; R237-E265 PolarHBondContact NH2-OE1 3.1Å; R237-E265 IonicContact NH2-OE2 3.57Å; R237-E265 PolarHBondContact NH2-OE2 3.36Å; I261-E265 CarbonylContact O-C 3.59Å; I261-E265 WeakPolarHBondContact O-CB 3.28Å; I261-E265 PolarHBondContact O-N 3.5Å; E265-A269 HydrophobicContact CB-CB 3.32Å; E265-A269 HydrophobicContact CG-CB 4.35Å; E265-K272 IonicContact OE2-NZ 2.76Å; E265-K272 PolarHBondContact OE2-NZ 2.93Å
266G95.2Very high95.5Very high27 Ų2763.2 Ų63.228%0.27830%0.302SS..  trans81.1165.6-178.100000114.9I261 A262 K268 A269I261-G266 PolarHBondContact O-N 3.39Å; I261-G266 VanDerWaalsContact O-N 3.11Å; A262-G266 VanDerWaalsContact O-CA 3.29Å; A262-G266 WeakPolarHBondContact O-CA 3.49Å; A262-G266 PolarHBondContact O-N 3.12Å; G266-K268 VanDerWaalsContact C-N 3.25Å; G266-K268 PolarHBondContact O-N 2.98Å; G266-K268 VanDerWaalsContact O-N 3.14Å; G266-A269 WeakPolarHBondContact O-CB 3.44Å; G266-A269 PolarHBondContact O-N 2.83Å
267G93.5Very high95.3Very high52 Ų5262.6 Ų62.654%0.53630%0.298SS..G310 helixtrans-60.5-26.9-174.700000115.3A269 F270G267-A269 PolarHBondContact O-N 3.14Å; G267-F270 WeakPolarHBondContact O-CD2 3.22Å
268K94.8Very high95Very high190 Ų19063.3 Ų63.383%0.82630%0.303SS*.G310 helixtrans-68.6-21.9175.9-66.2-178.7-179.11770112.6G266 F270 F271G266-K268 VanDerWaalsContact C-N 3.25Å; G266-K268 PolarHBondContact O-N 2.98Å; G266-K268 VanDerWaalsContact O-N 3.14Å; K268-F270 PolarHBondContact O-N 3.32Å; K268-F271 PolarHBondContact O-N 2.87Å
269A95.1Very high94.8Very high2 Ų263.1 Ų63.12%0.01731%0.307CS..G310 helixtrans-64.4-28.2-177.700000113.3I261 E265 G266 G267 F271 K272I261-A269 HydrophobicContact CG2-CB 3.8Å; E265-A269 HydrophobicContact CB-CB 3.32Å; E265-A269 HydrophobicContact CG-CB 4.35Å; G266-A269 WeakPolarHBondContact O-CB 3.44Å; G266-A269 PolarHBondContact O-N 2.83Å; G267-A269 PolarHBondContact O-N 3.14Å; A269-F271 PolarHBondContact O-N 3.3Å; A269-F271 VanDerWaalsContact O-N 3.12Å; A269-K272 HydrophobicContact CB-CD 4.37Å; A269-K272 WeakPolarHBondContact O-CB 3.32Å; A269-K272 WeakPolarHBondContact O-CG 3.36Å; A269-K272 PolarHBondContact O-N 2.96Å; A269-K272 VanDerWaalsContact O-N 3.16Å
270F96.9Very high94.5Very high20 Ų2056.8 Ų56.89%0.08828%0.283CS..G310 helixtrans-59.3-22.7173.4-69.2-67.6000113.1Y229 P230 T233 V234 W258 I261 A262 G267 K268Y229-F270 WeakPolarHBondContact CD1-O 3.48Å; P230-F270 HydrophobicContact CB-CB 3.87Å; P230-F270 HydrophobicContact CB-CD1 4.14Å; P230-F270 HydrophobicContact CB-CG 4.15Å; P230-F270 HydrophobicContact CG-CB 4.01Å; T233-F270 WeakPolarHBondContact CB-O 3.45Å; T233-F270 PolarHBondContact OG1-O 3Å; V234-F270 HydrophobicContact CG2-CD1 4.25Å; V234-F270 HydrophobicContact CG2-CE1 3.83Å; W258-F270 HydrophobicContact CD2-CE1 4.16Å; W258-F270 AromaticContact CE3-CD1 3.96Å; W258-F270 HydrophobicContact CE3-CD1 3.96Å; W258-F270 AromaticContact CE3-CE1 3.19Å; W258-F270 HydrophobicContact CE3-CE1 3.19Å; W258-F270 HydrophobicContact CE3-CE2 4.38Å; W258-F270 AromaticContact CE3-CZ 3.46Å; W258-F270 HydrophobicContact CE3-CZ 3.46Å; W258-F270 VanDerWaalsContact CE3-CZ 3.46Å; W258-F270 HydrophobicContact CH2-CE1 4.47Å; W258-F270 AromaticContact CZ3-CD1 3.64Å; W258-F270 HydrophobicContact CZ3-CD1 3.64Å; W258-F270 AromaticContact CZ3-CE1 3.39Å; W258-F270 HydrophobicContact CZ3-CE1 3.39Å; W258-F270 HydrophobicContact CZ3-CG 4.33Å; W258-F270 AromaticContact CZ3-CZ 3.88Å; W258-F270 HydrophobicContact CZ3-CZ 3.88Å; I261-F270 HydrophobicContact CB-CE1 3.82Å; I261-F270 HydrophobicContact CB-CZ 3.79Å; I261-F270 HydrophobicContact CD1-CE1 4.03Å; I261-F270 HydrophobicContact CG2-CD1 3.89Å; I261-F270 HydrophobicContact CG2-CD2 4.28Å; I261-F270 HydrophobicContact CG2-CE1 3.55Å; I261-F270 HydrophobicContact CG2-CE2 3.99Å; I261-F270 HydrophobicContact CG2-CG 4.22Å; I261-F270 HydrophobicContact CG2-CZ 3.6Å; A262-F270 HydrophobicContact CB-CE2 4.06Å; A262-F270 HydrophobicContact CB-CZ 4.21Å; G267-F270 WeakPolarHBondContact O-CD2 3.22Å; K268-F270 PolarHBondContact O-N 3.32Å
271F97.1Very high94Very high96 Ų9655.3 Ų55.342%0.42128%0.281SS..G310 helixtrans-105.512.7-177.7-60.7-87.3000113.4L226 Y229 P230 K268 A269 G273 A274L226-F271 WeakPolarHBondContact O-CE1 3.12Å; Y229-F271 HydrophobicContact CD1-CD1 4.39Å; P230-F271 HydrophobicContact CG-CE1 3.96Å; P230-F271 HydrophobicContact CG-CE2 4.06Å; P230-F271 HydrophobicContact CG-CZ 3.59Å; K268-F271 PolarHBondContact O-N 2.87Å; A269-F271 PolarHBondContact O-N 3.3Å; A269-F271 VanDerWaalsContact O-N 3.12Å; F271-G273 PolarHBondContact O-N 3.32Å; F271-G273 VanDerWaalsContact O-N 3.09Å; F271-A274 HydrophobicContact CB-CB 3.97Å; F271-A274 HydrophobicContact CD1-CB 4.26Å; F271-A274 WeakPolarHBondContact O-CB 3.22Å; F271-A274 PolarHBondContact O-N 3.28Å
272K93.8Very high93.7Very high64 Ų6458.9 Ų58.928%0.27830%0.299SS..THydrogen-bonded Turntrans-59.4115.9173.3-78176.6179178.90110.2Q37 Y229 E265 A269Q37-K272 WeakPolarHBondContact CA-O 3.16Å; Q37-K272 WeakPolarHBondContact CB-O 3.34Å; Y229-K272 WeakPolarHBondContact CE1-O 3.43Å; Y229-K272 PolarHBondContact OH-O 2.96Å; Y229-K272 VanDerWaalsContact OH-O 3.09Å; E265-K272 IonicContact OE2-NZ 2.76Å; E265-K272 PolarHBondContact OE2-NZ 2.93Å; A269-K272 HydrophobicContact CB-CD 4.37Å; A269-K272 WeakPolarHBondContact O-CB 3.32Å; A269-K272 WeakPolarHBondContact O-CG 3.36Å; A269-K272 PolarHBondContact O-N 2.96Å; A269-K272 VanDerWaalsContact O-N 3.16Å
273G92.1Very high93.2Very high10 Ų1057.8 Ų57.810%0.10329%0.292CS..THydrogen-bonded Turntrans864.4-175.800000114.9K33 Y229 F271 W275 S276 N277K33-G273 WeakPolarHBondContact CG-O 3.38Å; Y229-G273 WeakPolarHBondContact OH-CA 3.5Å; Y229-G273 PolarHBondContact OH-O 3.42Å; F271-G273 PolarHBondContact O-N 3.32Å; F271-G273 VanDerWaalsContact O-N 3.09Å; G273-W275 VanDerWaalsContact C-N 3.34Å; G273-W275 PolarHBondContact O-N 3.28Å; G273-S276 WeakPolarHBondContact O-CB 3.39Å; G273-S276 PolarHBondContact O-N 3.14Å; G273-N277 PolarHBondContact O-N 2.96Å
274A94.1Very high92.5Very high7 Ų749.5 Ų49.56%0.05826%0.264CS..Hα-helixtrans-59.6-44.2-179.200000112L226 Y229 F271 N277 V278L226-A274 HydrophobicContact CD2-CB 3.82Å; Y229-A274 HydrophobicContact CD1-CB 3.86Å; Y229-A274 HydrophobicContact CD2-CB 4.33Å; Y229-A274 HydrophobicContact CE1-CB 3.85Å; Y229-A274 HydrophobicContact CE2-CB 4.31Å; Y229-A274 HydrophobicContact CG-CB 4.11Å; Y229-A274 VanDerWaalsContact CZ-CA 3.47Å; Y229-A274 PolarHBondContact OH-N 2.66Å; F271-A274 HydrophobicContact CB-CB 3.97Å; F271-A274 HydrophobicContact CD1-CB 4.26Å; F271-A274 WeakPolarHBondContact O-CB 3.22Å; F271-A274 PolarHBondContact O-N 3.28Å; A274-N277 VanDerWaalsContact O-CB 3.31Å; A274-N277 WeakPolarHBondContact O-CB 3.34Å; A274-N277 PolarHBondContact O-N 2.92Å; A274-N277 VanDerWaalsContact O-N 3.1Å; A274-V278 PolarHBondContact O-N 3.35Å
275W93.9Very high92.1Very high166 Ų16646.2 Ų46.263%0.62925%0.249SC*.Hα-helixtrans-62.3-44.8175.8-175.3-122.1000112.6G273 N277 V278 L279G273-W275 VanDerWaalsContact C-N 3.34Å; G273-W275 PolarHBondContact O-N 3.28Å; W275-N277 PolarHBondContact O-N 2.87Å; W275-V278 HydrophobicContact CE3-CB 4.23Å; W275-V278 HydrophobicContact CE3-CG1 4.44Å; W275-V278 HydrophobicContact CZ3-CB 4.44Å; W275-V278 HydrophobicContact CZ3-CG1 4.15Å; W275-V278 WeakPolarHBondContact O-CB 3.47Å; W275-V278 PolarHBondContact O-N 3.36Å; W275-L279 HydrophobicContact CZ2-CD2 4.12Å; W275-L279 PolarHBondContact O-N 3.34Å
276S91.8Very high91.7Very high1 Ų149.6 Ų49.61%0.00726%0.263CS..Hα-helixtrans-58-34.3173.7-46.50000112I54 G273 R280I54-S276 WeakPolarHBondContact CD1-OG 3.33Å; I54-S276 VanDerWaalsContact CG1-OG 3.26Å; I54-S276 WeakPolarHBondContact CG1-OG 3.1Å; G273-S276 WeakPolarHBondContact O-CB 3.39Å; G273-S276 PolarHBondContact O-N 3.14Å; S276-R280 VanDerWaalsContact O-CB 3.29Å; S276-R280 WeakPolarHBondContact O-CB 3.47Å; S276-R280 PolarHBondContact O-N 2.91Å
277N92.4Very high91Very high22 Ų2249.8 Ų49.812%0.11826%0.259CS..Hα-helixtrans-70.3-34.8176.2-174.767.1000113.1K33 Y229 G273 A274 W275 R280 G281K33-N277 HydrophobicContact CD-CB 3.84Å; K33-N277 HydrophobicContact CG-CB 4Å; K33-N277 PolarHBondContact NZ-OD1 3.33Å; Y229-N277 HydrophobicContact CD2-CB 4.33Å; Y229-N277 HydrophobicContact CE2-CB 3.56Å; G273-N277 PolarHBondContact O-N 2.96Å; A274-N277 VanDerWaalsContact O-CB 3.31Å; A274-N277 WeakPolarHBondContact O-CB 3.34Å; A274-N277 PolarHBondContact O-N 2.92Å; A274-N277 VanDerWaalsContact O-N 3.1Å; W275-N277 PolarHBondContact O-N 2.87Å; N277-R280 PolarHBondContact OD1-NE 2.86Å; N277-R280 VanDerWaalsContact OD1-NE 3.16Å; N277-R280 PolarHBondContact OD1-NH2 3.2Å; N277-G281 PolarHBondContact O-N 3.47Å
278V93.1Very high90.3Very high14 Ų1450.4 Ų50.49%0.08525%0.249CC..Hα-helixtrans-64.3-50.5172.9174.70000109.7A222 L226 A274 W275 R280 G281 M282A222-V278 HydrophobicContact CB-CG1 4.12Å; A222-V278 HydrophobicContact CB-CG2 4.34Å; L226-V278 HydrophobicContact CD2-CG2 4.26Å; L226-V278 HydrophobicContact CG-CG2 4.34Å; A274-V278 PolarHBondContact O-N 3.35Å; W275-V278 HydrophobicContact CE3-CB 4.23Å; W275-V278 HydrophobicContact CE3-CG1 4.44Å; W275-V278 HydrophobicContact CZ3-CB 4.44Å; W275-V278 HydrophobicContact CZ3-CG1 4.15Å; W275-V278 WeakPolarHBondContact O-CB 3.47Å; W275-V278 PolarHBondContact O-N 3.36Å; V278-R280 VanDerWaalsContact C-N 3.32Å; V278-R280 PolarHBondContact O-N 2.69Å; V278-G281 WeakPolarHBondContact O-CA 3.38Å; V278-G281 PolarHBondContact O-N 2.92Å; V278-M282 HydrophobicContact CG1-CG 4.42Å; V278-M282 HydrophobicContact CG1-SD 3.85Å; V278-M282 WeakPolarHBondContact O-CG 3.07Å; V278-M282 PolarHBondContact O-N 2.79Å
279L92.2Very high89.7Confident67 Ų6744.3 Ų44.335%0.35123%0.228SC..Hα-helixtrans-56.9-44.5176.6-65.1178.1000112.1I29 I54 W275 G281 M282 G283I29-L279 HydrophobicContact CD1-CD1 4.49Å; I29-L279 HydrophobicContact CG1-CB 4.25Å; I54-L279 HydrophobicContact CD1-CD1 4.23Å; W275-L279 HydrophobicContact CZ2-CD2 4.12Å; W275-L279 PolarHBondContact O-N 3.34Å; L279-G281 VanDerWaalsContact C-N 3.32Å; L279-G281 PolarHBondContact O-N 2.93Å; L279-M282 PolarHBondContact O-N 2.85Å; L279-G283 PolarHBondContact O-N 3.48Å
280R92.2Very high88.8Confident46 Ų4648 Ų4817%0.17425%0.247CC..Hα-helixtrans-59.1-42.5174-178.5-149.560.877.43.5112V26 I29 E30 S276 N277 V278 G284V26-R280 HydrophobicContact CB-CG 4.15Å; V26-R280 HydrophobicContact CG2-CG 3.9Å; I29-R280 HydrophobicContact CG2-CB 3.97Å; I29-R280 HydrophobicContact CG2-CG 4.32Å; E30-R280 HydrophobicContact CB-CG 4Å; E30-R280 HydrophobicContact CG-CG 4.43Å; E30-R280 WeakPolarHBondContact OE1-CD 3.37Å; E30-R280 WeakPolarHBondContact OE2-CD 3.41Å; S276-R280 VanDerWaalsContact O-CB 3.29Å; S276-R280 WeakPolarHBondContact O-CB 3.47Å; S276-R280 PolarHBondContact O-N 2.91Å; N277-R280 PolarHBondContact OD1-NE 2.86Å; N277-R280 VanDerWaalsContact OD1-NE 3.16Å; N277-R280 PolarHBondContact OD1-NH2 3.2Å; V278-R280 VanDerWaalsContact C-N 3.32Å; V278-R280 PolarHBondContact O-N 2.69Å; R280-G284 PolarHBondContact O-N 3.48Å
281G87.9Confident87.8Confident19 Ų1950 Ų5020%0.19626%0.255CS..Hα-helixtrans-62.6-52.7178.800000111.9N277 V278 L279 G284 A285N277-G281 PolarHBondContact O-N 3.47Å; V278-G281 WeakPolarHBondContact O-CA 3.38Å; V278-G281 PolarHBondContact O-N 2.92Å; L279-G281 VanDerWaalsContact C-N 3.32Å; L279-G281 PolarHBondContact O-N 2.93Å; G281-G284 PolarHBondContact O-N 2.82Å; G281-A285 PolarHBondContact O-N 3.25Å; G281-A285 VanDerWaalsContact O-N 3.1Å
282M89.9Confident86.8Confident76 Ų7649.5 Ų49.537%0.37426%0.256SS..Hα-helixtrans-63.7-46.2-180-65.4175.770.700111.9V278 L279 G284 A285 F286V278-M282 HydrophobicContact CG1-CG 4.42Å; V278-M282 HydrophobicContact CG1-SD 3.85Å; V278-M282 WeakPolarHBondContact O-CG 3.07Å; V278-M282 PolarHBondContact O-N 2.79Å; L279-M282 PolarHBondContact O-N 2.85Å; M282-G284 VanDerWaalsContact C-N 3.31Å; M282-G284 PolarHBondContact O-N 3.36Å; M282-A285 PolarHBondContact O-N 3.07Å; M282-F286 WeakPolarHBondContact O-CB 3.29Å; M282-F286 PolarHBondContact O-N 3.45Å
283G86.4Confident85.8Confident25 Ų2550.9 Ų50.926%0.25826%0.264SS..Hα-helixtrans-61.6-39.2176.800000112.3L279 A285 F286 V287L279-G283 PolarHBondContact O-N 3.48Å; G283-A285 PolarHBondContact O-N 2.62Å; G283-F286 PolarHBondContact O-N 3.24Å; G283-V287 VanDerWaalsContact O-CG2 3.28Å; G283-V287 WeakPolarHBondContact O-CG2 3.49Å; G283-V287 PolarHBondContact O-N 3.3Å
284G81.7Confident84.8Confident8 Ų855.7 Ų55.78%0.08229%0.286CS..Hα-helixtrans-65.1-4117800000112.2S22 R280 G281 M282 L288S22-G284 PolarHBondContact OG-O 3.06Å; R280-G284 PolarHBondContact O-N 3.48Å; G281-G284 PolarHBondContact O-N 2.82Å; M282-G284 VanDerWaalsContact C-N 3.31Å; M282-G284 PolarHBondContact O-N 3.36Å; G284-L288 WeakPolarHBondContact O-CG 3.16Å; G284-L288 PolarHBondContact O-N 2.89Å
285A85.6Confident83.5Confident21 Ų2161.3 Ų61.317%0.17431%0.31CS..Hα-helixtrans-66.8-40.8174.700000112Q218 G281 M282 G283 L288 V289Q218-A285 VanDerWaalsContact NE2-CB 3.28Å; G281-A285 PolarHBondContact O-N 3.25Å; G281-A285 VanDerWaalsContact O-N 3.1Å; M282-A285 PolarHBondContact O-N 3.07Å; G283-A285 PolarHBondContact O-N 2.62Å; A285-L288 PolarHBondContact O-N 3.36Å; A285-V289 WeakPolarHBondContact O-CG2 3.21Å; A285-V289 PolarHBondContact O-N 3.11Å; A285-V289 VanDerWaalsContact O-N 3.12Å
286F85.5Confident82.5Confident109 Ų10960.3 Ų60.348%0.47831%0.31SS..Hα-helixtrans-62.4-43.2177.2-178-112.9000112.3M282 G283 L288 V289 L290M282-F286 WeakPolarHBondContact O-CB 3.29Å; M282-F286 PolarHBondContact O-N 3.45Å; G283-F286 PolarHBondContact O-N 3.24Å; F286-L288 VanDerWaalsContact C-N 3.29Å; F286-L288 PolarHBondContact O-N 3.01Å; F286-V289 PolarHBondContact O-N 3.04Å; F286-L290 HydrophobicContact CD1-CD1 3.81Å; F286-L290 HydrophobicContact CD1-CG 4.39Å; F286-L290 HydrophobicContact CE1-CD1 3.32Å; F286-L290 HydrophobicContact CE1-CG 4.04Å; F286-L290 HydrophobicContact CE2-CD1 4.41Å; F286-L290 HydrophobicContact CE2-CD2 4.44Å; F286-L290 HydrophobicContact CE2-CG 4.26Å; F286-L290 HydrophobicContact CZ-CD1 3.66Å; F286-L290 HydrophobicContact CZ-CD2 4.12Å; F286-L290 HydrophobicContact CZ-CG 3.95Å; F286-L290 PolarHBondContact O-N 2.75Å
287V80.8Confident81.3Confident31 Ų3166.3 Ų66.319%0.18835%0.346CS..Hα-helixtrans-62.5-36.3176.6173.50000111.9I21 A25 G283 Y291I21-V287 HydrophobicContact CG2-CG1 4.22Å; A25-V287 HydrophobicContact CB-CG1 4.14Å; A25-V287 HydrophobicContact CB-CG2 3.85Å; G283-V287 VanDerWaalsContact O-CG2 3.28Å; G283-V287 WeakPolarHBondContact O-CG2 3.49Å; G283-V287 PolarHBondContact O-N 3.3Å; V287-Y291 WeakPolarHBondContact O-CB 3.48Å; V287-Y291 PolarHBondContact O-N 3Å
288L78.9Confident79.5Confident64 Ų6474.5 Ų74.534%0.33539%0.388SS..Hα-helixtrans-65.4-44.7175.5-69.5171.9000111.5S18 G284 A285 F286 L290 Y291 D292S18-L288 WeakPolarHBondContact OG-CD2 3.31Å; G284-L288 WeakPolarHBondContact O-CG 3.16Å; G284-L288 PolarHBondContact O-N 2.89Å; A285-L288 PolarHBondContact O-N 3.36Å; F286-L288 VanDerWaalsContact C-N 3.29Å; F286-L288 PolarHBondContact O-N 3.01Å; L288-L290 PolarHBondContact O-N 3.03Å; L288-Y291 PolarHBondContact O-N 2.89Å; L288-D292 PolarHBondContact O-N 3.14Å
289V81.4Confident78.8Confident62 Ų6277.6 Ų77.638%0.37640%0.403SS..Hα-helixtrans-60.4-47.2176.3174.20000110.7A285 F286 Y291 D292 E293A285-V289 WeakPolarHBondContact O-CG2 3.21Å; A285-V289 PolarHBondContact O-N 3.11Å; A285-V289 VanDerWaalsContact O-N 3.12Å; F286-V289 PolarHBondContact O-N 3.04Å; V289-Y291 VanDerWaalsContact C-N 3.32Å; V289-Y291 PolarHBondContact O-N 3.15Å; V289-D292 PolarHBondContact O-N 3.06Å; V289-E293 WeakPolarHBondContact O-CG 3.38Å; V289-E293 PolarHBondContact O-N 3.28Å
290L77.5Confident78.1Confident80 Ų8078.1 Ų78.142%0.41941%0.406SS..Hα-helixtrans-60.5-41.2177.2-74.3179000112.5F286 L288 E293 L294F286-L290 HydrophobicContact CD1-CD1 3.81Å; F286-L290 HydrophobicContact CD1-CG 4.39Å; F286-L290 HydrophobicContact CE1-CD1 3.32Å; F286-L290 HydrophobicContact CE1-CG 4.04Å; F286-L290 HydrophobicContact CE2-CD1 4.41Å; F286-L290 HydrophobicContact CE2-CD2 4.44Å; F286-L290 HydrophobicContact CE2-CG 4.26Å; F286-L290 HydrophobicContact CZ-CD1 3.66Å; F286-L290 HydrophobicContact CZ-CD2 4.12Å; F286-L290 HydrophobicContact CZ-CG 3.95Å; F286-L290 PolarHBondContact O-N 2.75Å; L288-L290 PolarHBondContact O-N 3.03Å; L290-E293 PolarHBondContact O-N 3.49Å; L290-L294 WeakPolarHBondContact O-CB 3.41Å; L290-L294 VanDerWaalsContact O-CG 3.28Å; L290-L294 WeakPolarHBondContact O-CG 3.2Å; L290-L294 PolarHBondContact O-N 3.02Å
291Y75.3Confident77.3Confident63 Ų6379.9 Ų79.925%0.24742%0.419CS..Hα-helixtrans-62.6-43177.4178.4-96.1000111.8I21 V287 L288 V289 L294 K295I21-Y291 HydrophobicContact CD1-CD2 3.92Å; I21-Y291 HydrophobicContact CD1-CE2 3.56Å; V287-Y291 WeakPolarHBondContact O-CB 3.48Å; V287-Y291 PolarHBondContact O-N 3Å; L288-Y291 PolarHBondContact O-N 2.89Å; V289-Y291 VanDerWaalsContact C-N 3.32Å; V289-Y291 PolarHBondContact O-N 3.15Å; Y291-L294 PolarHBondContact O-N 3.39Å; Y291-K295 WeakPolarHBondContact O-CB 3.2Å; Y291-K295 PolarHBondContact O-N 3.42Å
292D75.4Confident76.7Confident85 Ų8583.5 Ų83.546%0.45543%0.432SS..Hα-helixtrans-66.5-38.7178.4-70.6-18.5000111.8L288 V289 K295 K296L288-D292 PolarHBondContact O-N 3.14Å; V289-D292 PolarHBondContact O-N 3.06Å; D292-K295 PolarHBondContact O-N 3.17Å; D292-K296 WeakPolarHBondContact O-CG 3.26Å; D292-K296 PolarHBondContact O-N 3.47Å
293E74.7Confident75.8Confident92 Ų9283.9 Ų83.943%0.4344%0.435SS..Hα-helixtrans-67.1-42.9174.2-67.4-52.7139.700112.1V289 L290 K295 K296V289-E293 WeakPolarHBondContact O-CG 3.38Å; V289-E293 PolarHBondContact O-N 3.28Å; L290-E293 PolarHBondContact O-N 3.49Å; E293-K295 VanDerWaalsContact C-N 3.27Å; E293-K295 PolarHBondContact O-N 3.39Å; E293-K296 VanDerWaalsContact CD-NZ 3.3Å; E293-K296 WeakPolarHBondContact O-CB 3.13Å; E293-K296 PolarHBondContact O-N 2.73Å; E293-K296 IonicContact OE1-NZ 3.96Å; E293-K296 PolarHBondContact OE1-NZ 2.79Å; E293-K296 IonicContact OE2-NZ 3.47Å; E293-K296 PolarHBondContact OE2-NZ 3.12Å
294L69.2Low75.1Confident111 Ų11187.9 Ų87.958%0.58145%0.447SS*.Hα-helixtrans-60.3-38175.6-74.8170.8000112L290 Y291 K296 V297 I298L290-L294 WeakPolarHBondContact O-CB 3.41Å; L290-L294 VanDerWaalsContact O-CG 3.28Å; L290-L294 WeakPolarHBondContact O-CG 3.2Å; L290-L294 PolarHBondContact O-N 3.02Å; Y291-L294 PolarHBondContact O-N 3.39Å; L294-K296 PolarHBondContact O-N 2.97Å; L294-V297 PolarHBondContact O-N 3.24Å; L294-V297 VanDerWaalsContact O-N 3.16Å; L294-I298 WeakPolarHBondContact O-CG1 3.18Å; L294-I298 PolarHBondContact O-N 3.14Å
295K68.5Low74.7Confident126 Ų12693.6 Ų93.655%0.54847%0.473SS..Hα-helixtrans-66-22.6176.6-166.7-174.9175.2-168.80113.3Y291 D292 E293 V297Y291-K295 WeakPolarHBondContact O-CB 3.2Å; Y291-K295 PolarHBondContact O-N 3.42Å; D292-K295 PolarHBondContact O-N 3.17Å; E293-K295 VanDerWaalsContact C-N 3.27Å; E293-K295 PolarHBondContact O-N 3.39Å; K295-V297 VanDerWaalsContact C-N 3.35Å
296K72.6Confident73.8Confident144 Ų14499.2 Ų99.263%0.62650%0.496SS*.Hα-helixtrans-78.7-21.4175.1-66.1171-170.4169.10112.8D292 E293 L294D292-K296 WeakPolarHBondContact O-CG 3.26Å; D292-K296 PolarHBondContact O-N 3.47Å; E293-K296 VanDerWaalsContact CD-NZ 3.3Å; E293-K296 WeakPolarHBondContact O-CB 3.13Å; E293-K296 PolarHBondContact O-N 2.73Å; E293-K296 IonicContact OE1-NZ 3.96Å; E293-K296 PolarHBondContact OE1-NZ 2.79Å; E293-K296 IonicContact OE2-NZ 3.47Å; E293-K296 PolarHBondContact OE2-NZ 3.12Å; L294-K296 PolarHBondContact O-N 2.97Å
297V66.6Low72.8Confident128 Ų12898.3 Ų98.378%0.77650%0.498SS*.Hα-helixtrans-93-20.3-176.4-179.40000112L294 K295L294-V297 PolarHBondContact O-N 3.24Å; L294-V297 VanDerWaalsContact O-N 3.16Å; K295-V297 VanDerWaalsContact C-N 3.35Å
298I53.2Low72.1Confident194 Ų194104.5 Ų104.5100%0.99553%0.526SS*.  trans-96.50175.5-57.2167.7000109.3L294L294-I298 WeakPolarHBondContact O-CG1 3.18Å; L294-I298 PolarHBondContact O-N 3.14Å

Retrieved 298 of 298 residues in 121 ms (Link to these results)

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