A0A087WZI7_HUMAN Loading...

Anion exchange transporter

AlphaFold DB , UniProt , Accession A0A087WZI7, Species HUMAN (Homo sapiens, Human), Gene SLC26A7, Length 355 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
1M52Low82.9Confident235 Ų235112.5 Ų112.5100%1.15864%0.637SS**  052.60-74167.767.400111.5
2N76.6Confident83.4Confident130 Ų130114.9 Ų114.970%0.69564%0.636SS**  trans-117.910.7-179.8-67.8-1.9000113.4L4 S5 A6N2-L4 VanDerWaalsContact C-N 3.27Å; N2-L4 PolarHBondContact O-N 3.23Å; N2-S5 PolarHBondContact O-N 2.96Å; N2-A6 PolarHBondContact O-N 3.43Å
3I85.4Confident83.8Confident135 Ų135106.7 Ų106.769%0.69259%0.593SS**Hα-helixtrans-59.8-40.5-176.7-63.6164.8000110.6S5 A6 V7I3-S5 PolarHBondContact O-N 3.44Å; I3-A6 PolarHBondContact O-N 3.27Å; I3-V7 HydrophobicContact CG2-CG2 4.26Å; I3-V7 WeakPolarHBondContact O-CG2 3.3Å; I3-V7 PolarHBondContact O-N 3.28Å
4L86.2Confident84.3Confident138 Ų138104.1 Ų104.172%0.72358%0.581SS**Hα-helixtrans-60-47.4177.6-174.964.8000111.7N2 A6 V7 I8N2-L4 VanDerWaalsContact C-N 3.27Å; N2-L4 PolarHBondContact O-N 3.23Å; L4-A6 VanDerWaalsContact C-N 3.25Å; L4-A6 PolarHBondContact O-N 2.86Å; L4-V7 PolarHBondContact O-N 3.48Å; L4-I8 VanDerWaalsContact O-CB 3.26Å; L4-I8 WeakPolarHBondContact O-CB 3.39Å; L4-I8 PolarHBondContact O-N 3.4Å
5S86.5Confident84.8Confident89 Ų89101.2 Ų101.262%0.62258%0.576SS**Hα-helixtrans-65.3-29.1178.4-174.30000112.9N2 I3N2-S5 PolarHBondContact O-N 2.96Å; I3-S5 PolarHBondContact O-N 3.44Å
6A85.6Confident85.1Confident70 Ų7099 Ų9958%0.57956%0.562SS**Hα-helixtrans-75.2-34.8177.800000112.2N2 I3 L4N2-A6 PolarHBondContact O-N 3.43Å; I3-A6 PolarHBondContact O-N 3.27Å; L4-A6 VanDerWaalsContact C-N 3.25Å; L4-A6 PolarHBondContact O-N 2.86Å
7V88.7Confident85.4Confident73 Ų7397.5 Ų97.544%0.44256%0.555SS.*Hα-helixtrans-98.2-22.6-172.3-178.60000112.8I3 L4 T9 E10 A11I3-V7 HydrophobicContact CG2-CG2 4.26Å; I3-V7 WeakPolarHBondContact O-CG2 3.3Å; I3-V7 PolarHBondContact O-N 3.28Å; L4-V7 PolarHBondContact O-N 3.48Å; V7-T9 VanDerWaalsContact C-N 3.3Å; V7-T9 PolarHBondContact O-N 3.21Å; V7-E10 PolarHBondContact O-N 3.18Å; V7-E10 VanDerWaalsContact O-N 3.13Å; V7-A11 HydrophobicContact CG1-CB 4.15Å; V7-A11 VanDerWaalsContact O-CB 3.26Å; V7-A11 WeakPolarHBondContact O-CB 3.23Å; V7-A11 PolarHBondContact O-N 2.54Å
8I89.4Confident85.7Confident96 Ų9692.5 Ų92.549%0.49253%0.528SS..Hα-helixtrans-57-39.6-172.4-164.8163.7000113.5L4 F12L4-I8 VanDerWaalsContact O-CB 3.26Å; L4-I8 WeakPolarHBondContact O-CB 3.39Å; L4-I8 PolarHBondContact O-N 3.4Å; I8-F12 WeakPolarHBondContact O-CB 3.41Å; I8-F12 PolarHBondContact O-N 3.3Å
9T85.5Confident86.1Confident109 Ų10989.7 Ų89.767%0.66951%0.509SS*.Hα-helixtrans-67.7-43.7179.5-54.40000111.6V7 G13V7-T9 VanDerWaalsContact C-N 3.3Å; V7-T9 PolarHBondContact O-N 3.21Å; T9-G13 PolarHBondContact O-N 2.99Å
10E86.3Confident86.4Confident113 Ų11389.4 Ų89.453%0.52851%0.508SS..Hα-helixtrans-71.4-42.3178.4-59.8-166157.400111.5V7 F12 G13 V14V7-E10 PolarHBondContact O-N 3.18Å; V7-E10 VanDerWaalsContact O-N 3.13Å; E10-F12 VanDerWaalsContact C-N 3.29Å; E10-F12 PolarHBondContact O-N 3.09Å; E10-G13 PolarHBondContact O-N 3.3Å; E10-G13 VanDerWaalsContact O-N 3.17Å; E10-V14 WeakPolarHBondContact O-CG2 3.2Å; E10-V14 PolarHBondContact O-N 3.25Å
11A89.8Confident86.6Confident49 Ų4986.4 Ų86.441%0.40550%0.495SS..Hα-helixtrans-60.4-39.3176.900000111.8V7 V14 A15V7-A11 HydrophobicContact CG1-CB 4.15Å; V7-A11 VanDerWaalsContact O-CB 3.26Å; V7-A11 WeakPolarHBondContact O-CB 3.23Å; V7-A11 PolarHBondContact O-N 2.54Å; A11-V14 PolarHBondContact O-N 3.49Å; A11-A15 VanDerWaalsContact O-CB 3.22Å; A11-A15 WeakPolarHBondContact O-CB 3.39Å; A11-A15 PolarHBondContact O-N 3.4Å
12F89Confident88.6Confident142 Ų14276.1 Ų76.162%0.62345%0.446SS*.Hα-helixtrans-61.9-46.1174.7-180-98.8000111.8I8 E10 A15 L16I8-F12 WeakPolarHBondContact O-CB 3.41Å; I8-F12 PolarHBondContact O-N 3.3Å; E10-F12 VanDerWaalsContact C-N 3.29Å; E10-F12 PolarHBondContact O-N 3.09Å; F12-A15 PolarHBondContact O-N 3.44Å; F12-L16 HydrophobicContact CE1-CD2 4.34Å; F12-L16 WeakPolarHBondContact O-CB 3.29Å; F12-L16 PolarHBondContact O-N 3.49Å
13G88.8Confident89.4Confident8 Ų871.3 Ų71.38%0.08242%0.42CS..Hα-helixtrans-60.2-46.8176.800000112.4T9 E10 L16 V17T9-G13 PolarHBondContact O-N 2.99Å; E10-G13 PolarHBondContact O-N 3.3Å; E10-G13 VanDerWaalsContact O-N 3.17Å; G13-L16 PolarHBondContact O-N 3.48Å; G13-V17 WeakPolarHBondContact O-CB 3.48Å; G13-V17 WeakPolarHBondContact O-CG2 3.33Å; G13-V17 PolarHBondContact O-N 3.27Å
14V90.4Very high89.7Confident70 Ų7067.5 Ų67.542%0.42441%0.409SS..Hα-helixtrans-63.6-43.8178173.90000111.5E10 A11 G18 P60E10-V14 WeakPolarHBondContact O-CG2 3.2Å; E10-V14 PolarHBondContact O-N 3.25Å; A11-V14 PolarHBondContact O-N 3.49Å; V14-G18 WeakPolarHBondContact O-CA 3.24Å; V14-G18 PolarHBondContact O-N 2.88Å; V14-P60 HydrophobicContact CG1-CB 3.74Å; V14-P60 HydrophobicContact CG1-CG 4.11Å
15A92.1Very high90Very high61 Ų6162.8 Ų62.850%0.50438%0.384SS..Hα-helixtrans-63.9-44.2178.500000111.8A11 F12 Y19A11-A15 VanDerWaalsContact O-CB 3.22Å; A11-A15 WeakPolarHBondContact O-CB 3.39Å; A11-A15 PolarHBondContact O-N 3.4Å; F12-A15 PolarHBondContact O-N 3.44Å; A15-Y19 VanDerWaalsContact O-CB 3.31Å; A15-Y19 WeakPolarHBondContact O-CB 3.39Å; A15-Y19 PolarHBondContact O-N 3.33Å
16L89.8Confident90.2Very high66 Ų6659 Ų5935%0.34636%0.359SS..Hα-helixtrans-62.7-51.4178.5-178.166.3000111.2F12 G13 Y19 V20F12-L16 HydrophobicContact CE1-CD2 4.34Å; F12-L16 WeakPolarHBondContact O-CB 3.29Å; F12-L16 PolarHBondContact O-N 3.49Å; G13-L16 PolarHBondContact O-N 3.48Å; L16-Y19 PolarHBondContact O-N 3Å; L16-V20 HydrophobicContact CD1-CG2 4.35Å; L16-V20 WeakPolarHBondContact O-CB 3.33Å; L16-V20 VanDerWaalsContact O-CG2 3.24Å; L16-V20 WeakPolarHBondContact O-CG2 3.37Å; L16-V20 PolarHBondContact O-N 3.39Å
17V89.6Confident90.6Very high73 Ų7359.9 Ų59.944%0.44235%0.351SS..Hα-helixtrans-65.6-42-179.5174.70000111.2G13 V20 A21 L156G13-V17 WeakPolarHBondContact O-CB 3.48Å; G13-V17 WeakPolarHBondContact O-CG2 3.33Å; G13-V17 PolarHBondContact O-N 3.27Å; V17-V20 PolarHBondContact O-N 2.97Å; V17-A21 VanDerWaalsContact O-CB 3.25Å; V17-A21 WeakPolarHBondContact O-CB 3.33Å; V17-A21 PolarHBondContact O-N 3.45Å; V17-L156 HydrophobicContact CG2-CD1 4.02Å; V17-L156 HydrophobicContact CG2-CD2 3.45Å; V17-L156 VanDerWaalsContact CG2-CD2 3.45Å; V17-L156 HydrophobicContact CG2-CG 4.34Å
18G91.8Very high90.8Very high8 Ų858.5 Ų58.58%0.08235%0.351CS..Hα-helixtrans-59.4-47.8177.700000112.1V14 A21 S22V14-G18 WeakPolarHBondContact O-CA 3.24Å; V14-G18 PolarHBondContact O-N 2.88Å; G18-A21 PolarHBondContact O-N 2.92Å; G18-S22 WeakPolarHBondContact O-CB 3.38Å; G18-S22 PolarHBondContact O-N 2.94Å
19Y93.4Very high90.8Very high40 Ų4054.3 Ų54.316%0.15733%0.33CS..Hα-helixtrans-64.7-48.7177174.7-116.8000112.4A15 L16 A21 S22 L23 D39 F43 H46A15-Y19 VanDerWaalsContact O-CB 3.31Å; A15-Y19 WeakPolarHBondContact O-CB 3.39Å; A15-Y19 PolarHBondContact O-N 3.33Å; L16-Y19 PolarHBondContact O-N 3Å; Y19-A21 VanDerWaalsContact C-N 3.29Å; Y19-A21 PolarHBondContact O-N 3.06Å; Y19-S22 WeakPolarHBondContact O-CB 3.39Å; Y19-S22 PolarHBondContact O-N 2.96Å; Y19-S22 VanDerWaalsContact O-N 3.07Å; Y19-L23 HydrophobicContact CE1-CD2 4.23Å; Y19-L23 HydrophobicContact CE2-CB 4.33Å; Y19-L23 WeakPolarHBondContact O-CB 3.49Å; Y19-L23 PolarHBondContact O-N 3.35Å; Y19-D39 PolarHBondContact OH-O 3.23Å; Y19-D39 VanDerWaalsContact OH-O 3.1Å; Y19-F43 AromaticContact CD1-CD2 3.85Å; Y19-F43 HydrophobicContact CD1-CD2 3.85Å; Y19-F43 HydrophobicContact CD1-CE2 4.3Å; Y19-F43 HydrophobicContact CD2-CB 4.4Å; Y19-F43 AromaticContact CD2-CD2 3.79Å; Y19-F43 HydrophobicContact CD2-CD2 3.79Å; Y19-F43 AromaticContact CE1-CD2 3.76Å; Y19-F43 HydrophobicContact CE1-CD2 3.76Å; Y19-F43 HydrophobicContact CE2-CB 3.64Å; Y19-F43 AromaticContact CE2-CD2 3.73Å; Y19-F43 HydrophobicContact CE2-CD2 3.73Å; Y19-F43 HydrophobicContact CE2-CG 4.2Å; Y19-F43 AromaticContact CG-CD2 3.85Å; Y19-F43 HydrophobicContact CG-CD2 3.85Å; Y19-F43 HydrophobicContact CG-CE2 4.38Å; Y19-F43 AromaticContact CZ-CD2 3.71Å; Y19-H46 HydrophobicContact CD2-CB 4.48Å
20V91.7Very high91.1Very high82 Ų8249.6 Ų49.650%0.49730%0.303SS..Hα-helixtrans-60.6-40.6179.8171.10000111.1L16 V17 A24L16-V20 HydrophobicContact CD1-CG2 4.35Å; L16-V20 WeakPolarHBondContact O-CB 3.33Å; L16-V20 VanDerWaalsContact O-CG2 3.24Å; L16-V20 WeakPolarHBondContact O-CG2 3.37Å; L16-V20 PolarHBondContact O-N 3.39Å; V17-V20 PolarHBondContact O-N 2.97Å; V20-A24 VanDerWaalsContact O-CB 3.26Å; V20-A24 WeakPolarHBondContact O-CB 3.47Å; V20-A24 PolarHBondContact O-N 3.25Å
21A90.4Very high91.5Very high28 Ų2853 Ų5323%0.23132%0.315CS..Hα-helixtrans-64.3-40.5174.900000112.1V17 G18 Y19 L25V17-A21 VanDerWaalsContact O-CB 3.25Å; V17-A21 WeakPolarHBondContact O-CB 3.33Å; V17-A21 PolarHBondContact O-N 3.45Å; G18-A21 PolarHBondContact O-N 2.92Å; Y19-A21 VanDerWaalsContact C-N 3.29Å; Y19-A21 PolarHBondContact O-N 3.06Å; A21-L25 WeakPolarHBondContact O-CB 3.33Å; A21-L25 PolarHBondContact O-N 3.37Å; A21-L25 VanDerWaalsContact O-N 3.13Å
22S93.1Very high91.5Very high19 Ų1957.3 Ų57.313%0.13333%0.325CS..Hα-helixtrans-64-48.3175.9-163.10000112.3G18 Y19 A24 L25 A26G18-S22 WeakPolarHBondContact O-CB 3.38Å; G18-S22 PolarHBondContact O-N 2.94Å; Y19-S22 WeakPolarHBondContact O-CB 3.39Å; Y19-S22 PolarHBondContact O-N 2.96Å; Y19-S22 VanDerWaalsContact O-N 3.07Å; S22-A24 PolarHBondContact O-N 2.87Å; S22-L25 WeakPolarHBondContact O-CB 3.43Å; S22-L25 PolarHBondContact O-N 2.98Å; S22-A26 WeakPolarHBondContact O-CB 3.48Å; S22-A26 PolarHBondContact O-N 3.41Å
23L94Very high91.5Very high28 Ų2855.2 Ų55.215%0.14732%0.316CS..Hα-helixtrans-62.8-43.8178.9-173.165.4000111.7Y19 L25 A26 Q27 D39 E42Y19-L23 HydrophobicContact CE1-CD2 4.23Å; Y19-L23 HydrophobicContact CE2-CB 4.33Å; Y19-L23 WeakPolarHBondContact O-CB 3.49Å; Y19-L23 PolarHBondContact O-N 3.35Å; L23-L25 VanDerWaalsContact C-N 3.33Å; L23-L25 PolarHBondContact O-N 3.49Å; L23-A26 PolarHBondContact O-N 3.2Å; L23-A26 VanDerWaalsContact O-N 3.17Å; L23-Q27 HydrophobicContact CD1-CG 4.31Å; L23-Q27 HydrophobicContact CG-CG 4.32Å; L23-Q27 WeakPolarHBondContact O-CB 3.44Å; L23-Q27 WeakPolarHBondContact O-CG 3.28Å; L23-Q27 PolarHBondContact O-N 2.84Å; L23-D39 HydrophobicContact CD1-CB 4.2Å; L23-D39 WeakPolarHBondContact CD1-OD1 3.29Å; L23-E42 HydrophobicContact CD1-CB 4.44Å
24A91.8Very high91.7Very high55 Ų5564.2 Ų64.246%0.45535%0.353SS..Hα-helixtrans-61.5-41.2177.900000112.2V20 S22 G28V20-A24 VanDerWaalsContact O-CB 3.26Å; V20-A24 WeakPolarHBondContact O-CB 3.47Å; V20-A24 PolarHBondContact O-N 3.25Å; S22-A24 PolarHBondContact O-N 2.87Å; A24-G28 PolarHBondContact O-N 3.16Å
25L91.4Very high91.8Very high39 Ų3966 Ų6620%0.20435%0.352CS..Hα-helixtrans-63.4-45.8173.4-178.2103.1000111.2A21 S22 L23 G28 S29 A63 M65 T68A21-L25 WeakPolarHBondContact O-CB 3.33Å; A21-L25 PolarHBondContact O-N 3.37Å; A21-L25 VanDerWaalsContact O-N 3.13Å; S22-L25 WeakPolarHBondContact O-CB 3.43Å; S22-L25 PolarHBondContact O-N 2.98Å; L23-L25 VanDerWaalsContact C-N 3.33Å; L23-L25 PolarHBondContact O-N 3.49Å; L25-G28 PolarHBondContact O-N 3.23Å; L25-S29 WeakPolarHBondContact O-CB 3.35Å; L25-S29 PolarHBondContact O-N 3.13Å; L25-S29 PolarHBondContact O-OG 3.33Å; L25-A63 HydrophobicContact CB-CB 4.03Å; L25-A63 HydrophobicContact CD2-CB 3.94Å; L25-A63 HydrophobicContact CG-CB 4.43Å; L25-M65 HydrophobicContact CD1-CB 3.91Å; L25-M65 HydrophobicContact CD1-CG 3.63Å; L25-T68 HydrophobicContact CD1-CG2 4.38Å; L25-T68 HydrophobicContact CD2-CG2 4.07Å; L25-T68 HydrophobicContact CG-CG2 4.48Å
26A92.7Very high91.9Very high11 Ų1168.4 Ų68.49%0.09137%0.366CS..Hα-helixtrans-61.5-52.5-179.100000110.2S22 L23 G28 S29 A30 I37S22-A26 WeakPolarHBondContact O-CB 3.48Å; S22-A26 PolarHBondContact O-N 3.41Å; L23-A26 PolarHBondContact O-N 3.2Å; L23-A26 VanDerWaalsContact O-N 3.17Å; A26-G28 VanDerWaalsContact C-N 3.33Å; A26-G28 PolarHBondContact O-N 3.01Å; A26-S29 CarbonylContact O-C 3.55Å; A26-S29 WeakPolarHBondContact O-CA 3.45Å; A26-S29 WeakPolarHBondContact O-CB 3.31Å; A26-S29 PolarHBondContact O-N 3.44Å; A26-A30 PolarHBondContact O-N 2.86Å; A26-I37 HydrophobicContact CB-CD1 3.7Å; A26-I37 WeakPolarHBondContact O-CD1 3.44Å
27Q93.6Very high92.1Very high88 Ų8867.1 Ų67.141%0.41136%0.359SS..Hα-helixtrans-59.6-39.9176.7-70.2179.6-1200112.6L23 S29 A30 K31 D39L23-Q27 HydrophobicContact CD1-CG 4.31Å; L23-Q27 HydrophobicContact CG-CG 4.32Å; L23-Q27 WeakPolarHBondContact O-CB 3.44Å; L23-Q27 WeakPolarHBondContact O-CG 3.28Å; L23-Q27 PolarHBondContact O-N 2.84Å; Q27-S29 VanDerWaalsContact C-N 3.27Å; Q27-S29 PolarHBondContact O-N 2.92Å; Q27-A30 PolarHBondContact O-N 3.33Å; Q27-K31 WeakPolarHBondContact O-CB 3.34Å; Q27-K31 PolarHBondContact O-N 3.02Å; Q27-D39 PolarHBondContact NE2-OD1 2.94Å
28G91.3Very high92.4Very high43 Ų4367.6 Ų67.644%0.44336%0.359SS..Hα-helixtrans-60.8-37.4172.900000112.6A24 L25 A26 K32A24-G28 PolarHBondContact O-N 3.16Å; L25-G28 PolarHBondContact O-N 3.23Å; A26-G28 VanDerWaalsContact C-N 3.33Å; A26-G28 PolarHBondContact O-N 3.01Å; G28-K32 WeakPolarHBondContact O-CB 3.46Å; G28-K32 PolarHBondContact O-N 2.98Å; G28-K32 VanDerWaalsContact O-N 3.09Å
29S90.1Very high92.5Very high8 Ų870.4 Ų70.46%0.05637%0.372CS..Hα-helixtrans-73.5-43.3177.6-54.70000111.8L25 A26 Q27 K31 K32 F33 Y35 Y72L25-S29 WeakPolarHBondContact O-CB 3.35Å; L25-S29 PolarHBondContact O-N 3.13Å; L25-S29 PolarHBondContact O-OG 3.33Å; A26-S29 CarbonylContact O-C 3.55Å; A26-S29 WeakPolarHBondContact O-CA 3.45Å; A26-S29 WeakPolarHBondContact O-CB 3.31Å; A26-S29 PolarHBondContact O-N 3.44Å; Q27-S29 VanDerWaalsContact C-N 3.27Å; Q27-S29 PolarHBondContact O-N 2.92Å; S29-K31 VanDerWaalsContact C-N 3.3Å; S29-K31 PolarHBondContact O-N 3.42Å; S29-K32 PolarHBondContact O-N 3.29Å; S29-K32 VanDerWaalsContact O-N 3.12Å; S29-F33 VanDerWaalsContact O-CD2 3.29Å; S29-F33 WeakPolarHBondContact O-CD2 2.9Å; S29-F33 PolarHBondContact O-N 3.38Å; S29-Y35 VanDerWaalsContact CB-OH 3.25Å; S29-Y35 WeakPolarHBondContact CB-OH 3.32Å; S29-Y35 WeakPolarHBondContact O-CE1 3.39Å; S29-Y72 VanDerWaalsContact CB-OH 3.3Å; S29-Y72 WeakPolarHBondContact CB-OH 3.42Å; S29-Y72 WeakPolarHBondContact OG-CE2 3.46Å; S29-Y72 PolarHBondContact OG-OH 3.34Å; S29-Y72 VanDerWaalsContact OG-OH 3.07Å
30A92.8Very high92.6Very high11 Ų1174.5 Ų74.59%0.09140%0.397CS..Hα-helixtrans-54.7-45.9171.200000112A26 Q27 K32 K34 Y35 I37A26-A30 PolarHBondContact O-N 2.86Å; Q27-A30 PolarHBondContact O-N 3.33Å; A30-K32 PolarHBondContact O-N 2.98Å; A30-K34 VanDerWaalsContact O-CA 3.23Å; A30-K34 WeakPolarHBondContact O-CA 3.09Å; A30-K34 PolarHBondContact O-N 3.23Å; A30-Y35 VanDerWaalsContact CA-CZ 3.49Å; A30-Y35 HydrophobicContact CB-CD2 4.03Å; A30-Y35 HydrophobicContact CB-CE1 4.47Å; A30-Y35 HydrophobicContact CB-CE2 3.82Å; A30-Y35 HydrophobicContact CB-CG 4.45Å; A30-Y35 WeakPolarHBondContact CB-O 2.92Å; A30-Y35 PolarHBondContact N-OH 2.92Å; A30-Y35 PolarHBondContact O-N 3.35Å; A30-I37 HydrophobicContact CB-CD1 3.36Å; A30-I37 HydrophobicContact CB-CG1 3.81Å
31K93Very high92.8Very high184 Ų18476.7 Ų76.780%0.840%0.402SS*.Hα-helixtrans-63.1-41.2176.5-173.3174.9-178.5175.40112.2Q27 S29Q27-K31 WeakPolarHBondContact O-CB 3.34Å; Q27-K31 PolarHBondContact O-N 3.02Å; S29-K31 VanDerWaalsContact C-N 3.3Å; S29-K31 PolarHBondContact O-N 3.42Å
32K90.1Very high93Very high139 Ų13978.2 Ų78.260%0.60440%0.404SS*.Hα-helixtrans-68.1-42.9-179.6-175.7176.7178.9-178.10112.5G28 S29 A30G28-K32 WeakPolarHBondContact O-CB 3.46Å; G28-K32 PolarHBondContact O-N 2.98Å; G28-K32 VanDerWaalsContact O-N 3.09Å; S29-K32 PolarHBondContact O-N 3.29Å; S29-K32 VanDerWaalsContact O-N 3.12Å; A30-K32 PolarHBondContact O-N 2.98Å
33F90.4Very high93.1Very high98 Ų9883.2 Ų83.243%0.4342%0.424SS..Hα-helixtrans-1023.9-174.5-63.2-71.2000114S29 Y35 Y72S29-F33 VanDerWaalsContact O-CD2 3.29Å; S29-F33 WeakPolarHBondContact O-CD2 2.9Å; S29-F33 PolarHBondContact O-N 3.38Å; F33-Y35 HydrophobicContact CB-CD1 3.64Å; F33-Y35 HydrophobicContact CB-CE1 3.73Å; F33-Y35 HydrophobicContact CD2-CE1 4.22Å; F33-Y35 HydrophobicContact CG-CE1 4.44Å; F33-Y72 AromaticContact CE2-CD1 3.79Å; F33-Y72 HydrophobicContact CE2-CD1 3.79Å; F33-Y72 AromaticContact CE2-CD2 3.65Å; F33-Y72 HydrophobicContact CE2-CD2 3.65Å; F33-Y72 AromaticContact CE2-CE1 3.82Å; F33-Y72 HydrophobicContact CE2-CE1 3.82Å; F33-Y72 AromaticContact CE2-CE2 3.64Å; F33-Y72 HydrophobicContact CE2-CE2 3.64Å; F33-Y72 AromaticContact CE2-CG 3.72Å; F33-Y72 HydrophobicContact CE2-CG 3.72Å; F33-Y72 AromaticContact CE2-CZ 3.75Å; F33-Y72 AromaticContact CZ-CD1 3.83Å; F33-Y72 HydrophobicContact CZ-CD1 3.83Å; F33-Y72 AromaticContact CZ-CD2 3.99Å; F33-Y72 HydrophobicContact CZ-CD2 3.99Å; F33-Y72 HydrophobicContact CZ-CE1 4.31Å; F33-Y72 HydrophobicContact CZ-CE2 4.42Å; F33-Y72 AromaticContact CZ-CG 3.67Å; F33-Y72 HydrophobicContact CZ-CG 3.67Å
34K92.6Very high93.2Very high198 Ų19887.2 Ų87.286%0.86144%0.444SS*.THydrogen-bonded Turntrans57.147.6175.7-55.6-178.1179.8-178.80113.8A30A30-K34 VanDerWaalsContact O-CA 3.23Å; A30-K34 WeakPolarHBondContact O-CA 3.09Å; A30-K34 PolarHBondContact O-N 3.23Å
35Y93.3Very high93.4Very high106 Ų10687 Ų8742%0.41644%0.443SS..  trans-118.5162.9169.465.9-93.8000110.6S29 A30 F33 I37S29-Y35 VanDerWaalsContact CB-OH 3.25Å; S29-Y35 WeakPolarHBondContact CB-OH 3.32Å; S29-Y35 WeakPolarHBondContact O-CE1 3.39Å; A30-Y35 VanDerWaalsContact CA-CZ 3.49Å; A30-Y35 HydrophobicContact CB-CD2 4.03Å; A30-Y35 HydrophobicContact CB-CE1 4.47Å; A30-Y35 HydrophobicContact CB-CE2 3.82Å; A30-Y35 HydrophobicContact CB-CG 4.45Å; A30-Y35 WeakPolarHBondContact CB-O 2.92Å; A30-Y35 PolarHBondContact N-OH 2.92Å; A30-Y35 PolarHBondContact O-N 3.35Å; F33-Y35 HydrophobicContact CB-CD1 3.64Å; F33-Y35 HydrophobicContact CB-CE1 3.73Å; F33-Y35 HydrophobicContact CD2-CE1 4.22Å; F33-Y35 HydrophobicContact CG-CE1 4.44Å; Y35-I37 HydrophobicContact CD2-CG1 3.99Å; Y35-I37 HydrophobicContact CE2-CD1 3.71Å; Y35-I37 HydrophobicContact CE2-CG1 3.49Å; Y35-I37 VanDerWaalsContact CE2-CG1 3.49Å
36S93.4Very high93.5Very high112 Ų11286.2 Ų86.278%0.78344%0.438SS*.  trans-94.7147.7176.2560000111.4
37I94Very high93.7Very high40 Ų4087.3 Ų87.321%0.20545%0.45CS..  trans-118.9143.6174.9-71.8168.1000108.7A26 A30 Y35 E42A26-I37 HydrophobicContact CB-CD1 3.7Å; A26-I37 WeakPolarHBondContact O-CD1 3.44Å; A30-I37 HydrophobicContact CB-CD1 3.36Å; A30-I37 HydrophobicContact CB-CG1 3.81Å; Y35-I37 HydrophobicContact CD2-CG1 3.99Å; Y35-I37 HydrophobicContact CE2-CD1 3.71Å; Y35-I37 HydrophobicContact CE2-CG1 3.49Å; Y35-I37 VanDerWaalsContact CE2-CG1 3.49Å; I37-E42 HydrophobicContact CG2-CG 3.65Å
38D95.8Very high93.8Very high83 Ų8387.4 Ų87.444%0.44445%0.453SS..  trans-97111.6165.4-177.3-12.1000108.9N40 Q41 E42D38-N40 VanDerWaalsContact C-N 3.26Å; D38-N40 PolarHBondContact O-N 3.35Å; D38-N40 WeakPolarHBondContact OD1-CB 3.41Å; D38-N40 PolarHBondContact OD1-N 2.99Å; D38-Q41 HydrophobicContact CB-CB 3.88Å; D38-Q41 PolarHBondContact O-N 3.33Å; D38-Q41 PolarHBondContact OD1-N 3.05Å; D38-E42 PolarHBondContact O-N 3.49Å; D38-E42 VanDerWaalsContact O-N 3.1Å
39D94.6Very high93.9Very high66 Ų6687.9 Ų87.935%0.35345%0.449SS..Hα-helixtrans-61.8-33.8-178.2-63.4-15.2000111.7Y19 L23 Q27 E42 F43Y19-D39 PolarHBondContact OH-O 3.23Å; Y19-D39 VanDerWaalsContact OH-O 3.1Å; L23-D39 HydrophobicContact CD1-CB 4.2Å; L23-D39 WeakPolarHBondContact CD1-OD1 3.29Å; Q27-D39 PolarHBondContact NE2-OD1 2.94Å; D39-E42 PolarHBondContact O-N 3.5Å; D39-F43 PolarHBondContact O-N 2.93Å
40N95.6Very high94.2Very high127 Ų12789.3 Ų89.368%0.67946%0.456SS*.Hα-helixtrans-70-37.9178.5-67.6-40.6000111.4D38 F43 L44D38-N40 VanDerWaalsContact C-N 3.26Å; D38-N40 PolarHBondContact O-N 3.35Å; D38-N40 WeakPolarHBondContact OD1-CB 3.41Å; D38-N40 PolarHBondContact OD1-N 2.99Å; N40-F43 PolarHBondContact O-N 3.37Å; N40-L44 PolarHBondContact O-N 3.17Å
41Q95.9Very high94.3Very high128 Ų12893.5 Ų93.560%0.59848%0.476SS*.Hα-helixtrans-65.6-42.6176.5-172.2179.9400111D38 L44 A45D38-Q41 HydrophobicContact CB-CB 3.88Å; D38-Q41 PolarHBondContact O-N 3.33Å; D38-Q41 PolarHBondContact OD1-N 3.05Å; Q41-L44 PolarHBondContact O-N 3.38Å; Q41-A45 VanDerWaalsContact O-CB 3.26Å; Q41-A45 WeakPolarHBondContact O-CB 3.43Å; Q41-A45 PolarHBondContact O-N 3.42Å
42E94.5Very high94.4Very high59 Ų5988.8 Ų88.828%0.27646%0.462SS..Hα-helixtrans-63.5-40.2175.3-73.9-64.514400111.8L23 I37 D38 D39 A45 H46L23-E42 HydrophobicContact CD1-CB 4.44Å; I37-E42 HydrophobicContact CG2-CG 3.65Å; D38-E42 PolarHBondContact O-N 3.49Å; D38-E42 VanDerWaalsContact O-N 3.1Å; D39-E42 PolarHBondContact O-N 3.5Å; E42-A45 PolarHBondContact O-N 3.25Å; E42-H46 VanDerWaalsContact O-CB 3.25Å; E42-H46 WeakPolarHBondContact O-CB 3.4Å; E42-H46 PolarHBondContact O-N 3.2Å
43F94.7Very high94.7Very high125 Ų12583.3 Ų83.355%0.54844%0.442SS..Hα-helixtrans-59.9-49.1175-176.2-107.8000111.9Y19 D39 N40 H46 G47Y19-F43 AromaticContact CD1-CD2 3.85Å; Y19-F43 HydrophobicContact CD1-CD2 3.85Å; Y19-F43 HydrophobicContact CD1-CE2 4.3Å; Y19-F43 HydrophobicContact CD2-CB 4.4Å; Y19-F43 AromaticContact CD2-CD2 3.79Å; Y19-F43 HydrophobicContact CD2-CD2 3.79Å; Y19-F43 AromaticContact CE1-CD2 3.76Å; Y19-F43 HydrophobicContact CE1-CD2 3.76Å; Y19-F43 HydrophobicContact CE2-CB 3.64Å; Y19-F43 AromaticContact CE2-CD2 3.73Å; Y19-F43 HydrophobicContact CE2-CD2 3.73Å; Y19-F43 HydrophobicContact CE2-CG 4.2Å; Y19-F43 AromaticContact CG-CD2 3.85Å; Y19-F43 HydrophobicContact CG-CD2 3.85Å; Y19-F43 HydrophobicContact CG-CE2 4.38Å; Y19-F43 AromaticContact CZ-CD2 3.71Å; D39-F43 PolarHBondContact O-N 2.93Å; N40-F43 PolarHBondContact O-N 3.37Å; F43-H46 PolarHBondContact O-N 2.85Å; F43-G47 PolarHBondContact O-N 2.91Å
44L96.4Very high94.8Very high112 Ų11282 Ų8259%0.58645%0.445SS*.Hα-helixtrans-64.2-45.2179.1-175.367.2000111.6N40 Q41 H46 G47 L48N40-L44 PolarHBondContact O-N 3.17Å; Q41-L44 PolarHBondContact O-N 3.38Å; L44-H46 PolarHBondContact O-N 2.89Å; L44-G47 PolarHBondContact O-N 3.29Å; L44-L48 HydrophobicContact CD1-CD1 4.22Å; L44-L48 HydrophobicContact CD1-CG 4.37Å; L44-L48 HydrophobicContact CG-CD1 3.93Å; L44-L48 HydrophobicContact CG-CG 4.45Å; L44-L48 WeakPolarHBondContact O-CB 3.25Å; L44-L48 WeakPolarHBondContact O-CG 3.47Å; L44-L48 PolarHBondContact O-N 3.26Å
45A94.4Very high95Very high50 Ų5080 Ų8041%0.41344%0.437SS..Hα-helixtrans-61.3-44178.600000111.5Q41 E42 S49Q41-A45 VanDerWaalsContact O-CB 3.26Å; Q41-A45 WeakPolarHBondContact O-CB 3.43Å; Q41-A45 PolarHBondContact O-N 3.42Å; E42-A45 PolarHBondContact O-N 3.25Å; A45-S49 WeakPolarHBondContact O-CB 3.43Å; A45-S49 PolarHBondContact O-N 3.01Å; A45-S49 PolarHBondContact O-OG 2.88Å
46H94.9Very high95.1Very high23 Ų2382.2 Ų82.211%0.10645%0.448CS..Hα-helixtrans-66.6-42.7179-166.544.4000112.2Y19 E42 F43 L44 S49 N50 S61Y19-H46 HydrophobicContact CD2-CB 4.48Å; E42-H46 VanDerWaalsContact O-CB 3.25Å; E42-H46 WeakPolarHBondContact O-CB 3.4Å; E42-H46 PolarHBondContact O-N 3.2Å; F43-H46 PolarHBondContact O-N 2.85Å; L44-H46 PolarHBondContact O-N 2.89Å; H46-S49 PolarHBondContact O-N 3.12Å; H46-S49 PolarHBondContact O-OG 2.82Å; H46-N50 PolarHBondContact CE1-ND2 3.49Å; H46-N50 PolarHBondContact O-N 3.32Å; H46-N50 PolarHBondContact O-ND2 2.93Å; H46-N50 VanDerWaalsContact O-ND2 3.08Å; H46-S61 PolarHBondContact CE1-O 3.23Å
47G95.5Very high95Very high33 Ų3386.8 Ų86.834%0.3446%0.455SS..Hα-helixtrans-61-50.2174.800000112.2F43 L44 S49 N50 I51F43-G47 PolarHBondContact O-N 2.91Å; L44-G47 PolarHBondContact O-N 3.29Å; G47-S49 VanDerWaalsContact C-N 3.32Å; G47-S49 PolarHBondContact O-N 3.26Å; G47-N50 PolarHBondContact O-N 3.02Å; G47-I51 WeakPolarHBondContact O-CG1 3.47Å; G47-I51 PolarHBondContact O-N 2.81Å
48L96.1Very high94.9Very high90 Ų9088.1 Ų88.147%0.47147%0.467SS..Hα-helixtrans-60.3-40.8177.7-75.2172.1000112.1L44 N50 I51 V52L44-L48 HydrophobicContact CD1-CD1 4.22Å; L44-L48 HydrophobicContact CD1-CG 4.37Å; L44-L48 HydrophobicContact CG-CD1 3.93Å; L44-L48 HydrophobicContact CG-CG 4.45Å; L44-L48 WeakPolarHBondContact O-CB 3.25Å; L44-L48 WeakPolarHBondContact O-CG 3.47Å; L44-L48 PolarHBondContact O-N 3.26Å; L48-N50 VanDerWaalsContact C-N 3.29Å; L48-N50 PolarHBondContact O-N 3.13Å; L48-I51 PolarHBondContact O-N 2.77Å; L48-V52 WeakPolarHBondContact O-CB 3.44Å; L48-V52 VanDerWaalsContact O-CG2 3.32Å; L48-V52 WeakPolarHBondContact O-CG2 3.43Å; L48-V52 PolarHBondContact O-N 2.68Å
49S94.8Very high94.8Very high53 Ų5391.1 Ų91.137%0.37148%0.481SS..Hα-helixtrans-60.6-38.1178.275.30000112.7A45 H46 G47 S53A45-S49 WeakPolarHBondContact O-CB 3.43Å; A45-S49 PolarHBondContact O-N 3.01Å; A45-S49 PolarHBondContact O-OG 2.88Å; H46-S49 PolarHBondContact O-N 3.12Å; H46-S49 PolarHBondContact O-OG 2.82Å; G47-S49 VanDerWaalsContact C-N 3.32Å; G47-S49 PolarHBondContact O-N 3.26Å; S49-S53 VanDerWaalsContact O-CB 3.3Å; S49-S53 WeakPolarHBondContact O-CB 3.16Å; S49-S53 PolarHBondContact O-N 3.5Å; S49-S53 VanDerWaalsContact O-N 3.14Å; S49-S53 PolarHBondContact O-OG 2.92Å
50N94.9Very high94.6Very high39 Ų3992.2 Ų92.221%0.20949%0.492CS..Hα-helixtrans-78.3-35178.3-78.6-63000112.4H46 G47 L48 S53 S54 S61H46-N50 PolarHBondContact CE1-ND2 3.49Å; H46-N50 PolarHBondContact O-N 3.32Å; H46-N50 PolarHBondContact O-ND2 2.93Å; H46-N50 VanDerWaalsContact O-ND2 3.08Å; G47-N50 PolarHBondContact O-N 3.02Å; L48-N50 VanDerWaalsContact C-N 3.29Å; L48-N50 PolarHBondContact O-N 3.13Å; N50-S53 WeakPolarHBondContact CA-OG 3.5Å; N50-S53 PolarHBondContact O-OG 2.92Å; N50-S54 WeakPolarHBondContact O-CB 3.45Å; N50-S54 PolarHBondContact O-N 3.22Å; N50-S61 PolarHBondContact ND2-O 2.84Å; N50-S61 PolarHBondContact OD1-N 3.02Å; N50-S61 PolarHBondContact OD1-O 3.25Å; N50-S61 PolarHBondContact OD1-OG 3.08Å; N50-S61 VanDerWaalsContact OD1-OG 3.07Å
51I95.4Very high94.3Very high99 Ų9988.8 Ų88.851%0.50848%0.478SS..Hα-helixtrans-63.2-52.2173-69.4166.9000110.1G47 L48 S53 S54 F55G47-I51 WeakPolarHBondContact O-CG1 3.47Å; G47-I51 PolarHBondContact O-N 2.81Å; L48-I51 PolarHBondContact O-N 2.77Å; I51-S53 VanDerWaalsContact C-N 3.33Å; I51-S53 PolarHBondContact O-N 2.62Å; I51-S54 WeakPolarHBondContact O-CB 3.46Å; I51-S54 PolarHBondContact O-N 3.42Å; I51-S54 PolarHBondContact O-OG 2.94Å; I51-F55 HydrophobicContact CG2-CE2 4.05Å; I51-F55 WeakPolarHBondContact O-CD2 3.33Å; I51-F55 WeakPolarHBondContact O-CE2 3.4Å
52V96.2Very high94Very high84 Ų8485.5 Ų85.551%0.50947%0.473SS..Hα-helixtrans-60.6-44.4-178.6173.40000110.8L48 S54 F55 F56L48-V52 WeakPolarHBondContact O-CB 3.44Å; L48-V52 VanDerWaalsContact O-CG2 3.32Å; L48-V52 WeakPolarHBondContact O-CG2 3.43Å; L48-V52 PolarHBondContact O-N 2.68Å; V52-S54 VanDerWaalsContact C-N 3.32Å; V52-S54 PolarHBondContact O-N 2.66Å; V52-F55 PolarHBondContact O-N 3.48Å; V52-F56 HydrophobicContact CG1-CE2 4.29Å; V52-F56 WeakPolarHBondContact O-CD2 3.42Å; V52-F56 WeakPolarHBondContact O-CE2 3.45Å
53S94.4Very high93.6Very high24 Ų2484 Ų8417%0.16847%0.47CS..Hα-helixtrans-69.5-25.5-179.559.60000113.8S49 N50 I51 F55 F56 C58S49-S53 VanDerWaalsContact O-CB 3.3Å; S49-S53 WeakPolarHBondContact O-CB 3.16Å; S49-S53 PolarHBondContact O-N 3.5Å; S49-S53 VanDerWaalsContact O-N 3.14Å; S49-S53 PolarHBondContact O-OG 2.92Å; N50-S53 WeakPolarHBondContact CA-OG 3.5Å; N50-S53 PolarHBondContact O-OG 2.92Å; I51-S53 VanDerWaalsContact C-N 3.33Å; I51-S53 PolarHBondContact O-N 2.62Å; S53-F55 PolarHBondContact O-N 3.46Å; S53-F56 PolarHBondContact O-N 2.89Å; S53-C58 VanDerWaalsContact O-CB 3.31Å; S53-C58 WeakPolarHBondContact O-CB 3.28Å; S53-C58 PolarHBondContact O-N 3.29Å
54S94.3Very high93.3Very high72 Ų7280.5 Ų80.550%0.50346%0.464SS..Hα-helixtrans-60.7-29.4176.875.60000113.8N50 I51 V52 F56 F57N50-S54 WeakPolarHBondContact O-CB 3.45Å; N50-S54 PolarHBondContact O-N 3.22Å; I51-S54 WeakPolarHBondContact O-CB 3.46Å; I51-S54 PolarHBondContact O-N 3.42Å; I51-S54 PolarHBondContact O-OG 2.94Å; V52-S54 VanDerWaalsContact C-N 3.32Å; V52-S54 PolarHBondContact O-N 2.66Å; S54-F56 PolarHBondContact O-N 2.92Å; S54-F57 PolarHBondContact O-N 3.45Å
55F95.8Very high92.6Very high156 Ų15680 Ų8068%0.68446%0.461SS*.THydrogen-bonded Turntrans-70.4-12175.4-64.7-79000113.6I51 V52 S53I51-F55 HydrophobicContact CG2-CE2 4.05Å; I51-F55 WeakPolarHBondContact O-CD2 3.33Å; I51-F55 WeakPolarHBondContact O-CE2 3.4Å; V52-F55 PolarHBondContact O-N 3.48Å; S53-F55 PolarHBondContact O-N 3.46Å
56F94.9Very high92.1Very high151 Ų15180.6 Ų80.666%0.66247%0.471SS*.THydrogen-bonded Turntrans-11221.2-178-59.4-85.7000112.7V52 S53 S54 C58V52-F56 HydrophobicContact CG1-CE2 4.29Å; V52-F56 WeakPolarHBondContact O-CD2 3.42Å; V52-F56 WeakPolarHBondContact O-CE2 3.45Å; S53-F56 PolarHBondContact O-N 2.89Å; S54-F56 PolarHBondContact O-N 2.92Å; F56-C58 PolarHBondContact O-N 3.27Å
57F92Very high91.7Very high208 Ų20887.7 Ų87.791%0.91250%0.497SS*.THydrogen-bonded Turntrans60.225.3-178-53.8-85.1000114.2S54S54-F57 PolarHBondContact O-N 3.45Å
58C92.6Very high91.4Very high68 Ų6887.5 Ų87.546%0.45949%0.489SS..PPolyproline II helixtrans-76145.1176-64.80000111.5S53 F56S53-C58 VanDerWaalsContact O-CB 3.31Å; S53-C58 WeakPolarHBondContact O-CB 3.28Å; S53-C58 PolarHBondContact O-N 3.29Å; F56-C58 PolarHBondContact O-N 3.27Å
59I92.4Very high90.8Very high146 Ų14685.7 Ų85.775%0.74949%0.487SS*.PPolyproline II helixtrans-72.1155.3165.560.9173.5000110.3S61I59-S61 PolarHBondContact O-N 2.96Å
60P91.5Very high90.5Very high90 Ų9085 Ų8558%0.58449%0.488SS*.PPolyproline II helixtrans-53.2126.7174-2634.9000111.3V14V14-P60 HydrophobicContact CG1-CB 3.74Å; V14-P60 HydrophobicContact CG1-CG 4.11Å
61S89.8Confident90.2Very high55 Ų5585.5 Ų85.539%0.38549%0.49SS..PPolyproline II helixtrans-94.7148.5179.469.40000110.7H46 N50 I59H46-S61 PolarHBondContact CE1-O 3.23Å; N50-S61 PolarHBondContact ND2-O 2.84Å; N50-S61 PolarHBondContact OD1-N 3.02Å; N50-S61 PolarHBondContact OD1-O 3.25Å; N50-S61 PolarHBondContact OD1-OG 3.08Å; N50-S61 VanDerWaalsContact OD1-OG 3.07Å; I59-S61 PolarHBondContact O-N 2.96Å
62A89.3Confident89.9Confident59 Ų5983.7 Ų83.749%0.48848%0.478SS..  trans-141.6178176.300000109.9A64A62-A64 PolarHBondContact O-N 2.99Å
63A85.9Confident89.6Confident27 Ų2784.7 Ų84.722%0.22349%0.489CS..  trans-64.9134.4179.700000113.8L25L25-A63 HydrophobicContact CB-CB 4.03Å; L25-A63 HydrophobicContact CD2-CB 3.94Å; L25-A63 HydrophobicContact CG-CB 4.43Å
64A87.3Confident89.4Confident51 Ų5188.7 Ų88.742%0.42151%0.512SS..  trans-103.582.9177.200000111.3A62 G66 R67 T68A62-A64 PolarHBondContact O-N 2.99Å; A64-G66 VanDerWaalsContact C-N 3.32Å; A64-G66 PolarHBondContact O-N 2.92Å; A64-R67 HydrophobicContact CB-CB 3.94Å; A64-R67 HydrophobicContact CB-CG 3.99Å; A64-R67 PolarHBondContact O-N 2.75Å; A64-R67 VanDerWaalsContact O-N 3.1Å; A64-T68 PolarHBondContact O-N 3.18Å; A64-T68 PolarHBondContact O-OG1 3.03Å
65M82.3Confident89.2Confident103 Ų10387.7 Ų87.751%0.50751%0.513SS..Hα-helixtrans-51.9-45.3-174.7-58.3-174.7-15500113.9L25 T68 A69L25-M65 HydrophobicContact CD1-CB 3.91Å; L25-M65 HydrophobicContact CD1-CG 3.63Å; M65-T68 PolarHBondContact O-N 2.87Å; M65-A69 VanDerWaalsContact O-CB 3.31Å; M65-A69 WeakPolarHBondContact O-CB 3.27Å; M65-A69 PolarHBondContact O-N 2.8Å
66G83.3Confident88.9Confident61 Ų6181.4 Ų81.463%0.62949%0.49SS*.Hα-helixtrans-65.5-39.7-179.800000113.5A64 G70A64-G66 VanDerWaalsContact C-N 3.32Å; A64-G66 PolarHBondContact O-N 2.92Å; G66-G70 PolarHBondContact O-N 3.26Å
67R86.4Confident88.5Confident172 Ų17284 Ų8465%0.64950%0.501SS*.Hα-helixtrans-67.8-44.9178.3-65.8-68.5-66.8-158.2-1.5110.8A64 G70 L71A64-R67 HydrophobicContact CB-CB 3.94Å; A64-R67 HydrophobicContact CB-CG 3.99Å; A64-R67 PolarHBondContact O-N 2.75Å; A64-R67 VanDerWaalsContact O-N 3.1Å; R67-G70 PolarHBondContact O-N 3.49Å; R67-L71 WeakPolarHBondContact O-CB 3.27Å; R67-L71 PolarHBondContact O-N 2.83Å
68T89.2Confident88.5Confident30 Ų3078.5 Ų78.518%0.18448%0.484CS..Hα-helixtrans-63.1-43.3176.9-59.10000111.6L25 A64 M65 G70 L71 Y72L25-T68 HydrophobicContact CD1-CG2 4.38Å; L25-T68 HydrophobicContact CD2-CG2 4.07Å; L25-T68 HydrophobicContact CG-CG2 4.48Å; A64-T68 PolarHBondContact O-N 3.18Å; A64-T68 PolarHBondContact O-OG1 3.03Å; M65-T68 PolarHBondContact O-N 2.87Å; T68-G70 PolarHBondContact O-N 3.18Å; T68-L71 PolarHBondContact O-N 3.35Å; T68-Y72 HydrophobicContact CG2-CD2 3.95Å; T68-Y72 HydrophobicContact CG2-CE1 4.03Å; T68-Y72 HydrophobicContact CG2-CE2 3.28Å; T68-Y72 WeakPolarHBondContact CG2-OH 3.46Å; T68-Y72 WeakPolarHBondContact O-CD2 3.27Å; T68-Y72 VanDerWaalsContact O-CG 3.26Å; T68-Y72 PolarHBondContact O-N 3.27Å
69A84.9Confident88.4Confident52 Ų5283.3 Ų83.343%0.4350%0.5SS..Hα-helixtrans-60.7-44.8175.800000112.1M65 Y72 S73M65-A69 VanDerWaalsContact O-CB 3.31Å; M65-A69 WeakPolarHBondContact O-CB 3.27Å; M65-A69 PolarHBondContact O-N 2.8Å; A69-Y72 PolarHBondContact O-N 2.81Å; A69-S73 PolarHBondContact O-N 2.95Å; A69-S73 PolarHBondContact O-OG 3.34Å
70G87.3Confident88.4Confident37 Ų3780.6 Ų80.638%0.38149%0.49SS..Hα-helixtrans-60.9-44.1175.300000112.6G66 R67 T68 Y72 S73 T74G66-G70 PolarHBondContact O-N 3.26Å; R67-G70 PolarHBondContact O-N 3.49Å; T68-G70 PolarHBondContact O-N 3.18Å; G70-Y72 VanDerWaalsContact C-N 3.31Å; G70-Y72 PolarHBondContact O-N 3.45Å; G70-S73 WeakPolarHBondContact O-CB 3.48Å; G70-S73 PolarHBondContact O-N 3.39Å; G70-S73 VanDerWaalsContact O-N 3.12Å; G70-T74 PolarHBondContact O-N 3.2Å
71L89.6Confident88.4Confident50 Ų5077.5 Ų77.526%0.26247%0.472SS..Hα-helixtrans-63.8-36.2178-173.663.3000112.3R67 T68 T74 A76 A81R67-L71 WeakPolarHBondContact O-CB 3.27Å; R67-L71 PolarHBondContact O-N 2.83Å; T68-L71 PolarHBondContact O-N 3.35Å; L71-T74 PolarHBondContact O-N 3.38Å; L71-T74 PolarHBondContact O-OG1 3.18Å; L71-A76 HydrophobicContact CD1-CB 3.66Å; L71-A76 HydrophobicContact CG-CB 3.71Å; L71-A76 WeakPolarHBondContact O-CB 3.5Å; L71-A76 PolarHBondContact O-N 3.17Å; L71-A81 HydrophobicContact CD1-CB 4Å
72Y89.2Confident88.5Confident61 Ų6177.8 Ų77.824%0.23947%0.473CS..Hα-helixtrans-67.5-35.9172.6-66.7-22.7000112.8S29 F33 T68 A69 G70 T74 G75S29-Y72 VanDerWaalsContact CB-OH 3.3Å; S29-Y72 WeakPolarHBondContact CB-OH 3.42Å; S29-Y72 WeakPolarHBondContact OG-CE2 3.46Å; S29-Y72 PolarHBondContact OG-OH 3.34Å; S29-Y72 VanDerWaalsContact OG-OH 3.07Å; F33-Y72 AromaticContact CE2-CD1 3.79Å; F33-Y72 HydrophobicContact CE2-CD1 3.79Å; F33-Y72 AromaticContact CE2-CD2 3.65Å; F33-Y72 HydrophobicContact CE2-CD2 3.65Å; F33-Y72 AromaticContact CE2-CE1 3.82Å; F33-Y72 HydrophobicContact CE2-CE1 3.82Å; F33-Y72 AromaticContact CE2-CE2 3.64Å; F33-Y72 HydrophobicContact CE2-CE2 3.64Å; F33-Y72 AromaticContact CE2-CG 3.72Å; F33-Y72 HydrophobicContact CE2-CG 3.72Å; F33-Y72 AromaticContact CE2-CZ 3.75Å; F33-Y72 AromaticContact CZ-CD1 3.83Å; F33-Y72 HydrophobicContact CZ-CD1 3.83Å; F33-Y72 AromaticContact CZ-CD2 3.99Å; F33-Y72 HydrophobicContact CZ-CD2 3.99Å; F33-Y72 HydrophobicContact CZ-CE1 4.31Å; F33-Y72 HydrophobicContact CZ-CE2 4.42Å; F33-Y72 AromaticContact CZ-CG 3.67Å; F33-Y72 HydrophobicContact CZ-CG 3.67Å; T68-Y72 HydrophobicContact CG2-CD2 3.95Å; T68-Y72 HydrophobicContact CG2-CE1 4.03Å; T68-Y72 HydrophobicContact CG2-CE2 3.28Å; T68-Y72 WeakPolarHBondContact CG2-OH 3.46Å; T68-Y72 WeakPolarHBondContact O-CD2 3.27Å; T68-Y72 VanDerWaalsContact O-CG 3.26Å; T68-Y72 PolarHBondContact O-N 3.27Å; A69-Y72 PolarHBondContact O-N 2.81Å; G70-Y72 VanDerWaalsContact C-N 3.31Å; G70-Y72 PolarHBondContact O-N 3.45Å; Y72-T74 PolarHBondContact O-N 2.98Å; Y72-G75 PolarHBondContact O-N 3.41Å
73S88.7Confident88.7Confident106 Ų10680 Ų8074%0.74148%0.477SS*.Hα-helixtrans-66.3-25.1176.3-68.40000113.2A69 G70 G75A69-S73 PolarHBondContact O-N 2.95Å; A69-S73 PolarHBondContact O-OG 3.34Å; G70-S73 WeakPolarHBondContact O-CB 3.48Å; G70-S73 PolarHBondContact O-N 3.39Å; G70-S73 VanDerWaalsContact O-N 3.12Å; S73-G75 PolarHBondContact O-N 3.25Å
74T91.6Very high89Confident108 Ų10882.8 Ų82.866%0.66349%0.487SS*.THydrogen-bonded Turntrans-81.41.217366.70000113.2G70 L71 Y72G70-T74 PolarHBondContact O-N 3.2Å; L71-T74 PolarHBondContact O-N 3.38Å; L71-T74 PolarHBondContact O-OG1 3.18Å; Y72-T74 PolarHBondContact O-N 2.98Å
75G89.4Confident89.2Confident50 Ų5082.4 Ų82.452%0.51548%0.481SS..THydrogen-bonded Turntrans77.917.7179.700000114.7Y72 S73 K77Y72-G75 PolarHBondContact O-N 3.41Å; S73-G75 PolarHBondContact O-N 3.25Å; G75-K77 PolarHBondContact O-N 2.99Å
76A89.9Confident89.7Confident25 Ų2581.6 Ų81.621%0.20749%0.485CS..  trans-65.3132.7176.700000111.1L71 A81L71-A76 HydrophobicContact CD1-CB 3.66Å; L71-A76 HydrophobicContact CG-CB 3.71Å; L71-A76 WeakPolarHBondContact O-CB 3.5Å; L71-A76 PolarHBondContact O-N 3.17Å; A76-A81 HydrophobicContact CB-CB 3.93Å
77K87.2Confident90.3Very high206 Ų20683 Ų8390%0.89648%0.477SS*.  trans-116-16.9-176.7-61.7-176.8-177.9178.60114.1G75G75-K77 PolarHBondContact O-N 2.99Å
78T90.9Very high90.7Very high91 Ų9181.1 Ų81.156%0.55847%0.474SS*.SBendtrans-127.2154.7-173.865.80000111.3V80 A81T78-V80 PolarHBondContact O-N 3.12Å; T78-A81 PolarHBondContact O-N 3.45Å
79Q90.4Very high90.9Very high169 Ų16982.9 Ų82.979%0.7948%0.484SS*.THydrogen-bonded Turntrans-66.1-13.8176.7-66.7179.1-13.400113.1A81 C82 L83Q79-A81 PolarHBondContact O-N 3.05Å; Q79-C82 WeakPolarHBondContact O-CA 3.33Å; Q79-C82 VanDerWaalsContact O-CB 3.3Å; Q79-C82 WeakPolarHBondContact O-CB 3.26Å; Q79-C82 PolarHBondContact O-N 2.9Å; Q79-L83 PolarHBondContact O-N 3.26Å
80V93.3Very high91.3Very high89 Ų8986.3 Ų86.354%0.53950%0.495SS..Hα-helixtrans-57-32.9173.7-178.10000111.2T78 C82 L83 I84T78-V80 PolarHBondContact O-N 3.12Å; V80-C82 VanDerWaalsContact C-N 3.27Å; V80-C82 PolarHBondContact O-N 2.89Å; V80-L83 WeakPolarHBondContact O-CB 3.44Å; V80-L83 PolarHBondContact O-N 3.05Å; V80-L83 VanDerWaalsContact O-N 3.13Å; V80-I84 HydrophobicContact CG1-CD1 4.09Å; V80-I84 HydrophobicContact CG1-CG1 4.41Å; V80-I84 WeakPolarHBondContact O-CG1 3.31Å; V80-I84 PolarHBondContact O-N 3.32Å
81A91.7Very high91.6Very high26 Ų2689 Ų8922%0.21550%0.499CS..Hα-helixtrans-61.9-35.3175.200000112.4L71 A76 T78 Q79 S85L71-A81 HydrophobicContact CD1-CB 4Å; A76-A81 HydrophobicContact CB-CB 3.93Å; T78-A81 PolarHBondContact O-N 3.45Å; Q79-A81 PolarHBondContact O-N 3.05Å; A81-S85 WeakPolarHBondContact O-CB 3.45Å; A81-S85 PolarHBondContact O-N 3.35Å
82C90.9Very high91.8Very high60 Ų6089.7 Ų89.741%0.40551%0.505SS..Hα-helixtrans-68.1-41.4173.5-60.90000111.3Q79 V80 I84 S85 C86Q79-C82 WeakPolarHBondContact O-CA 3.33Å; Q79-C82 VanDerWaalsContact O-CB 3.3Å; Q79-C82 WeakPolarHBondContact O-CB 3.26Å; Q79-C82 PolarHBondContact O-N 2.9Å; V80-C82 VanDerWaalsContact C-N 3.27Å; V80-C82 PolarHBondContact O-N 2.89Å; C82-I84 PolarHBondContact O-N 3.21Å; C82-S85 WeakPolarHBondContact O-CB 3.48Å; C82-S85 PolarHBondContact O-N 3.48Å; C82-S85 VanDerWaalsContact O-N 3.15Å; C82-C86 PolarHBondContact O-N 3.4Å; C82-C86 PolarHBondContact O-SG 2.99Å
83L93.1Very high92Very high107 Ų10792 Ų9256%0.5652%0.521SS*.Hα-helixtrans-61.9-44.2177.7-171.4144.3000111.6Q79 V80 S85 C86 I87Q79-L83 PolarHBondContact O-N 3.26Å; V80-L83 WeakPolarHBondContact O-CB 3.44Å; V80-L83 PolarHBondContact O-N 3.05Å; V80-L83 VanDerWaalsContact O-N 3.13Å; L83-S85 VanDerWaalsContact C-N 3.33Å; L83-S85 PolarHBondContact O-N 3.26Å; L83-C86 PolarHBondContact O-N 3.43Å; L83-I87 HydrophobicContact CD2-CD1 3.84Å; L83-I87 PolarHBondContact O-N 3.35Å; L83-I87 VanDerWaalsContact O-N 3.16Å
84I93.4Very high92.2Very high84 Ų8497 Ų9743%0.43153%0.525SS..Hα-helixtrans-59.9-45.6173.1-66.2167.3000110.1V80 C82 C86 I87 F88V80-I84 HydrophobicContact CG1-CD1 4.09Å; V80-I84 HydrophobicContact CG1-CG1 4.41Å; V80-I84 WeakPolarHBondContact O-CG1 3.31Å; V80-I84 PolarHBondContact O-N 3.32Å; C82-I84 PolarHBondContact O-N 3.21Å; I84-C86 VanDerWaalsContact C-N 3.29Å; I84-C86 PolarHBondContact O-N 3.23Å; I84-I87 PolarHBondContact O-N 3.47Å; I84-F88 HydrophobicContact CG2-CD2 3.76Å; I84-F88 HydrophobicContact CG2-CE2 3.69Å; I84-F88 WeakPolarHBondContact O-CD2 3.28Å; I84-F88 PolarHBondContact O-N 2.89Å
85S91.5Very high92.3Very high43 Ų4394.8 Ų94.830%0.30152%0.518SS..Hα-helixtrans-59.8-37.7177-174.70000112.5A81 C82 L83 F88 V89A81-S85 WeakPolarHBondContact O-CB 3.45Å; A81-S85 PolarHBondContact O-N 3.35Å; C82-S85 WeakPolarHBondContact O-CB 3.48Å; C82-S85 PolarHBondContact O-N 3.48Å; C82-S85 VanDerWaalsContact O-N 3.15Å; L83-S85 VanDerWaalsContact C-N 3.33Å; L83-S85 PolarHBondContact O-N 3.26Å; S85-F88 PolarHBondContact O-N 3.34Å; S85-V89 VanDerWaalsContact O-CG2 3.29Å; S85-V89 WeakPolarHBondContact O-CG2 2.92Å; S85-V89 PolarHBondContact O-N 2.9Å
86C92.4Very high92.5Very high86 Ų8696 Ų9658%0.58151%0.512SS*.Hα-helixtrans-65-41.6177.3-68.10000111.9C82 L83 I84 F88 V89 L90C82-C86 PolarHBondContact O-N 3.4Å; C82-C86 PolarHBondContact O-SG 2.99Å; L83-C86 PolarHBondContact O-N 3.43Å; I84-C86 VanDerWaalsContact C-N 3.29Å; I84-C86 PolarHBondContact O-N 3.23Å; C86-F88 VanDerWaalsContact C-N 3.35Å; C86-F88 PolarHBondContact O-N 3.35Å; C86-V89 PolarHBondContact O-N 3.48Å; C86-L90 PolarHBondContact O-N 3.5Å
87I95.4Very high92.5Very high92 Ų9296.2 Ų96.247%0.47252%0.516SS..Hα-helixtrans-61.6-45175.7-65.5168.5000110.4L83 I84 V89 L90 I91L83-I87 HydrophobicContact CD2-CD1 3.84Å; L83-I87 PolarHBondContact O-N 3.35Å; L83-I87 VanDerWaalsContact O-N 3.16Å; I84-I87 PolarHBondContact O-N 3.47Å; I87-V89 PolarHBondContact O-N 2.93Å; I87-L90 WeakPolarHBondContact O-CB 3.36Å; I87-L90 PolarHBondContact O-N 3.36Å; I87-I91 HydrophobicContact CG2-CD1 4.02Å; I87-I91 WeakPolarHBondContact O-CG1 3.37Å; I87-I91 PolarHBondContact O-N 2.92Å
88F94.3Very high92.7Very high131 Ų13190.8 Ų90.858%0.57550%0.502SS*.Hα-helixtrans-61.7-43176-87.4-73.1000112.6I84 S85 C86 L90 I91 V92I84-F88 HydrophobicContact CG2-CD2 3.76Å; I84-F88 HydrophobicContact CG2-CE2 3.69Å; I84-F88 WeakPolarHBondContact O-CD2 3.28Å; I84-F88 PolarHBondContact O-N 2.89Å; S85-F88 PolarHBondContact O-N 3.34Å; C86-F88 VanDerWaalsContact C-N 3.35Å; C86-F88 PolarHBondContact O-N 3.35Å; F88-L90 VanDerWaalsContact C-N 3.29Å; F88-L90 PolarHBondContact O-N 3.37Å; F88-I91 PolarHBondContact O-N 3.47Å; F88-V92 WeakPolarHBondContact O-CB 3.3Å; F88-V92 VanDerWaalsContact O-CG2 3.28Å; F88-V92 WeakPolarHBondContact O-CG2 3.43Å; F88-V92 PolarHBondContact O-N 2.87Å
89V93Very high92.7Very high68 Ų6892.4 Ų92.441%0.41251%0.506SS..Hα-helixtrans-60.1-41.9176.3168.90000110.7S85 C86 I87 V92 I93S85-V89 VanDerWaalsContact O-CG2 3.29Å; S85-V89 WeakPolarHBondContact O-CG2 2.92Å; S85-V89 PolarHBondContact O-N 2.9Å; C86-V89 PolarHBondContact O-N 3.48Å; I87-V89 PolarHBondContact O-N 2.93Å; V89-V92 PolarHBondContact O-N 3.35Å; V89-I93 HydrophobicContact CG1-CD1 3.69Å; V89-I93 HydrophobicContact CG1-CG1 4.35Å; V89-I93 VanDerWaalsContact O-CG1 3.26Å; V89-I93 WeakPolarHBondContact O-CG1 3.37Å; V89-I93 PolarHBondContact O-N 3.26Å
90L93.7Very high92.6Very high123 Ų12388.7 Ų88.764%0.64449%0.491SS*.Hα-helixtrans-61.2-45.5176.5-174.865.9000112.1C86 I87 F88 I93 Y94C86-L90 PolarHBondContact O-N 3.5Å; I87-L90 WeakPolarHBondContact O-CB 3.36Å; I87-L90 PolarHBondContact O-N 3.36Å; F88-L90 VanDerWaalsContact C-N 3.29Å; F88-L90 PolarHBondContact O-N 3.37Å; L90-I93 PolarHBondContact O-N 2.95Å; L90-Y94 PolarHBondContact O-N 2.82Å
91I95.1Very high92.4Very high94 Ų9493.3 Ų93.348%0.48250%0.501SS..Hα-helixtrans-61.5-45.2176.6-66.6167.2000110.7I87 F88 Y94 A95I87-I91 HydrophobicContact CG2-CD1 4.02Å; I87-I91 WeakPolarHBondContact O-CG1 3.37Å; I87-I91 PolarHBondContact O-N 2.92Å; F88-I91 PolarHBondContact O-N 3.47Å; I91-Y94 PolarHBondContact O-N 3.35Å; I91-A95 VanDerWaalsContact O-CB 3.29Å; I91-A95 WeakPolarHBondContact O-CB 3.3Å; I91-A95 PolarHBondContact O-N 3.42Å
92V93.8Very high92.4Very high64 Ų64102.3 Ų102.339%0.38853%0.529SS..Hα-helixtrans-62.6-43.8179.2168.10000111F88 V89 Y94 I96 G97F88-V92 WeakPolarHBondContact O-CB 3.3Å; F88-V92 VanDerWaalsContact O-CG2 3.28Å; F88-V92 WeakPolarHBondContact O-CG2 3.43Å; F88-V92 PolarHBondContact O-N 2.87Å; V89-V92 PolarHBondContact O-N 3.35Å; V92-Y94 VanDerWaalsContact C-N 3.35Å; V92-Y94 PolarHBondContact O-N 3.25Å; V92-I96 HydrophobicContact CG1-CB 4.26Å; V92-I96 HydrophobicContact CG1-CD1 4.26Å; V92-I96 HydrophobicContact CG2-CD1 4.29Å; V92-I96 CarbonylContact O-C 3.57Å; V92-I96 VanDerWaalsContact O-CA 3.32Å; V92-I96 WeakPolarHBondContact O-CA 3.47Å; V92-I96 VanDerWaalsContact O-CB 3.28Å; V92-I96 WeakPolarHBondContact O-CB 3.46Å; V92-I96 PolarHBondContact O-N 2.87Å; V92-G97 PolarHBondContact O-N 3.36Å; V92-G97 VanDerWaalsContact O-N 3.17Å
93I92.1Very high92.4Very high110 Ų110103.1 Ų103.156%0.56453%0.529SS*.Hα-helixtrans-62-44.8177.7-69.5167000110.5V89 L90 G97V89-I93 HydrophobicContact CG1-CD1 3.69Å; V89-I93 HydrophobicContact CG1-CG1 4.35Å; V89-I93 VanDerWaalsContact O-CG1 3.26Å; V89-I93 WeakPolarHBondContact O-CG1 3.37Å; V89-I93 PolarHBondContact O-N 3.26Å; L90-I93 PolarHBondContact O-N 2.95Å; I93-G97 VanDerWaalsContact O-CA 3.23Å; I93-G97 WeakPolarHBondContact O-CA 3.09Å; I93-G97 PolarHBondContact O-N 3.15Å; I93-G97 VanDerWaalsContact O-N 3.14Å
94Y93.7Very high92.5Very high211 Ų211101.5 Ų101.583%0.82753%0.525SS*.Hα-helixtrans-71.4-44-178-173.8-100.2000113.2L90 I91 V92L90-Y94 PolarHBondContact O-N 2.82Å; I91-Y94 PolarHBondContact O-N 3.35Å; V92-Y94 VanDerWaalsContact C-N 3.35Å; V92-Y94 PolarHBondContact O-N 3.25Å
95A93.8Very high92.5Very high62 Ų62105 Ų10551%0.51254%0.541SS..Hα-helixtrans-87.2-42.2-174.500000113.5I91I91-A95 VanDerWaalsContact O-CB 3.29Å; I91-A95 WeakPolarHBondContact O-CB 3.3Å; I91-A95 PolarHBondContact O-N 3.42Å
96I92.4Very high92.6Very high76 Ų76107.8 Ų107.839%0.3956%0.56SS.*Hα-helixtrans-101.1-17.1-172.8-53.2178000111.4V92 P98 L99 L100V92-I96 HydrophobicContact CG1-CB 4.26Å; V92-I96 HydrophobicContact CG1-CD1 4.26Å; V92-I96 HydrophobicContact CG2-CD1 4.29Å; V92-I96 CarbonylContact O-C 3.57Å; V92-I96 VanDerWaalsContact O-CA 3.32Å; V92-I96 WeakPolarHBondContact O-CA 3.47Å; V92-I96 VanDerWaalsContact O-CB 3.28Å; V92-I96 WeakPolarHBondContact O-CB 3.46Å; V92-I96 PolarHBondContact O-N 2.87Å; I96-P98 VanDerWaalsContact C-CD 3.47Å; I96-P98 VanDerWaalsContact C-N 3.33Å; I96-P98 VanDerWaalsContact O-N 3.16Å; I96-L99 HydrophobicContact CG2-CB 4.29Å; I96-L99 WeakPolarHBondContact O-CB 3.21Å; I96-L99 PolarHBondContact O-N 2.99Å; I96-L100 HydrophobicContact CG2-CG 4.45Å; I96-L100 PolarHBondContact O-N 3.47Å
97G90.4Very high92.7Very high28 Ų28106.7 Ų106.729%0.28955%0.55SS..G310 helixtrans-44.8-47.5178.700000114.8V92 I93 L99 L100V92-G97 PolarHBondContact O-N 3.36Å; V92-G97 VanDerWaalsContact O-N 3.17Å; I93-G97 VanDerWaalsContact O-CA 3.23Å; I93-G97 WeakPolarHBondContact O-CA 3.09Å; I93-G97 PolarHBondContact O-N 3.15Å; I93-G97 VanDerWaalsContact O-N 3.14Å; G97-L99 VanDerWaalsContact C-N 3.29Å; G97-L99 PolarHBondContact O-N 2.87Å; G97-L100 WeakPolarHBondContact O-CB 2.92Å; G97-L100 PolarHBondContact O-N 3.34Å; G97-L100 VanDerWaalsContact O-N 3.1Å
98P91Very high92.5Very high92 Ų92105.7 Ų105.760%0.59755%0.545SS*.G310 helixtrans-61.9-31.7177.7-2535.3000114.3I96 L100 Y101I96-P98 VanDerWaalsContact C-CD 3.47Å; I96-P98 VanDerWaalsContact C-N 3.33Å; I96-P98 VanDerWaalsContact O-N 3.16Å; P98-L100 VanDerWaalsContact C-N 3.27Å; P98-L100 PolarHBondContact O-N 3.02Å; P98-Y101 WeakPolarHBondContact O-CB 3.36Å; P98-Y101 PolarHBondContact O-N 3.11Å
99L91Very high92.5Very high126 Ų126101.9 Ų101.966%0.6654%0.538SS*.G310 helixtrans-70.2-27.1177.5-83.968.5000111.7I96 G97 Y101I96-L99 HydrophobicContact CG2-CB 4.29Å; I96-L99 WeakPolarHBondContact O-CB 3.21Å; I96-L99 PolarHBondContact O-N 2.99Å; G97-L99 VanDerWaalsContact C-N 3.29Å; G97-L99 PolarHBondContact O-N 2.87Å; L99-Y101 PolarHBondContact O-N 2.91Å
100L88.8Confident92.5Very high91 Ų91101.5 Ų101.548%0.47654%0.539SS..G310 helixtrans-74.1-7.9179.4-59.5178.1000113.2I96 G97 P98 W102 L103I96-L100 HydrophobicContact CG2-CG 4.45Å; I96-L100 PolarHBondContact O-N 3.47Å; G97-L100 WeakPolarHBondContact O-CB 2.92Å; G97-L100 PolarHBondContact O-N 3.34Å; G97-L100 VanDerWaalsContact O-N 3.1Å; P98-L100 VanDerWaalsContact C-N 3.27Å; P98-L100 PolarHBondContact O-N 3.02Å; L100-W102 PolarHBondContact O-N 3.47Å; L100-L103 HydrophobicContact CD2-CD2 4.34Å; L100-L103 WeakPolarHBondContact O-CB 3.41Å; L100-L103 PolarHBondContact O-N 3.34Å
101Y89.1Confident92.4Very high186 Ų186101 Ų10173%0.72954%0.535SS*.G310 helixtrans-57.1-36.5178.4-178.8-97.4000112.9P98 L99 L103P98-Y101 WeakPolarHBondContact O-CB 3.36Å; P98-Y101 PolarHBondContact O-N 3.11Å; L99-Y101 PolarHBondContact O-N 2.91Å; Y101-L103 VanDerWaalsContact C-N 3.29Å; Y101-L103 PolarHBondContact O-N 3.18Å
102W91.4Very high92.1Very high215 Ų215101.4 Ų101.481%0.81454%0.537SS*.G310 helixtrans-875.2-179-59.999.9000113.7L100 P104L100-W102 PolarHBondContact O-N 3.47Å; W102-P104 VanDerWaalsContact O-CD 3.27Å; W102-P104 WeakPolarHBondContact O-CD 3.44Å
103L91.3Very high91.9Very high77 Ų77102.9 Ų102.940%0.40355%0.546SS..  trans-70.9119.5-174.5-170.664.8000110.6L100 Y101 V107 L108L100-L103 HydrophobicContact CD2-CD2 4.34Å; L100-L103 WeakPolarHBondContact O-CB 3.41Å; L100-L103 PolarHBondContact O-N 3.34Å; Y101-L103 VanDerWaalsContact C-N 3.29Å; Y101-L103 PolarHBondContact O-N 3.18Å; L103-V107 HydrophobicContact CD1-CG1 4.44Å; L103-L108 HydrophobicContact CB-CD1 4.43Å; L103-L108 HydrophobicContact CD2-CD1 3.52Å; L103-L108 HydrophobicContact CD2-CG 4.35Å; L103-L108 HydrophobicContact CG-CD1 3.64Å
104P94.3Very high91.8Very high73 Ų73102.8 Ų102.847%0.47455%0.55SS.*  trans-67.8138.4-177.5-20.733.2000112.5W102 C106 V107 L108W102-P104 VanDerWaalsContact O-CD 3.27Å; W102-P104 WeakPolarHBondContact O-CD 3.44Å; P104-C106 PolarHBondContact O-N 3.44Å; P104-C106 VanDerWaalsContact O-N 3.12Å; P104-V107 HydrophobicContact CB-CG2 4.36Å; P104-V107 HydrophobicContact CG-CG2 4.46Å; P104-V107 WeakPolarHBondContact O-CB 3.42Å; P104-V107 PolarHBondContact O-N 3.26Å; P104-L108 WeakPolarHBondContact O-CD1 3.44Å
105M93.6Very high91.3Very high156 Ų15695.7 Ų95.777%0.76854%0.541SS*.Hα-helixtrans-55.6-31.2177-72.2-63.8-158.500113.4V107 L108 A109M105-V107 PolarHBondContact O-N 2.83Å; M105-L108 PolarHBondContact O-N 3.34Å; M105-A109 PolarHBondContact O-N 3.21Å
106C95Very high90.9Very high103 Ų10396.6 Ų96.670%0.69654%0.537SS*.Hα-helixtrans-60.3-35.1177.2-57.20000112.5P104 S110P104-C106 PolarHBondContact O-N 3.44Å; P104-C106 VanDerWaalsContact O-N 3.12Å; C106-S110 PolarHBondContact O-N 3.16Å
107V94.4Very high90.5Very high62 Ų6299.6 Ų99.638%0.37655%0.548SS..Hα-helixtrans-69.4-44.8178.2-178.50000109.5L103 P104 M105 A109 S110 I111L103-V107 HydrophobicContact CD1-CG1 4.44Å; P104-V107 HydrophobicContact CB-CG2 4.36Å; P104-V107 HydrophobicContact CG-CG2 4.46Å; P104-V107 WeakPolarHBondContact O-CB 3.42Å; P104-V107 PolarHBondContact O-N 3.26Å; M105-V107 PolarHBondContact O-N 2.83Å; V107-A109 VanDerWaalsContact C-N 3.34Å; V107-A109 PolarHBondContact O-N 2.8Å; V107-S110 PolarHBondContact O-N 2.96Å; V107-S110 PolarHBondContact O-OG 3.49Å; V107-I111 HydrophobicContact CG1-CD1 4.23Å; V107-I111 WeakPolarHBondContact O-CG1 3.21Å; V107-I111 PolarHBondContact O-N 3.33Å; V107-I111 VanDerWaalsContact O-N 3.1Å
108L91.3Very high90Very high72 Ų72100.7 Ų100.738%0.37756%0.559SS.*Hα-helixtrans-61-43.8176.2-73.579.5000111.3L103 P104 M105 S110 I111 I112L103-L108 HydrophobicContact CB-CD1 4.43Å; L103-L108 HydrophobicContact CD2-CD1 3.52Å; L103-L108 HydrophobicContact CD2-CG 4.35Å; L103-L108 HydrophobicContact CG-CD1 3.64Å; P104-L108 WeakPolarHBondContact O-CD1 3.44Å; M105-L108 PolarHBondContact O-N 3.34Å; L108-S110 PolarHBondContact O-N 3.21Å; L108-I111 PolarHBondContact O-N 2.86Å; L108-I112 WeakPolarHBondContact O-CG1 3.34Å; L108-I112 PolarHBondContact O-N 2.75Å; L108-I112 VanDerWaalsContact O-N 3.08Å
109A93.3Very high89.6Confident51 Ų51101.3 Ų101.342%0.42156%0.555SS.*Hα-helixtrans-59.7-43.5176.400000112.1M105 V107 I111 I112 V113M105-A109 PolarHBondContact O-N 3.21Å; V107-A109 VanDerWaalsContact C-N 3.34Å; V107-A109 PolarHBondContact O-N 2.8Å; A109-I111 VanDerWaalsContact C-N 3.32Å; A109-I111 PolarHBondContact O-N 2.88Å; A109-I112 PolarHBondContact O-N 2.83Å; A109-V113 WeakPolarHBondContact O-CG2 3.21Å; A109-V113 PolarHBondContact O-N 2.82Å
110S93.9Very high89.2Confident60 Ų60100.2 Ų100.242%0.4255%0.549SS..Hα-helixtrans-62.4-37.6176.870.60000113C106 V107 L108 I112 V113 V114C106-S110 PolarHBondContact O-N 3.16Å; V107-S110 PolarHBondContact O-N 2.96Å; V107-S110 PolarHBondContact O-OG 3.49Å; L108-S110 PolarHBondContact O-N 3.21Å; S110-I112 VanDerWaalsContact C-N 3.33Å; S110-I112 PolarHBondContact O-N 2.99Å; S110-V113 PolarHBondContact O-N 3.15Å; S110-V114 VanDerWaalsContact O-CG2 3.32Å; S110-V114 WeakPolarHBondContact O-CG2 3.42Å; S110-V114 PolarHBondContact O-N 3.3Å
111I90.6Very high89.1Confident111 Ų111100.1 Ų100.157%0.56955%0.549SS*.Hα-helixtrans-64.2-41.6176.6-68.2165.1000110.1V107 L108 A109 V114 G115V107-I111 HydrophobicContact CG1-CD1 4.23Å; V107-I111 WeakPolarHBondContact O-CG1 3.21Å; V107-I111 PolarHBondContact O-N 3.33Å; V107-I111 VanDerWaalsContact O-N 3.1Å; L108-I111 PolarHBondContact O-N 2.86Å; A109-I111 VanDerWaalsContact C-N 3.32Å; A109-I111 PolarHBondContact O-N 2.88Å; I111-V114 PolarHBondContact O-N 3.14Å; I111-G115 PolarHBondContact O-N 2.83Å
112I89.2Confident88.8Confident103 Ų10396.5 Ų96.553%0.52854%0.538SS..Hα-helixtrans-63-48.5176.5-65.1166.9000110.6L108 A109 S110 V114 G115 L116L108-I112 WeakPolarHBondContact O-CG1 3.34Å; L108-I112 PolarHBondContact O-N 2.75Å; L108-I112 VanDerWaalsContact O-N 3.08Å; A109-I112 PolarHBondContact O-N 2.83Å; S110-I112 VanDerWaalsContact C-N 3.33Å; S110-I112 PolarHBondContact O-N 2.99Å; I112-V114 VanDerWaalsContact C-N 3.34Å; I112-V114 PolarHBondContact O-N 3.32Å; I112-G115 PolarHBondContact O-N 3.28Å; I112-G115 VanDerWaalsContact O-N 3.14Å; I112-L116 HydrophobicContact CG2-CD1 3.81Å; I112-L116 HydrophobicContact CG2-CG 4.31Å; I112-L116 WeakPolarHBondContact O-CG 3.13Å; I112-L116 PolarHBondContact O-N 3.31Å
113V90.4Very high88.5Confident95 Ų9590.1 Ų90.158%0.57652%0.516SS*.Hα-helixtrans-59.3-45.1179.5172.20000111.4A109 S110 G115 L116 K117A109-V113 WeakPolarHBondContact O-CG2 3.21Å; A109-V113 PolarHBondContact O-N 2.82Å; S110-V113 PolarHBondContact O-N 3.15Å; V113-G115 VanDerWaalsContact C-N 3.35Å; V113-L116 PolarHBondContact O-N 3.12Å; V113-K117 PolarHBondContact O-N 3.42Å
114V88.6Confident88.3Confident108 Ų10895.9 Ų95.966%0.65553%0.533SS*.Hα-helixtrans-64.9-40.2177173.30000111.1S110 I111 I112 L116 K117S110-V114 VanDerWaalsContact O-CG2 3.32Å; S110-V114 WeakPolarHBondContact O-CG2 3.42Å; S110-V114 PolarHBondContact O-N 3.3Å; I111-V114 PolarHBondContact O-N 3.14Å; I112-V114 VanDerWaalsContact C-N 3.34Å; I112-V114 PolarHBondContact O-N 3.32Å; V114-L116 VanDerWaalsContact C-N 3.31Å; V114-L116 PolarHBondContact O-N 3.1Å; V114-K117 VanDerWaalsContact O-CB 3.27Å; V114-K117 WeakPolarHBondContact O-CB 3.23Å; V114-K117 PolarHBondContact O-N 3.32Å
115G84.3Confident87.8Confident62 Ų6296.1 Ų96.164%0.63953%0.53SS*.Hα-helixtrans-62.4-35.2176.100000113.4I111 I112 V113I111-G115 PolarHBondContact O-N 2.83Å; I112-G115 PolarHBondContact O-N 3.28Å; I112-G115 VanDerWaalsContact O-N 3.14Å; V113-G115 VanDerWaalsContact C-N 3.35Å
116L84.8Confident87.6Confident82 Ų8290.4 Ų90.443%0.42950%0.502SS..Hα-helixtrans-82.8-10.8180-66.9175.8000114I112 V113 V114 G118 M119 L120I112-L116 HydrophobicContact CG2-CD1 3.81Å; I112-L116 HydrophobicContact CG2-CG 4.31Å; I112-L116 WeakPolarHBondContact O-CG 3.13Å; I112-L116 PolarHBondContact O-N 3.31Å; V113-L116 PolarHBondContact O-N 3.12Å; V114-L116 VanDerWaalsContact C-N 3.31Å; V114-L116 PolarHBondContact O-N 3.1Å; L116-G118 PolarHBondContact O-N 3.07Å; L116-G118 VanDerWaalsContact O-N 3.11Å; L116-M119 HydrophobicContact CD2-SD 4.31Å; L116-M119 PolarHBondContact O-N 3.18Å; L116-L120 PolarHBondContact O-N 3.34Å
117K84.8Confident87.3Confident138 Ų13893.2 Ų93.260%0.650%0.503SS*.Hα-helixtrans-50-41.4-179.1-177.4-179.1177.3-1790112.9V113 V114 L120 I121V113-K117 PolarHBondContact O-N 3.42Å; V114-K117 VanDerWaalsContact O-CB 3.27Å; V114-K117 WeakPolarHBondContact O-CB 3.23Å; V114-K117 PolarHBondContact O-N 3.32Å; K117-L120 PolarHBondContact O-N 3.19Å; K117-I121 HydrophobicContact CG-CD1 4.2Å; K117-I121 WeakPolarHBondContact O-CD1 3.42Å; K117-I121 VanDerWaalsContact O-CG1 3.31Å; K117-I121 WeakPolarHBondContact O-CG1 3.44Å; K117-I121 PolarHBondContact O-N 3.27Å
118G79.7Confident87.1Confident51 Ų5197.2 Ų97.253%0.52652%0.515SS..Hα-helixtrans-62.6-41.3179.200000113.3L116L116-G118 PolarHBondContact O-N 3.07Å; L116-G118 VanDerWaalsContact O-N 3.11Å
119M81.4Confident87Confident106 Ų10698.5 Ų98.552%0.52252%0.516SS..Hα-helixtrans-70.1-39.7176.1-75.2178.672.200111.5L116 I121 Q122L116-M119 HydrophobicContact CD2-SD 4.31Å; L116-M119 PolarHBondContact O-N 3.18Å; M119-I121 PolarHBondContact O-N 3.01Å; M119-Q122 VanDerWaalsContact O-CB 3.23Å; M119-Q122 WeakPolarHBondContact O-CB 3.5Å; M119-Q122 WeakPolarHBondContact O-CG 3.5Å; M119-Q122 PolarHBondContact O-N 2.94Å
120L83.9Confident86.9Confident102 Ų102101.8 Ų101.853%0.53452%0.517SS..Hα-helixtrans-64.6-26.3179.6-65.6176.2000113.2L116 K117 Q122 F123L116-L120 PolarHBondContact O-N 3.34Å; K117-L120 PolarHBondContact O-N 3.19Å; L120-Q122 PolarHBondContact O-N 3.46Å; L120-F123 HydrophobicContact CD2-CE2 4.31Å; L120-F123 WeakPolarHBondContact O-CD2 3.34Å; L120-F123 PolarHBondContact O-N 2.83Å
121I85Confident86.8Confident90 Ų90104.9 Ų104.946%0.46253%0.529SS..G310 helixtrans-67-22.7176-70.3161.7000112K117 M119 F123 R124K117-I121 HydrophobicContact CG-CD1 4.2Å; K117-I121 WeakPolarHBondContact O-CD1 3.42Å; K117-I121 VanDerWaalsContact O-CG1 3.31Å; K117-I121 WeakPolarHBondContact O-CG1 3.44Å; K117-I121 PolarHBondContact O-N 3.27Å; M119-I121 PolarHBondContact O-N 3.01Å; I121-F123 PolarHBondContact O-N 3Å; I121-F123 VanDerWaalsContact O-N 3.17Å; I121-R124 WeakPolarHBondContact O-CB 3.41Å; I121-R124 PolarHBondContact O-N 3.01Å
122Q83.4Confident86.9Confident110 Ų110105.2 Ų105.251%0.51454%0.536SS..G310 helixtrans-63.6-20179.3-62177-18.400113M119 L120 R124 D125M119-Q122 VanDerWaalsContact O-CB 3.23Å; M119-Q122 WeakPolarHBondContact O-CB 3.5Å; M119-Q122 WeakPolarHBondContact O-CG 3.5Å; M119-Q122 PolarHBondContact O-N 2.94Å; L120-Q122 PolarHBondContact O-N 3.46Å; Q122-R124 PolarHBondContact O-N 2.94Å; Q122-R124 VanDerWaalsContact O-N 3.09Å; Q122-D125 WeakPolarHBondContact O-CB 3.44Å; Q122-D125 PolarHBondContact O-N 3.24Å
123F85.7Confident86.9Confident81 Ų81101.9 Ų101.936%0.35552%0.519SS..G310 helixtrans-56.2-26.4171.3-83.8-98000112.9L120 I121 D125 L126 W140 Y144L120-F123 HydrophobicContact CD2-CE2 4.31Å; L120-F123 WeakPolarHBondContact O-CD2 3.34Å; L120-F123 PolarHBondContact O-N 2.83Å; I121-F123 PolarHBondContact O-N 3Å; I121-F123 VanDerWaalsContact O-N 3.17Å; F123-D125 PolarHBondContact O-N 3.49Å; F123-L126 WeakPolarHBondContact O-CB 3.43Å; F123-L126 PolarHBondContact O-N 3Å; F123-W140 AromaticContact CD1-CH2 3.54Å; F123-W140 HydrophobicContact CD1-CH2 3.54Å; F123-W140 HydrophobicContact CD1-CZ2 4.32Å; F123-W140 HydrophobicContact CD1-CZ3 4.47Å; F123-W140 AromaticContact CE1-CH2 3.55Å; F123-W140 HydrophobicContact CE1-CH2 3.55Å; F123-W140 HydrophobicContact CE1-CZ2 4.39Å; F123-W140 HydrophobicContact CE1-CZ3 4.41Å; F123-W140 HydrophobicContact CG-CH2 4.2Å; F123-W140 HydrophobicContact CZ-CH2 4.21Å; F123-Y144 HydrophobicContact CE1-CD2 4.36Å; F123-Y144 HydrophobicContact CE1-CE1 4.15Å; F123-Y144 AromaticContact CE1-CE2 3.81Å; F123-Y144 HydrophobicContact CE1-CE2 3.81Å; F123-Y144 AromaticContact CE1-CZ 3.64Å; F123-Y144 HydrophobicContact CZ-CD2 4.07Å; F123-Y144 AromaticContact CZ-CE2 3.38Å; F123-Y144 HydrophobicContact CZ-CE2 3.38Å; F123-Y144 AromaticContact CZ-CZ 3.61Å
124R86.4Confident86.9Confident198 Ų198104 Ų10475%0.74752%0.521SS*.G310 helixtrans-68.6-23.7177.9-166.216861.91451.9112.7I121 Q122 L126I121-R124 WeakPolarHBondContact O-CB 3.41Å; I121-R124 PolarHBondContact O-N 3.01Å; Q122-R124 PolarHBondContact O-N 2.94Å; Q122-R124 VanDerWaalsContact O-N 3.09Å; R124-L126 PolarHBondContact O-N 3.38Å
125D84.9Confident87Confident77 Ų77102.5 Ų102.541%0.41251%0.508SS..G310 helixtrans-71.2-13.2177-62.5-34.6000112.1Q122 F123 K127 K128 Y129Q122-D125 WeakPolarHBondContact O-CB 3.44Å; Q122-D125 PolarHBondContact O-N 3.24Å; F123-D125 PolarHBondContact O-N 3.49Å; D125-K127 PolarHBondContact O-N 2.96Å; D125-K128 WeakPolarHBondContact O-CA 3.48Å; D125-K128 VanDerWaalsContact O-CB 3.24Å; D125-K128 WeakPolarHBondContact O-CB 3.37Å; D125-K128 PolarHBondContact O-N 2.94Å; D125-Y129 HydrophobicContact CB-CE2 4.21Å; D125-Y129 WeakPolarHBondContact O-CD2 3.25Å; D125-Y129 PolarHBondContact O-N 2.91Å; D125-Y129 VanDerWaalsContact O-N 3.15Å
126L87.8Confident87.3Confident37 Ų37103.2 Ų103.219%0.19450%0.498CS..Hα-helixtrans-57.6-36.7177.6-167.660.3000113F123 R124 K128 Y129 W130 W137 W140 V141F123-L126 WeakPolarHBondContact O-CB 3.43Å; F123-L126 PolarHBondContact O-N 3Å; R124-L126 PolarHBondContact O-N 3.38Å; L126-K128 VanDerWaalsContact C-N 3.26Å; L126-K128 PolarHBondContact O-N 3.38Å; L126-Y129 PolarHBondContact O-N 3.27Å; L126-W130 PolarHBondContact O-N 3.17Å; L126-W137 HydrophobicContact CD1-CG 4.23Å; L126-W137 VanDerWaalsContact CG-NE1 3.33Å; L126-W137 VanDerWaalsContact O-CD1 3.25Å; L126-W140 HydrophobicContact CD1-CD2 3.76Å; L126-W140 HydrophobicContact CD1-CE3 3.28Å; L126-W140 HydrophobicContact CD1-CG 4.31Å; L126-W140 HydrophobicContact CD1-CH2 4.5Å; L126-W140 HydrophobicContact CD1-CZ3 3.72Å; L126-W140 HydrophobicContact CD2-CE3 4.13Å; L126-W140 HydrophobicContact CD2-CH2 4.4Å; L126-W140 HydrophobicContact CD2-CZ3 3.71Å; L126-W140 HydrophobicContact CG-CE3 4.27Å; L126-W140 HydrophobicContact CG-CZ3 4.24Å; L126-V141 HydrophobicContact CD1-CG2 3.98Å; L126-V141 HydrophobicContact CD2-CG2 4.22Å
127K89.2Confident87.7Confident162 Ų162102.8 Ų102.870%0.70449%0.49SS*.Hα-helixtrans-64.4-33.7175.4-172.3176.3-178.4178.30112D125 N131D125-K127 PolarHBondContact O-N 2.96Å; K127-N131 PolarHBondContact O-N 2.99Å
128K90.6Very high88.1Confident146 Ų14697.6 Ų97.664%0.63548%0.475SS*.Hα-helixtrans-68.7-44.3177.8-174.1-177.7176.3-175.90110.5D125 L126 W130 N131 V132D125-K128 WeakPolarHBondContact O-CA 3.48Å; D125-K128 VanDerWaalsContact O-CB 3.24Å; D125-K128 WeakPolarHBondContact O-CB 3.37Å; D125-K128 PolarHBondContact O-N 2.94Å; L126-K128 VanDerWaalsContact C-N 3.26Å; L126-K128 PolarHBondContact O-N 3.38Å; K128-W130 VanDerWaalsContact C-N 3.34Å; K128-W130 PolarHBondContact O-N 2.68Å; K128-N131 PolarHBondContact O-N 3.38Å; K128-V132 WeakPolarHBondContact O-CG2 3.32Å; K128-V132 PolarHBondContact O-N 3.35Å
129Y88.3Confident88.7Confident99 Ų9996.1 Ų96.139%0.38846%0.455SS..Hα-helixtrans-58.8-44.7177.6-68.9-60.7000112.1D125 L126 N131 V132 D133D125-Y129 HydrophobicContact CB-CE2 4.21Å; D125-Y129 WeakPolarHBondContact O-CD2 3.25Å; D125-Y129 PolarHBondContact O-N 2.91Å; D125-Y129 VanDerWaalsContact O-N 3.15Å; L126-Y129 PolarHBondContact O-N 3.27Å; Y129-N131 PolarHBondContact O-N 2.93Å; Y129-V132 PolarHBondContact O-N 3.49Å; Y129-V132 VanDerWaalsContact O-N 3.07Å; Y129-D133 CarbonylContact O-C 3.6Å; Y129-D133 PolarHBondContact O-N 3.31Å
130W92.1Very high89.3Confident119 Ų11994.6 Ų94.645%0.45144%0.444SS..Hα-helixtrans-56.8-37.3178.9-177.1-98.1000113.6L126 K128 W137L126-W130 PolarHBondContact O-N 3.17Å; K128-W130 VanDerWaalsContact C-N 3.34Å; K128-W130 PolarHBondContact O-N 2.68Å; W130-W137 HydrophobicContact CB-CG 4.28Å; W130-W137 HydrophobicContact CE3-CB 4.43Å; W130-W137 AromaticContact CE3-CD2 3.45Å; W130-W137 HydrophobicContact CE3-CD2 3.45Å; W130-W137 VanDerWaalsContact CE3-CD2 3.45Å; W130-W137 AromaticContact CE3-CE2 3.66Å; W130-W137 AromaticContact CE3-CE3 3.73Å; W130-W137 HydrophobicContact CE3-CE3 3.73Å; W130-W137 AromaticContact CE3-CG 3.76Å; W130-W137 HydrophobicContact CE3-CG 3.76Å; W130-W137 HydrophobicContact CE3-CH2 4.4Å; W130-W137 HydrophobicContact CE3-CZ2 4.14Å; W130-W137 HydrophobicContact CE3-CZ3 4.21Å; W130-W137 AromaticContact CE3-NE1 4Å; W130-W137 AromaticContact CZ3-CD2 3.87Å; W130-W137 HydrophobicContact CZ3-CD2 3.87Å; W130-W137 AromaticContact CZ3-CE3 3.64Å; W130-W137 HydrophobicContact CZ3-CE3 3.64Å; W130-W137 HydrophobicContact CZ3-CH2 4.1Å; W130-W137 HydrophobicContact CZ3-CZ2 4.29Å; W130-W137 AromaticContact CZ3-CZ3 3.77Å; W130-W137 HydrophobicContact CZ3-CZ3 3.77Å
131N92.4Very high89.7Confident125 Ų12591.6 Ų91.667%0.66843%0.43SS*.Hα-helixtrans-80.4-20-179-73.63.7000113.4K127 K128 Y129K127-N131 PolarHBondContact O-N 2.99Å; K128-N131 PolarHBondContact O-N 3.38Å; Y129-N131 PolarHBondContact O-N 2.93Å
132V91.3Very high90.2Very high118 Ų11889 Ų8972%0.71542%0.419SS*.Hα-helixtrans-99.2-58.8-176.7177.10000111.1K128 Y129K128-V132 WeakPolarHBondContact O-CG2 3.32Å; K128-V132 PolarHBondContact O-N 3.35Å; Y129-V132 PolarHBondContact O-N 3.49Å; Y129-V132 VanDerWaalsContact O-N 3.07Å
133D89.4Confident90.7Very high34 Ų3485.2 Ų85.218%0.18240%0.404CS..  trans-143.1115.5177.9-164.3-22.1000110.6Y129 I135 D136 W137 R170Y129-D133 CarbonylContact O-C 3.6Å; Y129-D133 PolarHBondContact O-N 3.31Å; D133-I135 PolarHBondContact O-N 3.13Å; D133-I135 WeakPolarHBondContact OD1-CB 3.49Å; D133-I135 PolarHBondContact OD1-N 2.97Å; D133-D136 HydrophobicContact CB-CB 4.22Å; D133-D136 PolarHBondContact O-N 2.88Å; D133-W137 PolarHBondContact O-N 2.93Å; D133-W137 VanDerWaalsContact O-N 3.15Å; D133-R170 IonicContact OD1-NH1 3.55Å; D133-R170 IonicContact OD2-CZ 2.62Å; D133-R170 IonicContact OD2-NH1 3.48Å; D133-R170 PolarHBondContact OD2-NH1 2.91Å; D133-R170 IonicContact OD2-NH2 2.66Å; D133-R170 PolarHBondContact OD2-NH2 3.42Å
134K91.3Very high91Very high140 Ų14085.9 Ų85.961%0.60941%0.405SS*.Hα-helixtrans-64.1-27.1178.4-61.6-177.8-176.8-178.90112.2G138K134-G138 PolarHBondContact O-N 3.05Å
135I90.1Very high91.4Very high76 Ų7679.8 Ų79.839%0.3939%0.389SS..Hα-helixtrans-71.9-48.1179.7-57.6-61.4000110.1D133 W137 G138 I139 I166D133-I135 PolarHBondContact O-N 3.13Å; D133-I135 WeakPolarHBondContact OD1-CB 3.49Å; D133-I135 PolarHBondContact OD1-N 2.97Å; I135-W137 VanDerWaalsContact C-N 3.28Å; I135-W137 PolarHBondContact O-N 2.9Å; I135-G138 WeakPolarHBondContact O-CA 3.43Å; I135-G138 PolarHBondContact O-N 2.71Å; I135-I139 HydrophobicContact CG2-CD1 4.41Å; I135-I139 WeakPolarHBondContact O-CG1 3.41Å; I135-I139 PolarHBondContact O-N 2.7Å; I135-I166 HydrophobicContact CG2-CD1 3.74Å; I135-I166 HydrophobicContact CG2-CG1 4.27Å; I135-I166 HydrophobicContact CG2-CG2 3.6Å
136D90.7Very high91.9Very high77 Ų7779.3 Ų79.341%0.41238%0.384SS..Hα-helixtrans-62.2-38.3177.3-71.1-2.3000111.5D133 G138 I139 W140D133-D136 HydrophobicContact CB-CB 4.22Å; D133-D136 PolarHBondContact O-N 2.88Å; D136-G138 VanDerWaalsContact C-N 3.32Å; D136-G138 PolarHBondContact O-N 3.07Å; D136-I139 PolarHBondContact O-N 3.43Å; D136-W140 PolarHBondContact O-N 2.71Å
137W93.5Very high92.2Very high73 Ų7380 Ų8028%0.27739%0.389SS..Hα-helixtrans-58.1-45.1170.6-177.193.7000112L126 W130 D133 I135 W140 V141L126-W137 HydrophobicContact CD1-CG 4.23Å; L126-W137 VanDerWaalsContact CG-NE1 3.33Å; L126-W137 VanDerWaalsContact O-CD1 3.25Å; W130-W137 HydrophobicContact CB-CG 4.28Å; W130-W137 HydrophobicContact CE3-CB 4.43Å; W130-W137 AromaticContact CE3-CD2 3.45Å; W130-W137 HydrophobicContact CE3-CD2 3.45Å; W130-W137 VanDerWaalsContact CE3-CD2 3.45Å; W130-W137 AromaticContact CE3-CE2 3.66Å; W130-W137 AromaticContact CE3-CE3 3.73Å; W130-W137 HydrophobicContact CE3-CE3 3.73Å; W130-W137 AromaticContact CE3-CG 3.76Å; W130-W137 HydrophobicContact CE3-CG 3.76Å; W130-W137 HydrophobicContact CE3-CH2 4.4Å; W130-W137 HydrophobicContact CE3-CZ2 4.14Å; W130-W137 HydrophobicContact CE3-CZ3 4.21Å; W130-W137 AromaticContact CE3-NE1 4Å; W130-W137 AromaticContact CZ3-CD2 3.87Å; W130-W137 HydrophobicContact CZ3-CD2 3.87Å; W130-W137 AromaticContact CZ3-CE3 3.64Å; W130-W137 HydrophobicContact CZ3-CE3 3.64Å; W130-W137 HydrophobicContact CZ3-CH2 4.1Å; W130-W137 HydrophobicContact CZ3-CZ2 4.29Å; W130-W137 AromaticContact CZ3-CZ3 3.77Å; W130-W137 HydrophobicContact CZ3-CZ3 3.77Å; D133-W137 PolarHBondContact O-N 2.93Å; D133-W137 VanDerWaalsContact O-N 3.15Å; I135-W137 VanDerWaalsContact C-N 3.28Å; I135-W137 PolarHBondContact O-N 2.9Å; W137-W140 PolarHBondContact O-N 3.5Å; W137-V141 HydrophobicContact CD2-CG2 3.98Å; W137-V141 HydrophobicContact CE3-CG2 4.18Å; W137-V141 HydrophobicContact CH2-CG2 3.9Å; W137-V141 HydrophobicContact CZ2-CG2 3.7Å; W137-V141 HydrophobicContact CZ3-CG2 4.13Å; W137-V141 WeakPolarHBondContact O-CG2 3.46Å; W137-V141 PolarHBondContact O-N 3.48Å
138G93.1Very high92.4Very high28 Ų2877.3 Ų77.329%0.28938%0.382SS..Hα-helixtrans-62.5-42.6177.700000112.9K134 I135 D136 W140 S142K134-G138 PolarHBondContact O-N 3.05Å; I135-G138 WeakPolarHBondContact O-CA 3.43Å; I135-G138 PolarHBondContact O-N 2.71Å; D136-G138 VanDerWaalsContact C-N 3.32Å; D136-G138 PolarHBondContact O-N 3.07Å; G138-W140 VanDerWaalsContact C-N 3.33Å; G138-W140 PolarHBondContact O-N 3.31Å; G138-S142 VanDerWaalsContact O-CB 3.25Å; G138-S142 WeakPolarHBondContact O-CB 3.22Å; G138-S142 PolarHBondContact O-N 3.32Å; G138-S142 PolarHBondContact O-OG 3.37Å
139I92.7Very high92.6Very high20 Ų2074.6 Ų74.610%0.10338%0.38CS..Hα-helixtrans-60.7-45.3175.4-61.9167.7000110.2I135 D136 S142 T143 I166I135-I139 HydrophobicContact CG2-CD1 4.41Å; I135-I139 WeakPolarHBondContact O-CG1 3.41Å; I135-I139 PolarHBondContact O-N 2.7Å; D136-I139 PolarHBondContact O-N 3.43Å; I139-S142 WeakPolarHBondContact CA-OG 3.44Å; I139-S142 PolarHBondContact O-OG 3.03Å; I139-S142 VanDerWaalsContact O-OG 3.07Å; I139-T143 WeakPolarHBondContact O-CB 3.3Å; I139-T143 PolarHBondContact O-N 3.14Å; I139-T143 PolarHBondContact O-OG1 2.96Å; I139-I166 HydrophobicContact CD1-CD1 3.48Å; I139-I166 VanDerWaalsContact CD1-CD1 3.48Å; I139-I166 HydrophobicContact CG1-CD1 3.48Å; I139-I166 VanDerWaalsContact CG1-CD1 3.48Å
140W92.8Very high92.8Very high75 Ų7576.8 Ų76.828%0.28439%0.392SS..Hα-helixtrans-61.6-51-179.7-17198.2000111.7F123 L126 D136 W137 G138 T143 Y144F123-W140 AromaticContact CD1-CH2 3.54Å; F123-W140 HydrophobicContact CD1-CH2 3.54Å; F123-W140 HydrophobicContact CD1-CZ2 4.32Å; F123-W140 HydrophobicContact CD1-CZ3 4.47Å; F123-W140 AromaticContact CE1-CH2 3.55Å; F123-W140 HydrophobicContact CE1-CH2 3.55Å; F123-W140 HydrophobicContact CE1-CZ2 4.39Å; F123-W140 HydrophobicContact CE1-CZ3 4.41Å; F123-W140 HydrophobicContact CG-CH2 4.2Å; F123-W140 HydrophobicContact CZ-CH2 4.21Å; L126-W140 HydrophobicContact CD1-CD2 3.76Å; L126-W140 HydrophobicContact CD1-CE3 3.28Å; L126-W140 HydrophobicContact CD1-CG 4.31Å; L126-W140 HydrophobicContact CD1-CH2 4.5Å; L126-W140 HydrophobicContact CD1-CZ3 3.72Å; L126-W140 HydrophobicContact CD2-CE3 4.13Å; L126-W140 HydrophobicContact CD2-CH2 4.4Å; L126-W140 HydrophobicContact CD2-CZ3 3.71Å; L126-W140 HydrophobicContact CG-CE3 4.27Å; L126-W140 HydrophobicContact CG-CZ3 4.24Å; D136-W140 PolarHBondContact O-N 2.71Å; W137-W140 PolarHBondContact O-N 3.5Å; G138-W140 VanDerWaalsContact C-N 3.33Å; G138-W140 PolarHBondContact O-N 3.31Å; W140-T143 PolarHBondContact O-N 3.48Å; W140-Y144 HydrophobicContact CZ3-CG 4.46Å; W140-Y144 WeakPolarHBondContact O-CB 3.49Å; W140-Y144 PolarHBondContact O-N 3.37Å
141V93.8Very high92.6Very high39 Ų3973.2 Ų73.224%0.23639%0.388CS..Hα-helixtrans-65.5-44.7-178.11740000111.1L126 W137 Y144 V145L126-V141 HydrophobicContact CD1-CG2 3.98Å; L126-V141 HydrophobicContact CD2-CG2 4.22Å; W137-V141 HydrophobicContact CD2-CG2 3.98Å; W137-V141 HydrophobicContact CE3-CG2 4.18Å; W137-V141 HydrophobicContact CH2-CG2 3.9Å; W137-V141 HydrophobicContact CZ2-CG2 3.7Å; W137-V141 HydrophobicContact CZ3-CG2 4.13Å; W137-V141 WeakPolarHBondContact O-CG2 3.46Å; W137-V141 PolarHBondContact O-N 3.48Å; V141-Y144 WeakPolarHBondContact O-CB 3.41Å; V141-Y144 PolarHBondContact O-N 3.06Å; V141-V145 HydrophobicContact CG1-CG2 4.39Å; V141-V145 VanDerWaalsContact O-CG2 3.32Å; V141-V145 WeakPolarHBondContact O-CG2 3.34Å; V141-V145 PolarHBondContact O-N 2.9Å
142S94.3Very high92.3Very high34 Ų3470.4 Ų70.424%0.23838%0.382CS..Hα-helixtrans-63.5-47.4179.456.80000111.4G138 I139 Y144 V145 F146G138-S142 VanDerWaalsContact O-CB 3.25Å; G138-S142 WeakPolarHBondContact O-CB 3.22Å; G138-S142 PolarHBondContact O-N 3.32Å; G138-S142 PolarHBondContact O-OG 3.37Å; I139-S142 WeakPolarHBondContact CA-OG 3.44Å; I139-S142 PolarHBondContact O-OG 3.03Å; I139-S142 VanDerWaalsContact O-OG 3.07Å; S142-Y144 VanDerWaalsContact C-N 3.28Å; S142-Y144 PolarHBondContact O-N 3.37Å; S142-V145 PolarHBondContact O-N 3.36Å; S142-F146 VanDerWaalsContact O-CD2 3.31Å; S142-F146 WeakPolarHBondContact O-CD2 3.49Å; S142-F146 PolarHBondContact O-N 3.41Å
143T94.2Very high92Very high32 Ų3267.7 Ų67.720%0.19636%0.363CS..Hα-helixtrans-58.5-40.7176.9-56.40000111.8I139 W140 T147 G159I139-T143 WeakPolarHBondContact O-CB 3.3Å; I139-T143 PolarHBondContact O-N 3.14Å; I139-T143 PolarHBondContact O-OG1 2.96Å; W140-T143 PolarHBondContact O-N 3.48Å; T143-T147 VanDerWaalsContact O-CB 3.3Å; T143-T147 WeakPolarHBondContact O-CB 3.37Å; T143-T147 PolarHBondContact O-N 2.99Å; T143-T147 PolarHBondContact O-OG1 3.28Å; T143-G159 WeakPolarHBondContact OG1-CA 3.33Å
144Y92.6Very high92Very high95 Ų9569.5 Ų69.537%0.37338%0.375SS..Hα-helixtrans-61.9-48.7175.2173.9-107.5000112.5F123 W140 V141 S142 T147 I148F123-Y144 HydrophobicContact CE1-CD2 4.36Å; F123-Y144 HydrophobicContact CE1-CE1 4.15Å; F123-Y144 AromaticContact CE1-CE2 3.81Å; F123-Y144 HydrophobicContact CE1-CE2 3.81Å; F123-Y144 AromaticContact CE1-CZ 3.64Å; F123-Y144 HydrophobicContact CZ-CD2 4.07Å; F123-Y144 AromaticContact CZ-CE2 3.38Å; F123-Y144 HydrophobicContact CZ-CE2 3.38Å; F123-Y144 AromaticContact CZ-CZ 3.61Å; W140-Y144 HydrophobicContact CZ3-CG 4.46Å; W140-Y144 WeakPolarHBondContact O-CB 3.49Å; W140-Y144 PolarHBondContact O-N 3.37Å; V141-Y144 WeakPolarHBondContact O-CB 3.41Å; V141-Y144 PolarHBondContact O-N 3.06Å; S142-Y144 VanDerWaalsContact C-N 3.28Å; S142-Y144 PolarHBondContact O-N 3.37Å; Y144-T147 PolarHBondContact O-N 3.06Å; Y144-I148 HydrophobicContact CD1-CD1 4.4Å; Y144-I148 HydrophobicContact CD2-CD1 4.08Å; Y144-I148 HydrophobicContact CE1-CD1 3.71Å; Y144-I148 HydrophobicContact CE2-CD1 3.3Å; Y144-I148 HydrophobicContact CE2-CG1 4.12Å; Y144-I148 PolarHBondContact O-N 2.92Å; Y144-I148 VanDerWaalsContact O-N 3.08Å; Y144-I148 WeakPolarHBondContact OH-CD1 3.3Å
145V94.8Very high92Very high69 Ų6962.8 Ų62.842%0.41835%0.346SS..Hα-helixtrans-61.8-46.8178.4171.50000110.9V141 S142 T147 I148 C149V141-V145 HydrophobicContact CG1-CG2 4.39Å; V141-V145 VanDerWaalsContact O-CG2 3.32Å; V141-V145 WeakPolarHBondContact O-CG2 3.34Å; V141-V145 PolarHBondContact O-N 2.9Å; S142-V145 PolarHBondContact O-N 3.36Å; V145-T147 VanDerWaalsContact C-N 3.3Å; V145-T147 PolarHBondContact O-N 3.41Å; V145-I148 PolarHBondContact O-N 2.93Å; V145-C149 WeakPolarHBondContact O-CB 3.37Å; V145-C149 PolarHBondContact O-N 3.48Å; V145-C149 PolarHBondContact O-SG 3.4Å; V145-C149 VanDerWaalsContact O-SG 3.38Å
146F94.8Very high92Very high67 Ų6761.7 Ų61.729%0.29434%0.341SS..Hα-helixtrans-61.9-37.9177.6-88.8-87.2000112.6S142 F150 F158S142-F146 VanDerWaalsContact O-CD2 3.31Å; S142-F146 WeakPolarHBondContact O-CD2 3.49Å; S142-F146 PolarHBondContact O-N 3.41Å; F146-F150 AromaticContact CD1-CD2 3.7Å; F146-F150 HydrophobicContact CD1-CD2 3.7Å; F146-F150 AromaticContact CD1-CE2 3.67Å; F146-F150 HydrophobicContact CD1-CE2 3.67Å; F146-F150 HydrophobicContact CE1-CD2 4.31Å; F146-F150 AromaticContact CE1-CE2 3.83Å; F146-F150 HydrophobicContact CE1-CE2 3.83Å; F146-F150 HydrophobicContact CG-CD2 4.48Å; F146-F150 WeakPolarHBondContact O-CB 3.37Å; F146-F150 PolarHBondContact O-N 3Å; F146-F150 VanDerWaalsContact O-N 3.13Å; F146-F158 HydrophobicContact CB-CD1 4.34Å; F146-F158 HydrophobicContact CB-CG 4.48Å; F146-F158 HydrophobicContact CD1-CD2 4.37Å; F146-F158 HydrophobicContact CD1-CG 4.38Å; F146-F158 AromaticContact CD2-CD1 3.76Å; F146-F158 HydrophobicContact CD2-CD1 3.76Å; F146-F158 HydrophobicContact CD2-CD2 4.16Å; F146-F158 AromaticContact CD2-CE1 3.63Å; F146-F158 HydrophobicContact CD2-CE1 3.63Å; F146-F158 HydrophobicContact CD2-CE2 4.03Å; F146-F158 HydrophobicContact CD2-CG 4.02Å; F146-F158 AromaticContact CD2-CZ 3.76Å; F146-F158 HydrophobicContact CD2-CZ 3.76Å; F146-F158 HydrophobicContact CE1-CD2 4.23Å; F146-F158 HydrophobicContact CE1-CE2 4.4Å; F146-F158 HydrophobicContact CE2-CD1 4.28Å; F146-F158 HydrophobicContact CE2-CD2 4.03Å; F146-F158 AromaticContact CE2-CE1 3.86Å; F146-F158 HydrophobicContact CE2-CE1 3.86Å; F146-F158 AromaticContact CE2-CE2 3.56Å; F146-F158 HydrophobicContact CE2-CE2 3.56Å; F146-F158 HydrophobicContact CE2-CG 4.36Å; F146-F158 AromaticContact CE2-CZ 3.46Å; F146-F158 HydrophobicContact CE2-CZ 3.46Å; F146-F158 VanDerWaalsContact CE2-CZ 3.46Å; F146-F158 HydrophobicContact CG-CD1 4.07Å; F146-F158 HydrophobicContact CG-CD2 4.34Å; F146-F158 HydrophobicContact CG-CE1 4.4Å; F146-F158 HydrophobicContact CG-CG 4.04Å; F146-F158 HydrophobicContact CZ-CD2 4.06Å; F146-F158 AromaticContact CZ-CE2 3.77Å; F146-F158 HydrophobicContact CZ-CE2 3.77Å; F146-F158 HydrophobicContact CZ-CZ 4.16Å
147T93.9Very high92Very high51 Ų5163.6 Ų63.631%0.31335%0.35SS..Hα-helixtrans-63.9-42177.2-61.90000112.1T143 Y144 V145 A151 A152 G155T143-T147 VanDerWaalsContact O-CB 3.3Å; T143-T147 WeakPolarHBondContact O-CB 3.37Å; T143-T147 PolarHBondContact O-N 2.99Å; T143-T147 PolarHBondContact O-OG1 3.28Å; Y144-T147 PolarHBondContact O-N 3.06Å; V145-T147 VanDerWaalsContact C-N 3.3Å; V145-T147 PolarHBondContact O-N 3.41Å; T147-A151 CarbonylContact O-C 3.59Å; T147-A152 HydrophobicContact CG2-CB 4.41Å; T147-G155 WeakPolarHBondContact OG1-CA 3.34Å
148I93.7Very high92Very high107 Ų10762.8 Ų62.855%0.54935%0.349SS..Hα-helixtrans-76.1-43-179.5-72.7-176.2000112.3Y144 V145Y144-I148 HydrophobicContact CD1-CD1 4.4Å; Y144-I148 HydrophobicContact CD2-CD1 4.08Å; Y144-I148 HydrophobicContact CE1-CD1 3.71Å; Y144-I148 HydrophobicContact CE2-CD1 3.3Å; Y144-I148 HydrophobicContact CE2-CG1 4.12Å; Y144-I148 PolarHBondContact O-N 2.92Å; Y144-I148 VanDerWaalsContact O-N 3.08Å; Y144-I148 WeakPolarHBondContact OH-CD1 3.3Å; V145-I148 PolarHBondContact O-N 2.93Å
149C95.4Very high91.9Very high88 Ų8861.8 Ų61.860%0.59534%0.339SS*.Hα-helixtrans-75.8-29.8-174.3-68.40000113.3V145V145-C149 WeakPolarHBondContact O-CB 3.37Å; V145-C149 PolarHBondContact O-N 3.48Å; V145-C149 PolarHBondContact O-SG 3.4Å; V145-C149 VanDerWaalsContact O-SG 3.38Å
150F92Very high91.9Very high145 Ų14563.9 Ų63.964%0.63635%0.353SS*.THydrogen-bonded Turntrans-114.6-89.3-176.7-60.9-82.9000111.3F146 V154F146-F150 AromaticContact CD1-CD2 3.7Å; F146-F150 HydrophobicContact CD1-CD2 3.7Å; F146-F150 AromaticContact CD1-CE2 3.67Å; F146-F150 HydrophobicContact CD1-CE2 3.67Å; F146-F150 HydrophobicContact CE1-CD2 4.31Å; F146-F150 AromaticContact CE1-CE2 3.83Å; F146-F150 HydrophobicContact CE1-CE2 3.83Å; F146-F150 HydrophobicContact CG-CD2 4.48Å; F146-F150 WeakPolarHBondContact O-CB 3.37Å; F146-F150 PolarHBondContact O-N 3Å; F146-F150 VanDerWaalsContact O-N 3.13Å; F150-V154 HydrophobicContact CB-CB 4.25Å; F150-V154 HydrophobicContact CB-CG1 4.21Å
151A87.8Confident91.9Very high45 Ų4564.3 Ų64.337%0.37236%0.363SS..  trans-159.3156.5179.900000109.8T147 N153 V154 G155T147-A151 CarbonylContact O-C 3.59Å; A151-N153 VanDerWaalsContact C-N 3.28Å; A151-N153 PolarHBondContact O-N 3.26Å; A151-V154 HydrophobicContact CB-CG2 4.26Å; A151-V154 PolarHBondContact O-N 3.43Å; A151-V154 VanDerWaalsContact O-N 3.14Å; A151-G155 PolarHBondContact O-N 3.48Å
152A86.8Confident91.9Very high65 Ų6563.9 Ų63.954%0.53736%0.361SS..Hα-helixtrans-56.1-40.6178.300000113.2T147 V154 G155 L156T147-A152 HydrophobicContact CG2-CB 4.41Å; A152-V154 PolarHBondContact O-N 3.5Å; A152-G155 PolarHBondContact O-N 2.72Å; A152-L156 WeakPolarHBondContact O-CB 3.29Å; A152-L156 PolarHBondContact O-N 2.95Å
153N85.1Confident91.7Very high62 Ų6265.2 Ų65.233%0.33237%0.368SS..Hα-helixtrans-65.5-39.5179.4-63.1-16.3000112A151 L157A151-N153 VanDerWaalsContact C-N 3.28Å; A151-N153 PolarHBondContact O-N 3.26Å; N153-L157 WeakPolarHBondContact O-CB 3.34Å; N153-L157 PolarHBondContact O-N 3.13Å
154V89.3Confident91.6Very high71 Ų7168.3 Ų68.343%0.4338%0.383SS..Hα-helixtrans-69-44.2178.2178.80000110.4F150 A151 A152 L157 F158F150-V154 HydrophobicContact CB-CB 4.25Å; F150-V154 HydrophobicContact CB-CG1 4.21Å; A151-V154 HydrophobicContact CB-CG2 4.26Å; A151-V154 PolarHBondContact O-N 3.43Å; A151-V154 VanDerWaalsContact O-N 3.14Å; A152-V154 PolarHBondContact O-N 3.5Å; V154-L157 PolarHBondContact O-N 3.23Å; V154-F158 WeakPolarHBondContact O-CB 3.29Å; V154-F158 PolarHBondContact O-N 3.01Å
155G91.6Very high91.6Very high0 Ų066.5 Ų66.50%039%0.388CS..Hα-helixtrans-59.8-45.4175.500000112.6T147 A151 A152 F158 G159T147-G155 WeakPolarHBondContact OG1-CA 3.34Å; A151-G155 PolarHBondContact O-N 3.48Å; A152-G155 PolarHBondContact O-N 2.72Å; G155-F158 PolarHBondContact O-N 3.31Å; G155-G159 PolarHBondContact O-N 2.98Å
156L89.7Confident91.3Very high52 Ų5265.6 Ų65.627%0.27238%0.38SS..Hα-helixtrans-58-50.8175.2176.968.2000111.8V17 A152 F158 G159 V160V17-L156 HydrophobicContact CG2-CD1 4.02Å; V17-L156 HydrophobicContact CG2-CD2 3.45Å; V17-L156 VanDerWaalsContact CG2-CD2 3.45Å; V17-L156 HydrophobicContact CG2-CG 4.34Å; A152-L156 WeakPolarHBondContact O-CB 3.29Å; A152-L156 PolarHBondContact O-N 2.95Å; L156-F158 VanDerWaalsContact C-N 3.32Å; L156-F158 PolarHBondContact O-N 2.74Å; L156-G159 PolarHBondContact O-N 3.45Å; L156-V160 HydrophobicContact CD1-CG2 4.37Å; L156-V160 WeakPolarHBondContact O-CG2 3.3Å; L156-V160 PolarHBondContact O-N 3.46Å
157L89.7Confident91Very high117 Ų11766.7 Ų66.761%0.61339%0.392SS*.Hα-helixtrans-58.8-46.3179.3-179.664.9000111N153 V154 G159 V160 V161N153-L157 WeakPolarHBondContact O-CB 3.34Å; N153-L157 PolarHBondContact O-N 3.13Å; V154-L157 PolarHBondContact O-N 3.23Å; L157-G159 PolarHBondContact O-N 3.25Å; L157-V160 PolarHBondContact O-N 2.98Å; L157-V161 HydrophobicContact CD1-CG2 4.25Å; L157-V161 WeakPolarHBondContact O-CB 3.33Å; L157-V161 VanDerWaalsContact O-CG2 3.3Å; L157-V161 WeakPolarHBondContact O-CG2 3.36Å; L157-V161 PolarHBondContact O-N 3.27Å
158F93.2Very high90.6Very high56 Ų5668.4 Ų68.425%0.24640%0.398CS..Hα-helixtrans-58.5-47.3177176.1-92.2000111.9F146 V154 G155 L156 V160 V161 C162F146-F158 HydrophobicContact CB-CD1 4.34Å; F146-F158 HydrophobicContact CB-CG 4.48Å; F146-F158 HydrophobicContact CD1-CD2 4.37Å; F146-F158 HydrophobicContact CD1-CG 4.38Å; F146-F158 AromaticContact CD2-CD1 3.76Å; F146-F158 HydrophobicContact CD2-CD1 3.76Å; F146-F158 HydrophobicContact CD2-CD2 4.16Å; F146-F158 AromaticContact CD2-CE1 3.63Å; F146-F158 HydrophobicContact CD2-CE1 3.63Å; F146-F158 HydrophobicContact CD2-CE2 4.03Å; F146-F158 HydrophobicContact CD2-CG 4.02Å; F146-F158 AromaticContact CD2-CZ 3.76Å; F146-F158 HydrophobicContact CD2-CZ 3.76Å; F146-F158 HydrophobicContact CE1-CD2 4.23Å; F146-F158 HydrophobicContact CE1-CE2 4.4Å; F146-F158 HydrophobicContact CE2-CD1 4.28Å; F146-F158 HydrophobicContact CE2-CD2 4.03Å; F146-F158 AromaticContact CE2-CE1 3.86Å; F146-F158 HydrophobicContact CE2-CE1 3.86Å; F146-F158 AromaticContact CE2-CE2 3.56Å; F146-F158 HydrophobicContact CE2-CE2 3.56Å; F146-F158 HydrophobicContact CE2-CG 4.36Å; F146-F158 AromaticContact CE2-CZ 3.46Å; F146-F158 HydrophobicContact CE2-CZ 3.46Å; F146-F158 VanDerWaalsContact CE2-CZ 3.46Å; F146-F158 HydrophobicContact CG-CD1 4.07Å; F146-F158 HydrophobicContact CG-CD2 4.34Å; F146-F158 HydrophobicContact CG-CE1 4.4Å; F146-F158 HydrophobicContact CG-CG 4.04Å; F146-F158 HydrophobicContact CZ-CD2 4.06Å; F146-F158 AromaticContact CZ-CE2 3.77Å; F146-F158 HydrophobicContact CZ-CE2 3.77Å; F146-F158 HydrophobicContact CZ-CZ 4.16Å; V154-F158 WeakPolarHBondContact O-CB 3.29Å; V154-F158 PolarHBondContact O-N 3.01Å; G155-F158 PolarHBondContact O-N 3.31Å; L156-F158 VanDerWaalsContact C-N 3.32Å; L156-F158 PolarHBondContact O-N 2.74Å; F158-V160 PolarHBondContact O-N 2.65Å; F158-V161 PolarHBondContact O-N 2.82Å; F158-C162 VanDerWaalsContact CE1-SG 3.57Å; F158-C162 VanDerWaalsContact CE2-SG 3.54Å; F158-C162 WeakPolarHBondContact CZ-SG 3.07Å; F158-C162 WeakPolarHBondContact O-CB 3.23Å; F158-C162 PolarHBondContact O-N 3.19Å; F158-C162 PolarHBondContact O-SG 3.03Å
159G92.3Very high90.1Very high8 Ų865.7 Ų65.78%0.08240%0.396CS..Hα-helixtrans-61.8-43.5179.600000112.8T143 G155 L156 L157 T163T143-G159 WeakPolarHBondContact OG1-CA 3.33Å; G155-G159 PolarHBondContact O-N 2.98Å; L156-G159 PolarHBondContact O-N 3.45Å; L157-G159 PolarHBondContact O-N 3.25Å; G159-T163 WeakPolarHBondContact O-CB 3.35Å; G159-T163 PolarHBondContact O-N 3.31Å; G159-T163 PolarHBondContact O-OG1 3.49Å
160V91.3Very high89.4Confident64 Ų6467.3 Ų67.339%0.38839%0.39SS..Hα-helixtrans-62.7-50.1176.8171.60000110.8L156 L157 F158 C162 T163 I164L156-V160 HydrophobicContact CD1-CG2 4.37Å; L156-V160 WeakPolarHBondContact O-CG2 3.3Å; L156-V160 PolarHBondContact O-N 3.46Å; L157-V160 PolarHBondContact O-N 2.98Å; F158-V160 PolarHBondContact O-N 2.65Å; V160-C162 PolarHBondContact O-N 3.28Å; V160-T163 PolarHBondContact O-N 2.97Å; V160-I164 HydrophobicContact CG1-CD1 3.82Å; V160-I164 WeakPolarHBondContact O-CG1 3.33Å; V160-I164 PolarHBondContact O-N 2.85Å
161V93.3Very high88.6Confident83 Ų8363.5 Ų63.550%0.50337%0.374SS..Hα-helixtrans-62.4-44.6-179.5171.80000111.3L157 F158 T163 I164 A165L157-V161 HydrophobicContact CD1-CG2 4.25Å; L157-V161 WeakPolarHBondContact O-CB 3.33Å; L157-V161 VanDerWaalsContact O-CG2 3.3Å; L157-V161 WeakPolarHBondContact O-CG2 3.36Å; L157-V161 PolarHBondContact O-N 3.27Å; F158-V161 PolarHBondContact O-N 2.82Å; V161-T163 PolarHBondContact O-N 2.9Å; V161-I164 PolarHBondContact O-N 2.79Å; V161-A165 WeakPolarHBondContact O-CB 3.33Å; V161-A165 PolarHBondContact O-N 3.13Å
162C93.6Very high87.7Confident30 Ų3062.6 Ų62.620%0.20336%0.364CS..Hα-helixtrans-62.3-43177.8-71.50000112F158 V160 I164 A165 I166F158-C162 VanDerWaalsContact CE1-SG 3.57Å; F158-C162 VanDerWaalsContact CE2-SG 3.54Å; F158-C162 WeakPolarHBondContact CZ-SG 3.07Å; F158-C162 WeakPolarHBondContact O-CB 3.23Å; F158-C162 PolarHBondContact O-N 3.19Å; F158-C162 PolarHBondContact O-SG 3.03Å; V160-C162 PolarHBondContact O-N 3.28Å; C162-I164 PolarHBondContact O-N 3.04Å; C162-A165 PolarHBondContact O-N 2.81Å; C162-I166 WeakPolarHBondContact O-CB 3.25Å; C162-I166 WeakPolarHBondContact O-CD1 3.43Å; C162-I166 VanDerWaalsContact O-CG1 3.26Å; C162-I166 WeakPolarHBondContact O-CG1 3.26Å; C162-I166 PolarHBondContact O-N 2.88Å
163T91.7Very high86.8Confident63 Ų6368.3 Ų68.339%0.38737%0.372SS..Hα-helixtrans-61.4-46.5178.1-560000110.7G159 V160 V161 I166 V167G159-T163 WeakPolarHBondContact O-CB 3.35Å; G159-T163 PolarHBondContact O-N 3.31Å; G159-T163 PolarHBondContact O-OG1 3.49Å; V160-T163 PolarHBondContact O-N 2.97Å; V161-T163 PolarHBondContact O-N 2.9Å; T163-I166 PolarHBondContact O-N 3.15Å; T163-V167 VanDerWaalsContact O-CG2 3.29Å; T163-V167 WeakPolarHBondContact O-CG2 3.36Å; T163-V167 PolarHBondContact O-N 3.27Å
164I91.5Very high85.7Confident96 Ų9668.4 Ų68.449%0.49238%0.381SS..Hα-helixtrans-61.2-48.1177-68168.5000110.7V160 V161 C162 I166 V167 I168V160-I164 HydrophobicContact CG1-CD1 3.82Å; V160-I164 WeakPolarHBondContact O-CG1 3.33Å; V160-I164 PolarHBondContact O-N 2.85Å; V161-I164 PolarHBondContact O-N 2.79Å; C162-I164 PolarHBondContact O-N 3.04Å; I164-I166 VanDerWaalsContact C-N 3.31Å; I164-I166 PolarHBondContact O-N 2.8Å; I164-V167 PolarHBondContact O-N 3.07Å; I164-I168 HydrophobicContact CG2-CD1 3.64Å; I164-I168 HydrophobicContact CG2-CG1 4.38Å; I164-I168 VanDerWaalsContact O-CG1 3.28Å; I164-I168 WeakPolarHBondContact O-CG1 3.26Å; I164-I168 PolarHBondContact O-N 3.19Å
165A91.4Very high84.4Confident58 Ų5866.9 Ų66.948%0.47937%0.369SS..Hα-helixtrans-60-40.918000000112.2V161 C162 I168 G169V161-A165 WeakPolarHBondContact O-CB 3.33Å; V161-A165 PolarHBondContact O-N 3.13Å; C162-A165 PolarHBondContact O-N 2.81Å; A165-I168 PolarHBondContact O-N 3.49Å; A165-G169 PolarHBondContact O-N 3.31Å
166I89.7Confident82.7Confident49 Ų4967.5 Ų67.525%0.25137%0.373SS..Hα-helixtrans-68.6-42.7178.1-73.2164.5000111.1I135 I139 C162 T163 I164 I168 G169 R170I135-I166 HydrophobicContact CG2-CD1 3.74Å; I135-I166 HydrophobicContact CG2-CG1 4.27Å; I135-I166 HydrophobicContact CG2-CG2 3.6Å; I139-I166 HydrophobicContact CD1-CD1 3.48Å; I139-I166 VanDerWaalsContact CD1-CD1 3.48Å; I139-I166 HydrophobicContact CG1-CD1 3.48Å; I139-I166 VanDerWaalsContact CG1-CD1 3.48Å; C162-I166 WeakPolarHBondContact O-CB 3.25Å; C162-I166 WeakPolarHBondContact O-CD1 3.43Å; C162-I166 VanDerWaalsContact O-CG1 3.26Å; C162-I166 WeakPolarHBondContact O-CG1 3.26Å; C162-I166 PolarHBondContact O-N 2.88Å; T163-I166 PolarHBondContact O-N 3.15Å; I164-I166 VanDerWaalsContact C-N 3.31Å; I164-I166 PolarHBondContact O-N 2.8Å; I166-I168 VanDerWaalsContact C-N 3.34Å; I166-I168 PolarHBondContact O-N 3.45Å; I166-G169 PolarHBondContact O-N 3.24Å; I166-R170 HydrophobicContact CG2-CG 4.23Å; I166-R170 WeakPolarHBondContact O-CB 3.39Å; I166-R170 WeakPolarHBondContact O-CG 3.48Å; I166-R170 PolarHBondContact O-N 3.42Å
167V87.2Confident81Confident91 Ų9168.7 Ų68.755%0.55238%0.383SS*.Hα-helixtrans-59.6-47.8175.5169.30000110.1T163 I164 G169 R170 F171T163-V167 VanDerWaalsContact O-CG2 3.29Å; T163-V167 WeakPolarHBondContact O-CG2 3.36Å; T163-V167 PolarHBondContact O-N 3.27Å; I164-V167 PolarHBondContact O-N 3.07Å; V167-G169 VanDerWaalsContact C-N 3.33Å; V167-G169 PolarHBondContact O-N 3.2Å; V167-R170 PolarHBondContact O-N 3.13Å; V167-F171 VanDerWaalsContact O-CB 3.29Å; V167-F171 WeakPolarHBondContact O-CB 3.17Å; V167-F171 PolarHBondContact O-N 3.39Å
168I86Confident79.4Confident86 Ų8665.1 Ų65.144%0.44137%0.367SS..Hα-helixtrans-61.6-40.9177.1-66169000111.1I164 A165 I166 P172 L213I164-I168 HydrophobicContact CG2-CD1 3.64Å; I164-I168 HydrophobicContact CG2-CG1 4.38Å; I164-I168 VanDerWaalsContact O-CG1 3.28Å; I164-I168 WeakPolarHBondContact O-CG1 3.26Å; I164-I168 PolarHBondContact O-N 3.19Å; A165-I168 PolarHBondContact O-N 3.49Å; I166-I168 VanDerWaalsContact C-N 3.34Å; I166-I168 PolarHBondContact O-N 3.45Å; I168-P172 WeakPolarHBondContact O-CD 3.46Å; I168-L213 HydrophobicContact CG2-CD2 4.1Å
169G83Confident77.6Confident50 Ų5063 Ų6352%0.51536%0.358SS..Hα-helixtrans-71.7-34.217900000114.1A165 I166 V167A165-G169 PolarHBondContact O-N 3.31Å; I166-G169 PolarHBondContact O-N 3.24Å; V167-G169 VanDerWaalsContact C-N 3.33Å; V167-G169 PolarHBondContact O-N 3.2Å
170R80.3Confident75.6Confident122 Ų12269.9 Ų69.946%0.4639%0.386SS..Hα-helixtrans-77.1-31.5178-73.3-177.376.4140.8-4.6112.3D133 I166 V167 R173 A174D133-R170 IonicContact OD1-NH1 3.55Å; D133-R170 IonicContact OD2-CZ 2.62Å; D133-R170 IonicContact OD2-NH1 3.48Å; D133-R170 PolarHBondContact OD2-NH1 2.91Å; D133-R170 IonicContact OD2-NH2 2.66Å; D133-R170 PolarHBondContact OD2-NH2 3.42Å; I166-R170 HydrophobicContact CG2-CG 4.23Å; I166-R170 WeakPolarHBondContact O-CB 3.39Å; I166-R170 WeakPolarHBondContact O-CG 3.48Å; I166-R170 PolarHBondContact O-N 3.42Å; V167-R170 PolarHBondContact O-N 3.13Å; R170-R173 PolarHBondContact O-N 3.08Å; R170-R173 VanDerWaalsContact O-N 3.15Å; R170-A174 WeakPolarHBondContact O-CB 3.35Å; R170-A174 PolarHBondContact O-N 3.4Å
171F76.6Confident73.6Confident66 Ų6672.7 Ų72.729%0.28940%0.399SS..Hα-helixtrans-56.2-53.2-174.4-174.6-86.7000112.8V167 R173 M175 P209 V211 L213V167-F171 VanDerWaalsContact O-CB 3.29Å; V167-F171 WeakPolarHBondContact O-CB 3.17Å; V167-F171 PolarHBondContact O-N 3.39Å; F171-R173 VanDerWaalsContact C-N 3.33Å; F171-R173 PolarHBondContact O-N 3.01Å; F171-M175 HydrophobicContact CE2-CE 4.23Å; F171-M175 HydrophobicContact CZ-CE 4.39Å; F171-M175 VanDerWaalsContact O-CG 3.3Å; F171-M175 WeakPolarHBondContact O-CG 3.41Å; F171-M175 PolarHBondContact O-N 3.38Å; F171-P209 HydrophobicContact CZ-CG 4.22Å; F171-V211 HydrophobicContact CE1-CG2 3.65Å; F171-V211 HydrophobicContact CZ-CG2 4.26Å; F171-L213 HydrophobicContact CD1-CB 4.08Å; F171-L213 HydrophobicContact CD1-CD1 3.89Å; F171-L213 HydrophobicContact CE1-CB 4.42Å; F171-L213 HydrophobicContact CE1-CD1 4.33Å; F171-L213 HydrophobicContact CG-CD1 4.46Å
172P69.3Low71.9Confident26 Ų2670.1 Ų70.117%0.16938%0.382CS..Hα-helixtrans-63.1-37.4176.2-20.731.2000113I168 M175 T176 L213I168-P172 WeakPolarHBondContact O-CD 3.46Å; P172-M175 PolarHBondContact O-N 3Å; P172-T176 PolarHBondContact O-N 3.17Å; P172-T176 PolarHBondContact O-OG1 3.28Å; P172-L213 HydrophobicContact CG-CB 4.3Å; P172-L213 VanDerWaalsContact CG-O 3.3Å; P172-L213 WeakPolarHBondContact CG-O 3.39Å
173R67.5Low70Confident185 Ų18576.6 Ų76.670%0.69841%0.406SS*.Hα-helixtrans-72.2-41.3-175.1-172.4177.6179.3175.70.5112.7R170 F171 M175 T176 V177R170-R173 PolarHBondContact O-N 3.08Å; R170-R173 VanDerWaalsContact O-N 3.15Å; F171-R173 VanDerWaalsContact C-N 3.33Å; F171-R173 PolarHBondContact O-N 3.01Å; R173-M175 VanDerWaalsContact C-N 3.27Å; R173-M175 PolarHBondContact O-N 3.47Å; R173-T176 WeakPolarHBondContact O-CB 3.34Å; R173-T176 PolarHBondContact O-N 3.3Å; R173-V177 PolarHBondContact O-N 3.15Å
174A61.5Low68.3Low64 Ų6478 Ų7853%0.52941%0.409SS..Hα-helixtrans-61-41.3174.900000110.7R170 V177 S178R170-A174 WeakPolarHBondContact O-CB 3.35Å; R170-A174 PolarHBondContact O-N 3.4Å; A174-V177 PolarHBondContact O-N 2.94Å; A174-S178 PolarHBondContact O-N 2.86Å
175M63Low66.4Low38 Ų3878.1 Ų78.119%0.18741%0.408CS..Hα-helixtrans-69.9-35.7178.1-61.8-57.7174.400112.7F171 P172 R173 V177 S178 I179 N208 P209F171-M175 HydrophobicContact CE2-CE 4.23Å; F171-M175 HydrophobicContact CZ-CE 4.39Å; F171-M175 VanDerWaalsContact O-CG 3.3Å; F171-M175 WeakPolarHBondContact O-CG 3.41Å; F171-M175 PolarHBondContact O-N 3.38Å; P172-M175 PolarHBondContact O-N 3Å; R173-M175 VanDerWaalsContact C-N 3.27Å; R173-M175 PolarHBondContact O-N 3.47Å; M175-V177 VanDerWaalsContact C-N 3.32Å; M175-V177 PolarHBondContact O-N 3.38Å; M175-S178 CarbonylContact O-C 3.56Å; M175-S178 WeakPolarHBondContact O-CA 3.5Å; M175-S178 WeakPolarHBondContact O-CB 3.22Å; M175-S178 PolarHBondContact O-N 2.91Å; M175-S178 VanDerWaalsContact O-N 3.11Å; M175-I179 WeakPolarHBondContact O-CG1 3.33Å; M175-I179 PolarHBondContact O-N 3.01Å; M175-N208 HydrophobicContact CB-CB 4.4Å; M175-N208 HydrophobicContact CG-CB 4.35Å; M175-N208 PolarHBondContact O-ND2 3.01Å; M175-N208 HydrophobicContact SD-CB 3.6Å; M175-N208 PolarHBondContact SD-OD1 3.1Å; M175-P209 HydrophobicContact CE-CG 4.31Å
176T56Low64.5Low13 Ų1379.7 Ų79.78%0.0841%0.406CS..Hα-helixtrans-56.8-43.7171.2-56.70000112.9P172 R173 S178 I179 K180 K217 D221P172-T176 PolarHBondContact O-N 3.17Å; P172-T176 PolarHBondContact O-OG1 3.28Å; R173-T176 WeakPolarHBondContact O-CB 3.34Å; R173-T176 PolarHBondContact O-N 3.3Å; T176-S178 PolarHBondContact O-N 3Å; T176-I179 PolarHBondContact O-N 3.45Å; T176-K180 PolarHBondContact O-N 3.46Å; T176-K217 HydrophobicContact CG2-CD 4.42Å; T176-K217 VanDerWaalsContact CG2-CE 3.48Å; T176-K217 WeakPolarHBondContact OG1-CD 3.37Å; T176-K217 WeakPolarHBondContact OG1-CE 3.23Å; T176-K217 PolarHBondContact OG1-NZ 3.04Å; T176-D221 WeakPolarHBondContact CG2-OD2 3.33Å
177V53.8Low62.4Low78 Ų7882.8 Ų82.847%0.47342%0.417SS..Hα-helixtrans-64.5-36.4178.2175.50000110.1R173 A174 M175 K180 N181R173-V177 PolarHBondContact O-N 3.15Å; A174-V177 PolarHBondContact O-N 2.94Å; M175-V177 VanDerWaalsContact C-N 3.32Å; M175-V177 PolarHBondContact O-N 3.38Å; V177-K180 PolarHBondContact O-N 3.08Å; V177-N181 WeakPolarHBondContact O-CB 3.44Å; V177-N181 VanDerWaalsContact O-CG 3.32Å; V177-N181 PolarHBondContact O-N 2.97Å; V177-N181 PolarHBondContact O-ND2 3.34Å
178S55.2Low60.3Low41 Ų4184.1 Ų84.129%0.28742%0.416SS..Hα-helixtrans-65.7-38.5173.6173.10000112.6A174 M175 T176 N181 M182 N208A174-S178 PolarHBondContact O-N 2.86Å; M175-S178 CarbonylContact O-C 3.56Å; M175-S178 WeakPolarHBondContact O-CA 3.5Å; M175-S178 WeakPolarHBondContact O-CB 3.22Å; M175-S178 PolarHBondContact O-N 2.91Å; M175-S178 VanDerWaalsContact O-N 3.11Å; T176-S178 PolarHBondContact O-N 3Å; S178-N181 PolarHBondContact O-N 3.22Å; S178-M182 PolarHBondContact O-N 3.17Å; S178-N208 VanDerWaalsContact CB-ND2 3.3Å; S178-N208 WeakPolarHBondContact CB-ND2 3.48Å; S178-N208 WeakPolarHBondContact CB-OD1 3.33Å; S178-N208 PolarHBondContact OG-ND2 3.18Å; S178-N208 VanDerWaalsContact OG-ND2 3.13Å; S178-N208 PolarHBondContact OG-OD1 2.93Å
179I54.7Low58.4Low11 Ų1181.7 Ų81.76%0.05641%0.405CS..Hα-helixtrans-63.8-42.5172.5-63167000111.2M175 T176 N181 M182 F218 D221 M225M175-I179 WeakPolarHBondContact O-CG1 3.33Å; M175-I179 PolarHBondContact O-N 3.01Å; T176-I179 PolarHBondContact O-N 3.45Å; I179-N181 VanDerWaalsContact C-N 3.27Å; I179-N181 PolarHBondContact O-N 3.22Å; I179-M182 WeakPolarHBondContact O-CB 3.24Å; I179-M182 PolarHBondContact O-N 3.39Å; I179-F218 HydrophobicContact CD1-CB 4.19Å; I179-F218 HydrophobicContact CD1-CD2 3.81Å; I179-F218 HydrophobicContact CD1-CG 4.49Å; I179-D221 HydrophobicContact CG2-CB 3.98Å; I179-M225 HydrophobicContact CG2-CE 3.87Å
180K51.9Low56.1Low153 Ų15387.7 Ų87.767%0.66542%0.417SS*.Hα-helixtrans-66.9-26.3177.6-74-172.3175.7-170.40114T176 V177 M182T176-K180 PolarHBondContact O-N 3.46Å; V177-K180 PolarHBondContact O-N 3.08Å; K180-M182 VanDerWaalsContact C-N 3.25Å
181N48.8Very low53.9Low124 Ų12485.9 Ų85.966%0.66342%0.419SS*.THydrogen-bonded Turntrans-88.611.5176.5-70.4-15.3000112.7V177 S178 I179V177-N181 WeakPolarHBondContact O-CB 3.44Å; V177-N181 VanDerWaalsContact O-CG 3.32Å; V177-N181 PolarHBondContact O-N 2.97Å; V177-N181 PolarHBondContact O-ND2 3.34Å; S178-N181 PolarHBondContact O-N 3.22Å; I179-N181 VanDerWaalsContact C-N 3.27Å; I179-N181 PolarHBondContact O-N 3.22Å
182M57.6Low52.2Low28 Ų2892 Ų9214%0.13845%0.449CS..  trans-61.7137.7175.6177.1-174.7-88.900110.8S178 I179 K180 E184 I204 S205 I206 M225S178-M182 PolarHBondContact O-N 3.17Å; I179-M182 WeakPolarHBondContact O-CB 3.24Å; I179-M182 PolarHBondContact O-N 3.39Å; K180-M182 VanDerWaalsContact C-N 3.25Å; M182-E184 PolarHBondContact O-N 3.39Å; M182-I204 HydrophobicContact CE-CB 4.01Å; M182-I204 HydrophobicContact CE-CG2 3.12Å; M182-I204 WeakPolarHBondContact SD-CA 3.25Å; M182-I204 HydrophobicContact SD-CB 3.59Å; M182-I204 VanDerWaalsContact SD-CB 3.59Å; M182-I204 HydrophobicContact SD-CG1 3.91Å; M182-I204 HydrophobicContact SD-CG2 3.21Å; M182-I204 WeakPolarHBondContact SD-CG2 3.24Å; M182-S205 WeakPolarHBondContact CE-O 3.43Å; M182-S205 WeakPolarHBondContact CG-O 3.4Å; M182-S205 PolarHBondContact SD-N 3.5Å; M182-I206 HydrophobicContact CE-CB 4.36Å; M182-I206 HydrophobicContact CE-CG1 3.58Å; M182-M225 HydrophobicContact SD-CE 4.12Å
183K53.5Low50.8Low166 Ų16698.6 Ų98.672%0.72248%0.479SS*.  trans-73.395.6171.9-69.6-179-179.7179.40108.9M185K183-M185 PolarHBondContact O-N 3.24Å
184E55.9Low49.2Very low93 Ų9397 Ų9744%0.43549%0.485SS..  trans-69.5113.8163.6-174.2167.8-157.300107.8M182 K202M182-E184 PolarHBondContact O-N 3.39Å; E184-K202 WeakPolarHBondContact OE1-CE 3.49Å; E184-K202 IonicContact OE1-NZ 3.43Å; E184-K202 PolarHBondContact OE1-NZ 3.21Å
185M50.9Low47.9Very low98 Ų9898.8 Ų98.848%0.48349%0.494SS..EExtended strand (participates in β ladder)trans-113.2108.7169.2-76.3-166.4-78.700107.9K183 F187 I203K183-M185 PolarHBondContact O-N 3.24Å; M185-F187 HydrophobicContact CB-CD2 4.47Å; M185-F187 HydrophobicContact CB-CE2 4.26Å; M185-F187 HydrophobicContact SD-CE2 4.46Å; M185-I203 PolarHBondContact O-N 3.47Å
186E51.6Low46.8Very low91 Ų91105.8 Ų105.843%0.42553%0.526SS..EExtended strand (participates in β ladder)trans-84.5118.8168.2-74.7178.8-141.300108.9E229E186-E229 VanDerWaalsContact OE1-OE1 3.1Å
187F45.6Very low45.9Very low114 Ų114109.3 Ų109.350%0.555%0.547SS..EExtended strand (participates in β ladder)trans-103.4106.7166.3-83.4-88.4000108.6M185 V189 V201 I203M185-F187 HydrophobicContact CB-CD2 4.47Å; M185-F187 HydrophobicContact CB-CE2 4.26Å; M185-F187 HydrophobicContact SD-CE2 4.46Å; F187-V189 PolarHBondContact O-N 2.91Å; F187-V201 PolarHBondContact N-O 3.46Å; F187-V201 PolarHBondContact O-N 2.84Å; F187-I203 HydrophobicContact CD2-CD1 4.12Å; F187-I203 HydrophobicContact CE2-CD1 4.39Å
188K44.5Very low45.6Very low119 Ų119109.2 Ų109.252%0.51754%0.544SS..EExtended strand (participates in β ladder)trans-85103.3167.1-72.5-174-178.3-176.70108.5K190 L198K188-K190 PolarHBondContact O-N 3.15Å; K188-K190 VanDerWaalsContact O-N 3.16Å; K188-L198 HydrophobicContact CB-CD2 4.42Å
189V44.5Very low45.7Very low35 Ų35109 Ų10921%0.21254%0.539CS..EExtended strand (participates in β ladder)trans-78.899.3178.8-177.70000108.7F187F187-V189 PolarHBondContact O-N 2.91Å
190K35.4Very low46.1Very low177 Ų177110 Ų11077%0.7754%0.543SS*.  trans-88.7120163.3-74.1-175.7177.4-1750108.3K188 L198K188-K190 PolarHBondContact O-N 3.15Å; K188-K190 VanDerWaalsContact O-N 3.16Å; K190-L198 HydrophobicContact CD-CD2 4.37Å; K190-L198 HydrophobicContact CG-CD2 3.53Å
191T34.7Very low47.1Very low83 Ų83103 Ų10351%0.50951%0.513SS..  trans-93.8136.7172.1-42.70000108.8M193T191-M193 VanDerWaalsContact C-N 3.26Å; T191-M193 PolarHBondContact O-N 3.42Å
192E40.6Very low48.4Very low195 Ų19597.5 Ų97.591%0.91148%0.483SS*.SBendtrans-81.410.4-169.6-128.5174.9-166.400115.2
193M38.9Very low49.5Very low164 Ų16496.6 Ų96.681%0.80848%0.479SS*.SBendtrans-142.1126.5169.8-72.6-159170.500109.7T191T191-M193 VanDerWaalsContact C-N 3.26Å; T191-M193 PolarHBondContact O-N 3.42Å
194D33.5Very low50.9Low151 Ų15188.8 Ų88.881%0.80745%0.445SS*.SBendtrans74.1131.8-175.5-95.3-9.2000118.8
195S35.9Very low52.1Low103 Ų10385.7 Ų85.772%0.7243%0.434SS*.SBendtrans-54.4143-171.8-59.40000115.6
196E38.3Very low53.5Low184 Ų18481.1 Ų81.186%0.8641%0.411SS*.  trans58.452.7147.5-62.2-178.6-17900120.1
197T38.5Very low54.7Low87 Ų8781.8 Ų81.853%0.53442%0.418SS..  trans-131.991.4153.9430000111.5Q199T197-Q199 PolarHBondContact O-N 3.24Å
198L47.4Very low56.2Low77 Ų7776.9 Ų76.940%0.40340%0.397SS..  trans-80.896.1171.5-75.3168.4000109.1K188 K190 Q200K188-L198 HydrophobicContact CB-CD2 4.42Å; K190-L198 HydrophobicContact CD-CD2 4.37Å; K190-L198 HydrophobicContact CG-CD2 3.53Å; L198-Q200 PolarHBondContact O-N 3.07Å
199Q56.3Low58.2Low37 Ų3772.2 Ų72.217%0.17338%0.379CS..EExtended strand (participates in β ladder)trans-76.2118.6167.6-89.2172.8-21.600109.5T197 V201T197-Q199 PolarHBondContact O-N 3.24Å; Q199-V201 PolarHBondContact O-N 2.91Å
200Q64.8Low60.2Low30 Ų3070.7 Ų70.714%0.1437%0.369CS..EExtended strand (participates in β ladder)trans-85.1107.7172.9-168.5164.98.500108.7L198 E229 N233 Y270L198-Q200 PolarHBondContact O-N 3.07Å; Q200-E229 PolarHBondContact NE2-OE1 3.38Å; Q200-N233 PolarHBondContact OE1-ND2 3.08Å; Q200-Y270 PolarHBondContact O-N 2.89Å
201V71.4Confident62.7Low8 Ų863 Ų635%0.04834%0.337CS..EExtended strand (participates in β ladder)trans-99.6118.4171.5-175.50000108.1F187 Q199 I203 Y270 I272 I340F187-V201 PolarHBondContact N-O 3.46Å; F187-V201 PolarHBondContact O-N 2.84Å; Q199-V201 PolarHBondContact O-N 2.91Å; V201-I203 HydrophobicContact CG1-CG1 4.45Å; V201-Y270 WeakPolarHBondContact CA-O 3.32Å; V201-I272 HydrophobicContact CG1-CD1 3.8Å; V201-I272 HydrophobicContact CG1-CG1 4.12Å; V201-I340 HydrophobicContact CG1-CD1 3.98Å; V201-I340 HydrophobicContact CG2-CD1 4.13Å
202K76.9Confident65.2Low7 Ų766 Ų663%0.0334%0.343CS..EExtended strand (participates in β ladder)trans-103.3128.4176.2-169.9179.7-167.5138.60110E184 I204 M225 E229 Y270 L271 I272E184-K202 WeakPolarHBondContact OE1-CE 3.49Å; E184-K202 IonicContact OE1-NZ 3.43Å; E184-K202 PolarHBondContact OE1-NZ 3.21Å; K202-I204 HydrophobicContact CD-CD1 4.04Å; K202-I204 HydrophobicContact CD-CG1 4.28Å; K202-I204 HydrophobicContact CG-CD1 4.49Å; K202-I204 HydrophobicContact CG-CG1 4.19Å; K202-M225 PolarHBondContact NZ-O 3.07Å; K202-E229 VanDerWaalsContact CD-OE2 3.29Å; K202-E229 WeakPolarHBondContact CD-OE2 3.25Å; K202-E229 WeakPolarHBondContact CE-OE2 3.2Å; K202-E229 IonicContact NZ-OE2 2.71Å; K202-E229 PolarHBondContact NZ-OE2 3.47Å; K202-Y270 PolarHBondContact N-O 2.95Å; K202-L271 HydrophobicContact CB-CD1 4.11Å; K202-L271 HydrophobicContact CD-CD1 4.23Å; K202-L271 HydrophobicContact CG-CD1 4.22Å; K202-I272 PolarHBondContact O-N 3.4Å
203I80.4Confident67.3Low10 Ų1060.4 Ų60.45%0.05132%0.319CS..EExtended strand (participates in β ladder)trans-111.3125177-51.6175.4000109.3M185 F187 V201 I272 V333 I337M185-I203 PolarHBondContact O-N 3.47Å; F187-I203 HydrophobicContact CD2-CD1 4.12Å; F187-I203 HydrophobicContact CE2-CD1 4.39Å; V201-I203 HydrophobicContact CG1-CG1 4.45Å; I203-I272 WeakPolarHBondContact CA-O 3.35Å; I203-I272 HydrophobicContact CG1-CB 4.22Å; I203-I272 HydrophobicContact CG1-CD1 4.28Å; I203-I272 HydrophobicContact CG2-CB 4.43Å; I203-V333 HydrophobicContact CD1-CG1 3.91Å; I203-V333 HydrophobicContact CG2-CG1 4.11Å; I203-I337 HydrophobicContact CD1-CD1 3.96Å
204I82.3Confident69.5Low1 Ų152.9 Ų52.91%0.00528%0.282CS..EExtended strand (participates in β ladder)trans-122.5104.8-175.6-74.1-167.6000107.6M182 K202 I206 L222 M225 L271 I272 L273 D274M182-I204 HydrophobicContact CE-CB 4.01Å; M182-I204 HydrophobicContact CE-CG2 3.12Å; M182-I204 WeakPolarHBondContact SD-CA 3.25Å; M182-I204 HydrophobicContact SD-CB 3.59Å; M182-I204 VanDerWaalsContact SD-CB 3.59Å; M182-I204 HydrophobicContact SD-CG1 3.91Å; M182-I204 HydrophobicContact SD-CG2 3.21Å; M182-I204 WeakPolarHBondContact SD-CG2 3.24Å; K202-I204 HydrophobicContact CD-CD1 4.04Å; K202-I204 HydrophobicContact CD-CG1 4.28Å; K202-I204 HydrophobicContact CG-CD1 4.49Å; K202-I204 HydrophobicContact CG-CG1 4.19Å; I204-I206 HydrophobicContact CG2-CG1 4.3Å; I204-L222 HydrophobicContact CD1-CD1 3.48Å; I204-L222 VanDerWaalsContact CD1-CD1 3.48Å; I204-L222 HydrophobicContact CG2-CD1 3.7Å; I204-M225 HydrophobicContact CD1-CE 4.39Å; I204-L271 HydrophobicContact CB-CD1 4.22Å; I204-L271 HydrophobicContact CD1-CD1 3.6Å; I204-L271 HydrophobicContact CG1-CD1 3.79Å; I204-I272 PolarHBondContact N-O 2.99Å; I204-L273 HydrophobicContact CB-CD2 4.24Å; I204-L273 HydrophobicContact CG2-CD2 3.58Å; I204-L273 CarbonylContact O-C 3.47Å; I204-L273 WeakPolarHBondContact O-CA 3.31Å; I204-D274 PolarHBondContact O-N 3.1Å
205S81.2Confident72Confident28 Ų2846 Ų4620%0.19625%0.246CC..EExtended strand (participates in β ladder)trans-95.6113.1-179.2-178.60000113.7M182 D274M182-S205 WeakPolarHBondContact CE-O 3.43Å; M182-S205 WeakPolarHBondContact CG-O 3.4Å; M182-S205 PolarHBondContact SD-N 3.5Å; S205-D274 WeakPolarHBondContact CB-OD2 3.43Å; S205-D274 PolarHBondContact OG-OD2 3.21Å
206I80.5Confident74.4Confident3 Ų349.2 Ų49.22%0.01525%0.247CC..  trans-97.4115.4-171.3-56.9166.7000109.8M182 I204 F218 L273 D274 G277 F278M182-I206 HydrophobicContact CE-CB 4.36Å; M182-I206 HydrophobicContact CE-CG1 3.58Å; I204-I206 HydrophobicContact CG2-CG1 4.3Å; I206-F218 HydrophobicContact CD1-CE2 3.57Å; I206-F218 HydrophobicContact CD1-CZ 3.51Å; I206-F218 HydrophobicContact CG1-CE2 4.04Å; I206-F218 HydrophobicContact CG1-CZ 4.46Å; I206-F218 HydrophobicContact CG2-CE2 4.06Å; I206-L273 HydrophobicContact CD1-CD2 3.51Å; I206-L273 HydrophobicContact CG1-CD2 4.38Å; I206-D274 PolarHBondContact N-O 3.34Å; I206-G277 WeakPolarHBondContact O-CA 3.45Å; I206-G277 PolarHBondContact O-N 2.95Å; I206-F278 HydrophobicContact CB-CE1 4.27Å; I206-F278 HydrophobicContact CB-CZ 4.29Å; I206-F278 HydrophobicContact CD1-CE1 4.33Å; I206-F278 HydrophobicContact CD1-CE2 4.22Å; I206-F278 HydrophobicContact CD1-CZ 3.63Å; I206-F278 HydrophobicContact CG2-CD1 4.11Å; I206-F278 HydrophobicContact CG2-CE1 3.47Å; I206-F278 VanDerWaalsContact CG2-CE1 3.47Å; I206-F278 HydrophobicContact CG2-CZ 3.9Å
207N76.3Confident76.5Confident104 Ų10444.4 Ų44.456%0.55622%0.224SC*.  trans-102.814.7-174.8-78.7-10.1000115.5
208N78.6Confident78.8Confident12 Ų1240.5 Ų40.56%0.06420%0.199CC..SBendtrans-129.8148.3-170.7-58.8-31.3000112.3M175 S178 G277 F278M175-N208 HydrophobicContact CB-CB 4.4Å; M175-N208 HydrophobicContact CG-CB 4.35Å; M175-N208 PolarHBondContact O-ND2 3.01Å; M175-N208 HydrophobicContact SD-CB 3.6Å; M175-N208 PolarHBondContact SD-OD1 3.1Å; S178-N208 VanDerWaalsContact CB-ND2 3.3Å; S178-N208 WeakPolarHBondContact CB-ND2 3.48Å; S178-N208 WeakPolarHBondContact CB-OD1 3.33Å; S178-N208 PolarHBondContact OG-ND2 3.18Å; S178-N208 VanDerWaalsContact OG-ND2 3.13Å; S178-N208 PolarHBondContact OG-OD1 2.93Å; N208-G277 CarbonylContact C-O 3.56Å; N208-G277 VanDerWaalsContact C-O 3.29Å; N208-G277 PolarHBondContact N-O 3.05Å; N208-F278 VanDerWaalsContact O-CD1 3.23Å; N208-F278 WeakPolarHBondContact O-CD1 3.2Å
209P86.3Confident80.7Confident21 Ų2139.5 Ų39.514%0.13619%0.191CC..  trans-62.2148.1169.728.6-35000110.9F171 M175 N214 F280F171-P209 HydrophobicContact CZ-CG 4.22Å; M175-P209 HydrophobicContact CE-CG 4.31Å; P209-N214 PolarHBondContact O-ND2 3.31Å; P209-F280 CarbonylContact C-O 3.55Å; P209-F280 WeakPolarHBondContact CA-O 3.27Å; P209-F280 HydrophobicContact CB-CB 4.16Å; P209-F280 WeakPolarHBondContact CB-O 3.44Å
210L86.6Confident82.1Confident3 Ų340.5 Ų40.52%0.01620%0.2CC..BIsolated β-bridgetrans-113.799.2-176.9-170.564.4000110.7F218 F278 F280 F281 D282 G285 L289L210-F218 HydrophobicContact CD1-CB 3.86Å; L210-F218 HydrophobicContact CD1-CD1 3.65Å; L210-F218 HydrophobicContact CD1-CD2 4.22Å; L210-F218 HydrophobicContact CD1-CE1 4.26Å; L210-F218 HydrophobicContact CD1-CG 3.63Å; L210-F218 HydrophobicContact CD2-CD1 4.46Å; L210-F218 HydrophobicContact CD2-CE1 4.36Å; L210-F278 HydrophobicContact CB-CD1 3.82Å; L210-F278 HydrophobicContact CB-CE1 3.61Å; L210-F278 HydrophobicContact CB-CZ 4.43Å; L210-F278 HydrophobicContact CD2-CE1 3.99Å; L210-F278 HydrophobicContact CD2-CZ 4Å; L210-F278 HydrophobicContact CG-CE1 4.27Å; L210-F280 PolarHBondContact N-O 3.22Å; L210-F281 WeakPolarHBondContact O-CA 3.41Å; L210-F281 WeakPolarHBondContact O-CB 3.37Å; L210-D282 PolarHBondContact O-N 3.26Å; L210-G285 WeakPolarHBondContact CD2-O 3.49Å; L210-L289 HydrophobicContact CD2-CB 4.06Å
211V88Confident83Confident16 Ų1640.2 Ų40.210%0.09720%0.199CC..  trans-127.3167.5-174.7-64.80000111F171 L213 N214 A215 F280 D282F171-V211 HydrophobicContact CE1-CG2 3.65Å; F171-V211 HydrophobicContact CZ-CG2 4.26Å; V211-L213 HydrophobicContact CG2-CB 4.1Å; V211-L213 PolarHBondContact O-N 2.66Å; V211-N214 WeakPolarHBondContact CG2-OD1 3.16Å; V211-N214 PolarHBondContact N-OD1 3.39Å; V211-N214 PolarHBondContact O-N 3.4Å; V211-N214 PolarHBondContact O-OD1 3.36Å; V211-A215 WeakPolarHBondContact O-CB 3.32Å; V211-A215 PolarHBondContact O-N 3.21Å; V211-F280 HydrophobicContact CG1-CD1 3.52Å; V211-F280 HydrophobicContact CG1-CE1 3.69Å; V211-D282 WeakPolarHBondContact CA-OD1 3.31Å; V211-D282 WeakPolarHBondContact CA-OD2 3.47Å
212F87.5Confident83.6Confident144 Ų14439.9 Ų39.963%0.63220%0.197SC*.Hα-helixtrans-46.8-39.2177.2172.3-103.2000113.1N214 D282 S284F212-N214 VanDerWaalsContact C-N 3.28Å; F212-N214 PolarHBondContact O-N 2.95Å; F212-D282 WeakPolarHBondContact CB-OD2 3.33Å; F212-D282 VanDerWaalsContact N-CG 3.32Å; F212-D282 PolarHBondContact N-OD1 3.32Å; F212-D282 PolarHBondContact N-OD2 3.12Å; F212-S284 WeakPolarHBondContact CD2-OG 3.41Å
213L84.1Confident83.9Confident78 Ų7839.9 Ų39.941%0.40820%0.197SC..Hα-helixtrans-61.8-30.7-179-65177000113.8I168 F171 P172 V211I168-L213 HydrophobicContact CG2-CD2 4.1Å; F171-L213 HydrophobicContact CD1-CB 4.08Å; F171-L213 HydrophobicContact CD1-CD1 3.89Å; F171-L213 HydrophobicContact CE1-CB 4.42Å; F171-L213 HydrophobicContact CE1-CD1 4.33Å; F171-L213 HydrophobicContact CG-CD1 4.46Å; P172-L213 HydrophobicContact CG-CB 4.3Å; P172-L213 VanDerWaalsContact CG-O 3.3Å; P172-L213 WeakPolarHBondContact CG-O 3.39Å; V211-L213 HydrophobicContact CG2-CB 4.1Å; V211-L213 PolarHBondContact O-N 2.66Å
214N84.5Confident84.1Confident6 Ų643.4 Ų43.43%0.03222%0.216CC..Hα-helixtrans-120-10.7-176.567.4-20.9000114.7P209 V211 F212 K216 K217 F218P209-N214 PolarHBondContact O-ND2 3.31Å; V211-N214 WeakPolarHBondContact CG2-OD1 3.16Å; V211-N214 PolarHBondContact N-OD1 3.39Å; V211-N214 PolarHBondContact O-N 3.4Å; V211-N214 PolarHBondContact O-OD1 3.36Å; F212-N214 VanDerWaalsContact C-N 3.28Å; F212-N214 PolarHBondContact O-N 2.95Å; N214-K216 PolarHBondContact O-N 3.21Å; N214-K217 PolarHBondContact O-N 3.25Å; N214-K217 VanDerWaalsContact O-N 3.08Å; N214-F218 WeakPolarHBondContact O-CB 3.26Å; N214-F218 PolarHBondContact O-N 3.09Å
215A85.9Confident83.8Confident7 Ų745.4 Ų45.46%0.05823%0.226CC..Hα-helixtrans-49.9-54.5-175.800000113.7V211 K217 F218 Y219 M288V211-A215 WeakPolarHBondContact O-CB 3.32Å; V211-A215 PolarHBondContact O-N 3.21Å; A215-K217 VanDerWaalsContact C-N 3.26Å; A215-K217 PolarHBondContact O-N 3.39Å; A215-F218 WeakPolarHBondContact O-CB 3.49Å; A215-F218 PolarHBondContact O-N 3.05Å; A215-Y219 PolarHBondContact O-N 3.28Å; A215-M288 HydrophobicContact CB-CB 3.99Å; A215-M288 HydrophobicContact CB-CG 4.09Å; A215-M288 WeakPolarHBondContact O-CG 3.35Å
216K86.7Confident83.7Confident170 Ų17044.7 Ų44.774%0.73922%0.22SC*.Hα-helixtrans-58.9-39-179.8-176.5173.5-176.1172.90112.9N214 T220N214-K216 PolarHBondContact O-N 3.21Å; K216-T220 PolarHBondContact O-N 2.92Å; K216-T220 VanDerWaalsContact O-N 3.13Å; K216-T220 PolarHBondContact O-OG1 3.5Å
217K83.3Confident83.5Confident83 Ų8348.6 Ų48.636%0.36124%0.238SC..Hα-helixtrans-74.7-40.3-178.5-166.8163.2-174-162.60111.4T176 N214 A215 Y219 T220 D221T176-K217 HydrophobicContact CG2-CD 4.42Å; T176-K217 VanDerWaalsContact CG2-CE 3.48Å; T176-K217 WeakPolarHBondContact OG1-CD 3.37Å; T176-K217 WeakPolarHBondContact OG1-CE 3.23Å; T176-K217 PolarHBondContact OG1-NZ 3.04Å; N214-K217 PolarHBondContact O-N 3.25Å; N214-K217 VanDerWaalsContact O-N 3.08Å; A215-K217 VanDerWaalsContact C-N 3.26Å; A215-K217 PolarHBondContact O-N 3.39Å; K217-Y219 VanDerWaalsContact C-N 3.33Å; K217-Y219 PolarHBondContact O-N 3.31Å; K217-T220 PolarHBondContact O-N 3.48Å; K217-D221 WeakPolarHBondContact O-CB 3.33Å; K217-D221 VanDerWaalsContact O-CG 3.32Å; K217-D221 PolarHBondContact O-N 3.37Å
218F85Confident83Confident6 Ų651.8 Ų51.83%0.02625%0.247CC..Hα-helixtrans-54.6-48.3171.5169.2-95.1000111.5I179 I206 L210 N214 A215 T220 D221 L222 F278 L289 V292I179-F218 HydrophobicContact CD1-CB 4.19Å; I179-F218 HydrophobicContact CD1-CD2 3.81Å; I179-F218 HydrophobicContact CD1-CG 4.49Å; I206-F218 HydrophobicContact CD1-CE2 3.57Å; I206-F218 HydrophobicContact CD1-CZ 3.51Å; I206-F218 HydrophobicContact CG1-CE2 4.04Å; I206-F218 HydrophobicContact CG1-CZ 4.46Å; I206-F218 HydrophobicContact CG2-CE2 4.06Å; L210-F218 HydrophobicContact CD1-CB 3.86Å; L210-F218 HydrophobicContact CD1-CD1 3.65Å; L210-F218 HydrophobicContact CD1-CD2 4.22Å; L210-F218 HydrophobicContact CD1-CE1 4.26Å; L210-F218 HydrophobicContact CD1-CG 3.63Å; L210-F218 HydrophobicContact CD2-CD1 4.46Å; L210-F218 HydrophobicContact CD2-CE1 4.36Å; N214-F218 WeakPolarHBondContact O-CB 3.26Å; N214-F218 PolarHBondContact O-N 3.09Å; A215-F218 WeakPolarHBondContact O-CB 3.49Å; A215-F218 PolarHBondContact O-N 3.05Å; F218-T220 PolarHBondContact O-N 3.13Å; F218-D221 PolarHBondContact O-N 3.23Å; F218-L222 HydrophobicContact CE1-CD2 4.02Å; F218-L222 HydrophobicContact CZ-CD2 3.86Å; F218-L222 VanDerWaalsContact O-CB 3.25Å; F218-L222 WeakPolarHBondContact O-CB 3.47Å; F218-L222 PolarHBondContact O-N 3.07Å; F218-F278 HydrophobicContact CZ-CZ 4.36Å; F218-L289 HydrophobicContact CE1-CD1 4.44Å; F218-V292 HydrophobicContact CE1-CG2 4.4Å
219Y87.3Confident82Confident55 Ų5552.3 Ų52.322%0.21625%0.249CC..Hα-helixtrans-58.6-49.4175.3172.5-91.6000112.3A215 K217 D221 L222 M223 M288 E291 V292 D295A215-Y219 PolarHBondContact O-N 3.28Å; K217-Y219 VanDerWaalsContact C-N 3.33Å; K217-Y219 PolarHBondContact O-N 3.31Å; Y219-D221 VanDerWaalsContact C-N 3.35Å; Y219-D221 PolarHBondContact O-N 3.17Å; Y219-L222 PolarHBondContact O-N 2.96Å; Y219-M223 HydrophobicContact CD1-CG 4.24Å; Y219-M223 HydrophobicContact CD2-CG 4Å; Y219-M223 HydrophobicContact CE1-CG 3.97Å; Y219-M223 HydrophobicContact CE2-CG 3.76Å; Y219-M223 HydrophobicContact CE2-SD 4.34Å; Y219-M223 HydrophobicContact CG-CG 4.26Å; Y219-M223 WeakPolarHBondContact O-CB 3.43Å; Y219-M223 VanDerWaalsContact O-CG 3.24Å; Y219-M223 WeakPolarHBondContact O-CG 3.44Å; Y219-M223 PolarHBondContact O-N 3.07Å; Y219-M288 WeakPolarHBondContact CB-SD 2.99Å; Y219-M288 HydrophobicContact CD1-CE 4.34Å; Y219-M288 HydrophobicContact CD2-CE 3.14Å; Y219-M288 HydrophobicContact CD2-SD 4.18Å; Y219-M288 HydrophobicContact CE2-CE 3.83Å; Y219-M288 HydrophobicContact CG-CE 3.44Å; Y219-M288 VanDerWaalsContact CG-CE 3.44Å; Y219-M288 HydrophobicContact CG-SD 3.91Å; Y219-E291 HydrophobicContact CE2-CG 4.48Å; Y219-V292 HydrophobicContact CD2-CG2 3.6Å; Y219-V292 HydrophobicContact CE2-CG2 4.33Å; Y219-D295 VanDerWaalsContact CE2-OD2 3.3Å; Y219-D295 WeakPolarHBondContact CE2-OD2 3.3Å; Y219-D295 VanDerWaalsContact CZ-OD2 3.32Å; Y219-D295 PolarHBondContact OH-OD2 3.42Å
220T86.8Confident80.5Confident59 Ų5955.6 Ų55.636%0.36227%0.265SS..Hα-helixtrans-60.9-45.1-178.6-53.10000111.3K216 K217 F218 N224K216-T220 PolarHBondContact O-N 2.92Å; K216-T220 VanDerWaalsContact O-N 3.13Å; K216-T220 PolarHBondContact O-OG1 3.5Å; K217-T220 PolarHBondContact O-N 3.48Å; F218-T220 PolarHBondContact O-N 3.13Å; T220-N224 VanDerWaalsContact O-CB 3.29Å; T220-N224 WeakPolarHBondContact O-CB 3.45Å; T220-N224 PolarHBondContact O-N 3.35Å; T220-N224 PolarHBondContact O-ND2 3.38Å
221D83.6Confident78.3Confident24 Ų2458.9 Ų58.913%0.12829%0.293CS..Hα-helixtrans-65.9-44179.6-69.8-28.7000111.4T176 I179 K217 F218 Y219 N224 M225T176-D221 WeakPolarHBondContact CG2-OD2 3.33Å; I179-D221 HydrophobicContact CG2-CB 3.98Å; K217-D221 WeakPolarHBondContact O-CB 3.33Å; K217-D221 VanDerWaalsContact O-CG 3.32Å; K217-D221 PolarHBondContact O-N 3.37Å; F218-D221 PolarHBondContact O-N 3.23Å; Y219-D221 VanDerWaalsContact C-N 3.35Å; Y219-D221 PolarHBondContact O-N 3.17Å; D221-N224 PolarHBondContact O-N 3.49Å; D221-M225 WeakPolarHBondContact O-CG 3.35Å; D221-M225 PolarHBondContact O-N 2.97Å
222L83.5Confident75.6Confident1 Ų163 Ų631%0.00532%0.321CS..Hα-helixtrans-64.7-46.7178.9-176.660.4000111.7I204 F218 Y219 N224 M225 I226 L273 V292I204-L222 HydrophobicContact CD1-CD1 3.48Å; I204-L222 VanDerWaalsContact CD1-CD1 3.48Å; I204-L222 HydrophobicContact CG2-CD1 3.7Å; F218-L222 HydrophobicContact CE1-CD2 4.02Å; F218-L222 HydrophobicContact CZ-CD2 3.86Å; F218-L222 VanDerWaalsContact O-CB 3.25Å; F218-L222 WeakPolarHBondContact O-CB 3.47Å; F218-L222 PolarHBondContact O-N 3.07Å; Y219-L222 PolarHBondContact O-N 2.96Å; L222-N224 VanDerWaalsContact C-N 3.33Å; L222-N224 PolarHBondContact O-N 3.36Å; L222-M225 HydrophobicContact CD1-CE 4.3Å; L222-M225 PolarHBondContact O-N 2.8Å; L222-M225 VanDerWaalsContact O-N 3.16Å; L222-I226 HydrophobicContact CD1-CD1 4.37Å; L222-I226 HydrophobicContact CG-CD1 4.1Å; L222-I226 WeakPolarHBondContact O-CG1 3.31Å; L222-I226 PolarHBondContact O-N 3.36Å; L222-L273 HydrophobicContact CD1-CD2 4.28Å; L222-L273 HydrophobicContact CD2-CD2 4.08Å; L222-V292 HydrophobicContact CD2-CB 4.43Å; L222-V292 HydrophobicContact CD2-CG1 3.47Å; L222-V292 VanDerWaalsContact CD2-CG1 3.47Å; L222-V292 HydrophobicContact CD2-CG2 4.05Å
223M84.7Confident73.2Confident6 Ų659.9 Ų59.93%0.0331%0.311CS..Hα-helixtrans-65-36.8177.9-67.9-57.5-80.700111.9Y219 I226 Q227 D295Y219-M223 HydrophobicContact CD1-CG 4.24Å; Y219-M223 HydrophobicContact CD2-CG 4Å; Y219-M223 HydrophobicContact CE1-CG 3.97Å; Y219-M223 HydrophobicContact CE2-CG 3.76Å; Y219-M223 HydrophobicContact CE2-SD 4.34Å; Y219-M223 HydrophobicContact CG-CG 4.26Å; Y219-M223 WeakPolarHBondContact O-CB 3.43Å; Y219-M223 VanDerWaalsContact O-CG 3.24Å; Y219-M223 WeakPolarHBondContact O-CG 3.44Å; Y219-M223 PolarHBondContact O-N 3.07Å; M223-I226 PolarHBondContact O-N 2.82Å; M223-I226 HydrophobicContact SD-CD1 4.19Å; M223-Q227 WeakPolarHBondContact O-CB 3.38Å; M223-Q227 VanDerWaalsContact O-CG 3.23Å; M223-Q227 WeakPolarHBondContact O-CG 3.3Å; M223-Q227 PolarHBondContact O-N 3.17Å; M223-D295 HydrophobicContact CE-CB 4.04Å
224N83.2Confident70.5Confident85 Ų8563.7 Ų63.746%0.45533%0.327SS..Hα-helixtrans-63.9-39.3172.9-74.2-25.2000112T220 D221 L222 I226 Q227 K228T220-N224 VanDerWaalsContact O-CB 3.29Å; T220-N224 WeakPolarHBondContact O-CB 3.45Å; T220-N224 PolarHBondContact O-N 3.35Å; T220-N224 PolarHBondContact O-ND2 3.38Å; D221-N224 PolarHBondContact O-N 3.49Å; L222-N224 VanDerWaalsContact C-N 3.33Å; L222-N224 PolarHBondContact O-N 3.36Å; N224-I226 VanDerWaalsContact C-N 3.33Å; N224-Q227 PolarHBondContact O-N 3.13Å; N224-K228 WeakPolarHBondContact O-CB 3.35Å; N224-K228 PolarHBondContact O-N 2.83Å
225M77.4Confident67.8Low43 Ų4368.1 Ų68.121%0.21236%0.356CS..Hα-helixtrans-66.9-33.5176-73.2-164.7-66.400112.8I179 M182 K202 I204 D221 L222I179-M225 HydrophobicContact CG2-CE 3.87Å; M182-M225 HydrophobicContact SD-CE 4.12Å; K202-M225 PolarHBondContact NZ-O 3.07Å; I204-M225 HydrophobicContact CD1-CE 4.39Å; D221-M225 WeakPolarHBondContact O-CG 3.35Å; D221-M225 PolarHBondContact O-N 2.97Å; L222-M225 HydrophobicContact CD1-CE 4.3Å; L222-M225 PolarHBondContact O-N 2.8Å; L222-M225 VanDerWaalsContact O-N 3.16Å
226I77.9Confident65.2Low13 Ų1375.6 Ų75.67%0.06739%0.394CS..Hα-helixtrans-73-38.8174.9-63.6163.7000110.4L222 M223 N224 L271L222-I226 HydrophobicContact CD1-CD1 4.37Å; L222-I226 HydrophobicContact CG-CD1 4.1Å; L222-I226 WeakPolarHBondContact O-CG1 3.31Å; L222-I226 PolarHBondContact O-N 3.36Å; M223-I226 PolarHBondContact O-N 2.82Å; M223-I226 HydrophobicContact SD-CD1 4.19Å; N224-I226 VanDerWaalsContact C-N 3.33Å; I226-L271 HydrophobicContact CD1-CD2 3.75Å; I226-L271 HydrophobicContact CG1-CD2 4.29Å
227Q76.2Confident62.4Low84 Ų8473.9 Ų73.939%0.39339%0.393SS..Hα-helixtrans-74.6-37.6-178-74.3175.718.800114.3M223 N224 E229 N230 A231M223-Q227 WeakPolarHBondContact O-CB 3.38Å; M223-Q227 VanDerWaalsContact O-CG 3.23Å; M223-Q227 WeakPolarHBondContact O-CG 3.3Å; M223-Q227 PolarHBondContact O-N 3.17Å; N224-Q227 PolarHBondContact O-N 3.13Å; Q227-E229 PolarHBondContact O-N 3.25Å; Q227-N230 PolarHBondContact O-N 3.41Å; Q227-A231 PolarHBondContact O-N 3.23Å
228K66.7Low60Low172 Ų17276.6 Ų76.675%0.74841%0.411SS*.Hα-helixtrans-62.2-26.4-176.3-168178.2177.9-169.50112.9N224N224-K228 WeakPolarHBondContact O-CB 3.35Å; N224-K228 PolarHBondContact O-N 2.83Å
229E57.2Low57.6Low23 Ų2384.2 Ų84.211%0.10745%0.451CS..Hα-helixtrans-84.1-37.7-178.1-144.8179.9172.100112.1E186 Q200 K202 Q227 A231 C232 N233E186-E229 VanDerWaalsContact OE1-OE1 3.1Å; Q200-E229 PolarHBondContact NE2-OE1 3.38Å; K202-E229 VanDerWaalsContact CD-OE2 3.29Å; K202-E229 WeakPolarHBondContact CD-OE2 3.25Å; K202-E229 WeakPolarHBondContact CE-OE2 3.2Å; K202-E229 IonicContact NZ-OE2 2.71Å; K202-E229 PolarHBondContact NZ-OE2 3.47Å; Q227-E229 PolarHBondContact O-N 3.25Å; E229-A231 PolarHBondContact O-N 2.78Å; E229-C232 PolarHBondContact O-N 3.24Å; E229-N233 PolarHBondContact O-N 2.98Å
230N54.8Low55.1Low90 Ų9086.4 Ų86.448%0.48147%0.474SS..Hα-helixtrans-60.8-29.1174.2-71.1-14.7000112.6Q227Q227-N230 PolarHBondContact O-N 3.41Å
231A39.4Very low52.4Low72 Ų7292.7 Ų92.760%0.59550%0.496SS*.THydrogen-bonded Turntrans-76.9-23.6173.100000113.4Q227 E229Q227-A231 PolarHBondContact O-N 3.23Å; E229-A231 PolarHBondContact O-N 2.78Å
232C31.1Very low49.9Very low103 Ų10397.4 Ų97.470%0.69653%0.53SS*.THydrogen-bonded Turntrans-85.7-12.1179.9-160.80000113E229E229-C232 PolarHBondContact O-N 3.24Å
233N37.3Very low47.5Very low77 Ų77106.1 Ų106.141%0.41257%0.571SS.*THydrogen-bonded Turntrans-94.46.2177.8-73.9-19000113.7Q200 E229Q200-N233 PolarHBondContact OE1-ND2 3.08Å; E229-N233 PolarHBondContact O-N 2.98Å
234Q27.2Very low45Very low158 Ų158114.4 Ų114.474%0.73861%0.609SS**SBendtrans-72.1123.3162-79.3-175.6-2500108.2L236Q234-L236 PolarHBondContact O-N 3.36Å
235P29.2Very low42.6Very low99 Ų99117.7 Ų117.764%0.64363%0.627SS**  trans-60.3131.2174.413.3-11.6000108.4D237P235-D237 PolarHBondContact O-N 3.21Å
236L30.4Very low40.6Very low164 Ų164121.7 Ų121.786%0.85965%0.654SS**  trans-74.567.5172.6-138.7145.6000107.1Q234 D238Q234-L236 PolarHBondContact O-N 3.36Å; L236-D238 PolarHBondContact O-N 3.22Å
237D28.4Very low38.5Very low134 Ų134129 Ų12972%0.71769%0.692SS**  trans-78.7105.2174.8-77.5-18.8000108.8P235P235-D237 PolarHBondContact O-N 3.21Å
238D32.3Very low36.7Very low140 Ų140132.1 Ų132.175%0.74971%0.711SS**  trans52.668155-71.3-22.6000119.2L236 S240L236-D238 PolarHBondContact O-N 3.22Å; D238-S240 PolarHBondContact O-N 2.72Å
239I35Very low35.1Very low167 Ų167131.4 Ų131.486%0.85672%0.715SS**SBendtrans-92.671.5149.4-53.2177.7000108.7
240S34.2Very low34Very low101 Ų101135.6 Ų135.671%0.70675%0.747SS**SBendtrans-154.88.5159.668.30000116.7D238D238-S240 PolarHBondContact O-N 2.72Å
241K29.8Very low33.1Very low191 Ų191139.6 Ų139.683%0.8377%0.767SS**SBendtrans-146.460.5171-71.8-172.2-178.9170.80113.7
242C32.6Very low32.7Very low122 Ų122141.8 Ų141.882%0.82478%0.779SS**  trans-152.141.6162-101.60000112.7
243E31.7Very low32.8Very low185 Ų185145.2 Ų145.286%0.86479%0.79SS**SBendtrans-118.761.6160.5-81-171.8139.900109
244Q33.8Very low32.4Very low179 Ų179144.7 Ų144.784%0.83680%0.803SS**SBendtrans-1560.3162.9-143.4107.234.800116.7
245N32Very low32.4Very low154 Ų154144.4 Ų144.482%0.82481%0.806SS**  trans-128.732.2-177.5-72.9-33.7000114.1
246T35.2Very low32.1Very low127 Ų127145.7 Ų145.778%0.77982%0.816SS**SBendtrans-100.135.8172.6-26.30000112.2
247L35.1Very low31.8Very low166 Ų166144 Ų14487%0.86981%0.808SS**SBendtrans-1414.5172.2-86.8-173.7000116.5
248L38.3Very low31.5Very low151 Ų151146.2 Ų146.279%0.79181%0.814SS**SBendtrans-14597.1170.8-78.6173.7000110.4
249N33.2Very low31Very low156 Ų156148.3 Ų148.383%0.83482%0.819SS**  trans165.162137.5-79.6-15.8000110.5
250S33.6Very low30.5Very low112 Ų112145 Ų14578%0.78382%0.817SS**  trans-69.8122143.5460000107.6
251L35.9Very low30Very low173 Ų173146 Ų14691%0.90682%0.823SS**  trans111.581.8176.6-61.1161000114.2
252S30.3Very low29.7Very low119 Ų119145.8 Ų145.883%0.83283%0.826SS**  trans-156.9121.4134.8-167.90000109.9
253N33.8Very low29.3Very low175 Ų175145.4 Ų145.494%0.93682%0.824SS**  trans-81.4119.2172.3-156.526.3000106.8
254G27.5Very low29Very low66 Ų66142.3 Ų142.368%0.6882%0.822SS**  trans-162.8115-17700000112.3
255N27.8Very low29Very low152 Ų152139.6 Ų139.681%0.81382%0.819SS**  trans-76.9126.1178-15946.6000109.9
256C23.6Very low29.4Very low125 Ų125139.5 Ų139.585%0.84582%0.819SS**  trans-142.4120.3164-73.30000110.3
257N22.9Very low30.3Very low128 Ų128140.6 Ų140.668%0.68482%0.815SS**  trans-75163.9165.6-69.5-25000110.7
258E23Very low31.6Very low182 Ų182138.4 Ų138.485%0.8580%0.799SS**  trans70.7127.4162.8-65.6161.7-16600113.9
259E21.9Very low33.3Very low184 Ų184132.8 Ų132.886%0.8677%0.772SS**  cis-146.6145.335.3-66.5173.4148.900110.6S261E259-S261 PolarHBondContact O-N 3.14Å
260A23.9Very low35.7Very low97 Ų97126.1 Ų126.180%0.80274%0.735SS**  trans-66.3113.8168.800000109.3Q262A260-Q262 PolarHBondContact O-N 3.48Å
261S24.2Very low38.2Very low121 Ų121121 Ų12185%0.84670%0.698SS**  trans-63.9101.6170.254.80000109.6E259 S263E259-S261 PolarHBondContact O-N 3.14Å; S261-S263 PolarHBondContact O-N 3.4Å
262Q24.4Very low40.6Very low188 Ų188112.7 Ų112.788%0.87966%0.655SS**PPolyproline II helixtrans-49.8124.6170.8-106.5159.5-25.700111.3A260A260-Q262 PolarHBondContact O-N 3.48Å
263S24.2Very low43.3Very low114 Ų114107.1 Ų107.180%0.79762%0.616SS**PPolyproline II helixtrans-69.1129.4168.857.30000110.5S261S261-S263 PolarHBondContact O-N 3.4Å
264C23.8Very low45.9Very low120 Ų12099.6 Ų99.681%0.81158%0.576SS**PPolyproline II helixtrans-55.2148.6173.2-61.90000112.3
265P33.5Very low48.7Very low121 Ų12196.6 Ų96.679%0.78654%0.544SS*.PPolyproline II helixtrans-75.8141.1-171.928.6-29.6000113.1E267P265-E267 PolarHBondContact O-N 2.97Å
266N41.3Very low51.4Low152 Ų15292.4 Ų92.481%0.81353%0.527SS*.  trans-29.9103.1177.2-86.7-28.2000116.4K268N266-K268 PolarHBondContact O-N 3.42Å
267E54.8Low54Low150 Ų15086.9 Ų86.970%0.70149%0.491SS*.  trans-77115.2162.3-69.9-172.6152.700110P265 C269P265-E267 PolarHBondContact O-N 2.97Å; E267-C269 PolarHBondContact O-N 3.48Å
268K62.2Low56.9Low120 Ų12081.1 Ų81.152%0.52246%0.46SS..  trans-77.4119.9174.6-75-179-179.3170.40110.5N266N266-K268 PolarHBondContact O-N 3.42Å
269C74.6Confident59.7Low33 Ų3378.2 Ų78.222%0.22346%0.455CS..EExtended strand (participates in β ladder)trans-91.5136.5173.6-177.80000110.5E267 V301 D302E267-C269 PolarHBondContact O-N 3.48Å; C269-V301 HydrophobicContact CB-CG1 4.43Å; C269-V301 HydrophobicContact CB-CG2 4.27Å; C269-V301 WeakPolarHBondContact O-CA 3.29Å; C269-D302 PolarHBondContact O-N 3.44Å
270Y82.8Confident62.7Low17 Ų1775.5 Ų75.57%0.06744%0.44CS..EExtended strand (participates in β ladder)trans-110.7131.3176-73.4-83.6000110.7Q200 V201 K202 D302 L304 I340Q200-Y270 PolarHBondContact O-N 2.89Å; V201-Y270 WeakPolarHBondContact CA-O 3.32Å; K202-Y270 PolarHBondContact N-O 2.95Å; Y270-D302 WeakPolarHBondContact CA-O 3.43Å; Y270-D302 HydrophobicContact CD1-CB 3.52Å; Y270-D302 HydrophobicContact CE1-CB 3.48Å; Y270-D302 VanDerWaalsContact CE1-CB 3.48Å; Y270-D302 HydrophobicContact CG-CB 4.47Å; Y270-L304 HydrophobicContact CD1-CD1 4.05Å; Y270-I340 HydrophobicContact CD1-CD1 4.07Å; Y270-I340 HydrophobicContact CD1-CG1 3.89Å; Y270-I340 HydrophobicContact CD2-CD1 4.49Å; Y270-I340 HydrophobicContact CD2-CG2 3.84Å; Y270-I340 HydrophobicContact CE1-CG1 4.23Å; Y270-I340 HydrophobicContact CE2-CG2 3.85Å; Y270-I340 HydrophobicContact CG-CD1 3.88Å; Y270-I340 HydrophobicContact CG-CG1 4.06Å; Y270-I340 HydrophobicContact CG-CG2 4.22Å
271L85.6Confident65.8Low3 Ų373 Ų732%0.01641%0.411CS..EExtended strand (participates in β ladder)trans-114.3118.4174.5175.664.6000110.2K202 I204 I226 L273 V301 D302 V303 L304K202-L271 HydrophobicContact CB-CD1 4.11Å; K202-L271 HydrophobicContact CD-CD1 4.23Å; K202-L271 HydrophobicContact CG-CD1 4.22Å; I204-L271 HydrophobicContact CB-CD1 4.22Å; I204-L271 HydrophobicContact CD1-CD1 3.6Å; I204-L271 HydrophobicContact CG1-CD1 3.79Å; I226-L271 HydrophobicContact CD1-CD2 3.75Å; I226-L271 HydrophobicContact CG1-CD2 4.29Å; L271-L273 HydrophobicContact CD2-CD1 4.43Å; L271-L273 HydrophobicContact CD2-CG 4.42Å; L271-L273 HydrophobicContact CG-CG 4.41Å; L271-V301 HydrophobicContact CB-CG1 3.79Å; L271-D302 PolarHBondContact N-O 2.93Å; L271-V303 HydrophobicContact CB-CG2 4.36Å; L271-V303 HydrophobicContact CD2-CG2 4.26Å; L271-V303 CarbonylContact O-C 3.52Å; L271-V303 WeakPolarHBondContact O-CA 3.49Å; L271-L304 PolarHBondContact O-N 3.02Å
272I86.4Confident69Low0 Ų069.5 Ų69.50%038%0.383CS..EExtended strand (participates in β ladder)trans-100.6115.8173.5-54.2179000109.1V201 K202 I203 I204 L304 A306 V333 A336 I337 I340V201-I272 HydrophobicContact CG1-CD1 3.8Å; V201-I272 HydrophobicContact CG1-CG1 4.12Å; K202-I272 PolarHBondContact O-N 3.4Å; I203-I272 WeakPolarHBondContact CA-O 3.35Å; I203-I272 HydrophobicContact CG1-CB 4.22Å; I203-I272 HydrophobicContact CG1-CD1 4.28Å; I203-I272 HydrophobicContact CG2-CB 4.43Å; I204-I272 PolarHBondContact N-O 2.99Å; I272-L304 CarbonylContact C-O 3.57Å; I272-L304 WeakPolarHBondContact CA-O 3.48Å; I272-L304 HydrophobicContact CG1-CB 4.36Å; I272-L304 HydrophobicContact CG1-CD1 4.18Å; I272-A306 HydrophobicContact CG2-CB 4.16Å; I272-V333 HydrophobicContact CG2-CG1 4.32Å; I272-A336 HydrophobicContact CD1-CB 4.07Å; I272-A336 HydrophobicContact CG1-CB 4.5Å; I272-A336 HydrophobicContact CG2-CB 4.24Å; I272-I337 HydrophobicContact CD1-CG1 3.59Å; I272-I340 HydrophobicContact CD1-CD1 3.98Å; I272-I340 HydrophobicContact CG1-CD1 4.37Å
273L88.1Confident72.1Confident1 Ų168.4 Ų68.41%0.00537%0.372CS..EExtended strand (participates in β ladder)trans-95.4105.5173.2-77.8157.1000109.2I204 I206 L222 L271 C275 V303 L304 L305 A306I204-L273 HydrophobicContact CB-CD2 4.24Å; I204-L273 HydrophobicContact CG2-CD2 3.58Å; I204-L273 CarbonylContact O-C 3.47Å; I204-L273 WeakPolarHBondContact O-CA 3.31Å; I206-L273 HydrophobicContact CD1-CD2 3.51Å; I206-L273 HydrophobicContact CG1-CD2 4.38Å; L222-L273 HydrophobicContact CD1-CD2 4.28Å; L222-L273 HydrophobicContact CD2-CD2 4.08Å; L271-L273 HydrophobicContact CD2-CD1 4.43Å; L271-L273 HydrophobicContact CD2-CG 4.42Å; L271-L273 HydrophobicContact CG-CG 4.41Å; L273-C275 PolarHBondContact O-N 3.46Å; L273-C275 PolarHBondContact O-SG 2.91Å; L273-V303 HydrophobicContact CD1-CG1 3.49Å; L273-V303 VanDerWaalsContact CD1-CG1 3.49Å; L273-V303 HydrophobicContact CG-CG1 4.4Å; L273-L304 PolarHBondContact N-O 3.21Å; L273-L305 HydrophobicContact CB-CD2 3.75Å; L273-L305 HydrophobicContact CD1-CD2 3.97Å; L273-L305 WeakPolarHBondContact O-CA 3.37Å; L273-A306 PolarHBondContact O-N 3.45Å
274D88.1Confident75.3Confident17 Ų1764.9 Ų64.99%0.09135%0.348CS..EExtended strand (participates in β ladder)trans-79109.8171.4166.330.2000109.7I204 S205 I206 S276 H307 V333I204-D274 PolarHBondContact O-N 3.1Å; S205-D274 WeakPolarHBondContact CB-OD2 3.43Å; S205-D274 PolarHBondContact OG-OD2 3.21Å; I206-D274 PolarHBondContact N-O 3.34Å; D274-S276 VanDerWaalsContact OD1-CB 3.25Å; D274-S276 WeakPolarHBondContact OD1-CB 3.26Å; D274-S276 PolarHBondContact OD1-N 2.9Å; D274-S276 VanDerWaalsContact OD1-N 3.15Å; D274-S276 PolarHBondContact OD1-OG 2.88Å; D274-S276 PolarHBondContact OD2-OG 3.42Å; D274-H307 IonicContact OD1-CE1 3.81Å; D274-H307 IonicContact OD1-CG 3.61Å; D274-H307 IonicContact OD1-ND1 2.8Å; D274-H307 PolarHBondContact OD1-ND1 2.95Å; D274-V333 HydrophobicContact CB-CG2 3.8Å
275C86.7Confident78.4Confident3 Ų359.2 Ų59.22%0.0231%0.309CS..  trans-92.69-173.3-65.10000113.4L273 G277 F278 L305 A306 C308 L312L273-C275 PolarHBondContact O-N 3.46Å; L273-C275 PolarHBondContact O-SG 2.91Å; C275-G277 PolarHBondContact O-N 3.39Å; C275-G277 VanDerWaalsContact O-N 3.07Å; C275-F278 HydrophobicContact CB-CD2 3.59Å; C275-F278 HydrophobicContact CB-CE2 3.94Å; C275-F278 PolarHBondContact O-N 3.02Å; C275-F278 VanDerWaalsContact SG-CE2 3.59Å; C275-L305 WeakPolarHBondContact SG-CD2 3.41Å; C275-A306 VanDerWaalsContact CB-O 3.23Å; C275-A306 WeakPolarHBondContact CB-O 3.43Å; C275-A306 PolarHBondContact N-O 3.5Å; C275-C308 VanDerWaalsContact SG-SG 3.7Å; C275-L312 HydrophobicContact CB-CD2 4.26Å
276S84.3Confident81.1Confident64 Ų6453.8 Ų53.845%0.44827%0.274SS..THydrogen-bonded Turntrans-56.2-27.4-174.954.70000114.1D274D274-S276 VanDerWaalsContact OD1-CB 3.25Å; D274-S276 WeakPolarHBondContact OD1-CB 3.26Å; D274-S276 PolarHBondContact OD1-N 2.9Å; D274-S276 VanDerWaalsContact OD1-N 3.15Å; D274-S276 PolarHBondContact OD1-OG 2.88Å; D274-S276 PolarHBondContact OD2-OG 3.42Å
277G77.1Confident83.5Confident9 Ų947.7 Ų47.79%0.09324%0.244CC..THydrogen-bonded Turntrans-93.35.7178.100000116.9I206 N208 C275 T279I206-G277 WeakPolarHBondContact O-CA 3.45Å; I206-G277 PolarHBondContact O-N 2.95Å; N208-G277 CarbonylContact C-O 3.56Å; N208-G277 VanDerWaalsContact C-O 3.29Å; N208-G277 PolarHBondContact N-O 3.05Å; C275-G277 PolarHBondContact O-N 3.39Å; C275-G277 VanDerWaalsContact O-N 3.07Å; G277-T279 PolarHBondContact O-N 3.49Å
278F83.8Confident85.2Confident8 Ų841.4 Ų41.44%0.03521%0.214CC..  trans-72.973.8168.3-69.1-39.5000110.9I206 N208 L210 F218 C275 F280 L289 L312I206-F278 HydrophobicContact CB-CE1 4.27Å; I206-F278 HydrophobicContact CB-CZ 4.29Å; I206-F278 HydrophobicContact CD1-CE1 4.33Å; I206-F278 HydrophobicContact CD1-CE2 4.22Å; I206-F278 HydrophobicContact CD1-CZ 3.63Å; I206-F278 HydrophobicContact CG2-CD1 4.11Å; I206-F278 HydrophobicContact CG2-CE1 3.47Å; I206-F278 VanDerWaalsContact CG2-CE1 3.47Å; I206-F278 HydrophobicContact CG2-CZ 3.9Å; N208-F278 VanDerWaalsContact O-CD1 3.23Å; N208-F278 WeakPolarHBondContact O-CD1 3.2Å; L210-F278 HydrophobicContact CB-CD1 3.82Å; L210-F278 HydrophobicContact CB-CE1 3.61Å; L210-F278 HydrophobicContact CB-CZ 4.43Å; L210-F278 HydrophobicContact CD2-CE1 3.99Å; L210-F278 HydrophobicContact CD2-CZ 4Å; L210-F278 HydrophobicContact CG-CE1 4.27Å; F218-F278 HydrophobicContact CZ-CZ 4.36Å; C275-F278 HydrophobicContact CB-CD2 3.59Å; C275-F278 HydrophobicContact CB-CE2 3.94Å; C275-F278 PolarHBondContact O-N 3.02Å; C275-F278 VanDerWaalsContact SG-CE2 3.59Å; F278-F280 VanDerWaalsContact C-N 3.32Å; F278-F280 PolarHBondContact O-N 3.01Å; F278-L289 HydrophobicContact CE2-CD1 4.49Å; F278-L289 HydrophobicContact CE2-CD2 3.85Å; F278-L289 HydrophobicContact CZ-CD1 4.46Å; F278-L289 HydrophobicContact CZ-CD2 4.36Å; F278-L312 HydrophobicContact CD2-CD2 3.65Å; F278-L312 HydrophobicContact CE2-CD2 4.34Å
279T82.4Confident86.5Confident120 Ų12035.8 Ų35.874%0.73619%0.19SC*.  trans-66.4-34.2177.452.40000112.5G277G277-T279 PolarHBondContact O-N 3.49Å
280F84Confident87.2Confident127 Ų12734.5 Ų34.556%0.55718%0.181SC*.  trans-146.7147.3176.6-179.1-99.8000110.1P209 L210 V211 F278P209-F280 CarbonylContact C-O 3.55Å; P209-F280 WeakPolarHBondContact CA-O 3.27Å; P209-F280 HydrophobicContact CB-CB 4.16Å; P209-F280 WeakPolarHBondContact CB-O 3.44Å; L210-F280 PolarHBondContact N-O 3.22Å; V211-F280 HydrophobicContact CG1-CD1 3.52Å; V211-F280 HydrophobicContact CG1-CE1 3.69Å; F278-F280 VanDerWaalsContact C-N 3.32Å; F278-F280 PolarHBondContact O-N 3.01Å
281F89.4Confident87.6Confident44 Ų4438 Ų3819%0.19320%0.198CC..BIsolated β-bridgetrans-146154.2174.157.3-94.1000111.5L210 V286 L312 A315L210-F281 WeakPolarHBondContact O-CA 3.41Å; L210-F281 WeakPolarHBondContact O-CB 3.37Å; F281-V286 HydrophobicContact CD2-CG2 3.37Å; F281-V286 HydrophobicContact CE2-CG2 3.82Å; F281-V286 HydrophobicContact CG-CG2 4.23Å; F281-L312 HydrophobicContact CD1-CB 4.45Å; F281-L312 HydrophobicContact CD1-CD1 4Å; F281-L312 HydrophobicContact CD2-CD1 4.42Å; F281-L312 HydrophobicContact CE1-CB 3.75Å; F281-L312 HydrophobicContact CE1-CD1 4.01Å; F281-L312 HydrophobicContact CE1-CG 4.46Å; F281-L312 HydrophobicContact CE2-CD1 4.42Å; F281-L312 HydrophobicContact CG-CD1 4.22Å; F281-L312 HydrophobicContact CZ-CB 4.03Å; F281-L312 HydrophobicContact CZ-CD1 4.22Å; F281-A315 HydrophobicContact CE2-CB 3.82Å; F281-A315 HydrophobicContact CZ-CB 4.36Å
282D91.5Very high87.7Confident48 Ų4837.9 Ų37.926%0.25720%0.198SC..  trans-117.2179.8172.470.215.6000111.9L210 V211 F212 S284 G285 V286L210-D282 PolarHBondContact O-N 3.26Å; V211-D282 WeakPolarHBondContact CA-OD1 3.31Å; V211-D282 WeakPolarHBondContact CA-OD2 3.47Å; F212-D282 WeakPolarHBondContact CB-OD2 3.33Å; F212-D282 VanDerWaalsContact N-CG 3.32Å; F212-D282 PolarHBondContact N-OD1 3.32Å; F212-D282 PolarHBondContact N-OD2 3.12Å; D282-S284 VanDerWaalsContact C-N 3.28Å; D282-S284 PolarHBondContact O-N 2.93Å; D282-S284 WeakPolarHBondContact OD1-CB 3.39Å; D282-S284 PolarHBondContact OD1-N 3.31Å; D282-G285 PolarHBondContact O-N 3.21Å; D282-G285 PolarHBondContact OD1-N 2.99Å; D282-V286 WeakPolarHBondContact O-CG2 3.42Å; D282-V286 PolarHBondContact O-N 3.1Å
283Y90.6Very high87.8Confident165 Ų16538.9 Ų38.965%0.64720%0.201SC*.Hα-helixtrans-56.3-41.5179176.2-94000112.7G285 V286 S287 Y319Y283-G285 VanDerWaalsContact C-N 3.33Å; Y283-G285 PolarHBondContact O-N 3.41Å; Y283-V286 PolarHBondContact O-N 3.44Å; Y283-S287 WeakPolarHBondContact O-CB 3.41Å; Y283-S287 PolarHBondContact O-N 3.23Å; Y283-Y319 HydrophobicContact CD2-CD2 4.44Å; Y283-Y319 HydrophobicContact CE1-CE2 4.4Å; Y283-Y319 AromaticContact CE2-CD2 3.72Å; Y283-Y319 HydrophobicContact CE2-CD2 3.72Å; Y283-Y319 AromaticContact CE2-CE2 3.66Å; Y283-Y319 HydrophobicContact CE2-CE2 3.66Å; Y283-Y319 AromaticContact CZ-CE2 3.58Å; Y283-Y319 WeakPolarHBondContact OH-CE2 3.48Å
284S90.6Very high87.8Confident41 Ų4142.9 Ų42.929%0.28722%0.221SC..Hα-helixtrans-67.3-37.8179.9-62.10000111.2F212 D282 M288F212-S284 WeakPolarHBondContact CD2-OG 3.41Å; D282-S284 VanDerWaalsContact C-N 3.28Å; D282-S284 PolarHBondContact O-N 2.93Å; D282-S284 WeakPolarHBondContact OD1-CB 3.39Å; D282-S284 PolarHBondContact OD1-N 3.31Å; S284-M288 VanDerWaalsContact O-CB 3.28Å; S284-M288 WeakPolarHBondContact O-CB 3.39Å; S284-M288 PolarHBondContact O-N 3.22Å
285G89.3Confident87.8Confident0 Ų044.7 Ų44.70%023%0.231CC..Hα-helixtrans-63.1-47.2173.900000112.9L210 D282 Y283 M288 L289L210-G285 WeakPolarHBondContact CD2-O 3.49Å; D282-G285 PolarHBondContact O-N 3.21Å; D282-G285 PolarHBondContact OD1-N 2.99Å; Y283-G285 VanDerWaalsContact C-N 3.33Å; Y283-G285 PolarHBondContact O-N 3.41Å; G285-M288 PolarHBondContact O-N 3.43Å; G285-L289 PolarHBondContact O-N 3.22Å
286V90.6Very high87.7Confident7 Ų744.6 Ų44.64%0.04223%0.23CC..Hα-helixtrans-63.6-46177.4175.80000111.1F281 D282 Y283 M288 L289 V290 L312 A315 M316 Y319F281-V286 HydrophobicContact CD2-CG2 3.37Å; F281-V286 HydrophobicContact CE2-CG2 3.82Å; F281-V286 HydrophobicContact CG-CG2 4.23Å; D282-V286 WeakPolarHBondContact O-CG2 3.42Å; D282-V286 PolarHBondContact O-N 3.1Å; Y283-V286 PolarHBondContact O-N 3.44Å; V286-M288 VanDerWaalsContact C-N 3.27Å; V286-M288 PolarHBondContact O-N 3.08Å; V286-L289 PolarHBondContact O-N 3.4Å; V286-V290 WeakPolarHBondContact O-CG2 3.41Å; V286-V290 PolarHBondContact O-N 2.99Å; V286-L312 HydrophobicContact CG2-CD1 4.47Å; V286-A315 HydrophobicContact CG1-CB 4.16Å; V286-A315 HydrophobicContact CG2-CB 3.96Å; V286-M316 HydrophobicContact CG1-CG 4.14Å; V286-Y319 HydrophobicContact CG1-CG 4.44Å
287S91.1Very high87.6Confident25 Ų2546.7 Ų46.718%0.17523%0.231CC..Hα-helixtrans-53.5-47.5174.5174.30000111.3Y283 L289 V290 E291 Y319Y283-S287 WeakPolarHBondContact O-CB 3.41Å; Y283-S287 PolarHBondContact O-N 3.23Å; S287-L289 PolarHBondContact O-N 2.98Å; S287-V290 PolarHBondContact O-N 3.37Å; S287-E291 WeakPolarHBondContact O-CB 3.17Å; S287-E291 PolarHBondContact O-N 2.92Å; S287-Y319 WeakPolarHBondContact CB-OH 3.29Å; S287-Y319 PolarHBondContact OG-OH 3.35Å
288M90.1Very high87.8Confident17 Ų1749.5 Ų49.58%0.08426%0.26CS..Hα-helixtrans-65.7-39.2-179-170.679-8800112.3A215 Y219 S284 G285 V286 E291 V292A215-M288 HydrophobicContact CB-CB 3.99Å; A215-M288 HydrophobicContact CB-CG 4.09Å; A215-M288 WeakPolarHBondContact O-CG 3.35Å; Y219-M288 WeakPolarHBondContact CB-SD 2.99Å; Y219-M288 HydrophobicContact CD1-CE 4.34Å; Y219-M288 HydrophobicContact CD2-CE 3.14Å; Y219-M288 HydrophobicContact CD2-SD 4.18Å; Y219-M288 HydrophobicContact CE2-CE 3.83Å; Y219-M288 HydrophobicContact CG-CE 3.44Å; Y219-M288 VanDerWaalsContact CG-CE 3.44Å; Y219-M288 HydrophobicContact CG-SD 3.91Å; S284-M288 VanDerWaalsContact O-CB 3.28Å; S284-M288 WeakPolarHBondContact O-CB 3.39Å; S284-M288 PolarHBondContact O-N 3.22Å; G285-M288 PolarHBondContact O-N 3.43Å; V286-M288 VanDerWaalsContact C-N 3.27Å; V286-M288 PolarHBondContact O-N 3.08Å; M288-E291 HydrophobicContact CE-CB 3.76Å; M288-E291 VanDerWaalsContact CE-CD 3.49Å; M288-E291 HydrophobicContact CE-CG 3.87Å; M288-E291 WeakPolarHBondContact CE-OE2 3.31Å; M288-E291 PolarHBondContact O-N 3.14Å; M288-V292 WeakPolarHBondContact O-CG2 3.39Å; M288-V292 PolarHBondContact O-N 3.49Å
289L89.7Confident87.7Confident2 Ų254.7 Ų54.71%0.0128%0.279CS..Hα-helixtrans-67.1-37.1177.7-172.960.8000112.1L210 F218 F278 G285 V286 S287 Y293 L305 L312 M316L210-L289 HydrophobicContact CD2-CB 4.06Å; F218-L289 HydrophobicContact CE1-CD1 4.44Å; F278-L289 HydrophobicContact CE2-CD1 4.49Å; F278-L289 HydrophobicContact CE2-CD2 3.85Å; F278-L289 HydrophobicContact CZ-CD1 4.46Å; F278-L289 HydrophobicContact CZ-CD2 4.36Å; G285-L289 PolarHBondContact O-N 3.22Å; V286-L289 PolarHBondContact O-N 3.4Å; S287-L289 PolarHBondContact O-N 2.98Å; L289-Y293 PolarHBondContact O-N 3.5Å; L289-L305 HydrophobicContact CD1-CD2 4.38Å; L289-L305 HydrophobicContact CD2-CD2 4.49Å; L289-L312 HydrophobicContact CD2-CD1 4.28Å; L289-M316 HydrophobicContact CD2-CE 4.31Å; L289-M316 HydrophobicContact CD2-SD 3.5Å; L289-M316 WeakPolarHBondContact CD2-SD 3.32Å; L289-M316 HydrophobicContact CG-CE 4.1Å; L289-M316 HydrophobicContact CG-SD 3.95Å
290V90.1Very high87.5Confident7 Ų752.9 Ų52.94%0.04227%0.272CS..Hα-helixtrans-67.5-40.8173.1173.30000110.9V286 S287 Y293 M294 M316 Y319 L322V286-V290 WeakPolarHBondContact O-CG2 3.41Å; V286-V290 PolarHBondContact O-N 2.99Å; S287-V290 PolarHBondContact O-N 3.37Å; V290-Y293 WeakPolarHBondContact O-CB 3.46Å; V290-Y293 PolarHBondContact O-N 2.89Å; V290-M294 HydrophobicContact CG1-CE 4.37Å; V290-M294 HydrophobicContact CG1-CG 4.37Å; V290-M294 WeakPolarHBondContact O-CG 3.27Å; V290-M294 PolarHBondContact O-N 3Å; V290-M316 HydrophobicContact CG2-CB 4.44Å; V290-M316 HydrophobicContact CG2-CE 3.75Å; V290-M316 HydrophobicContact CG2-CG 4.23Å; V290-Y319 HydrophobicContact CB-CD1 3.85Å; V290-Y319 HydrophobicContact CB-CE1 4.12Å; V290-Y319 HydrophobicContact CG1-CD1 3.98Å; V290-Y319 HydrophobicContact CG1-CE1 4.2Å; V290-Y319 HydrophobicContact CG2-CD1 3.81Å; V290-L322 HydrophobicContact CG2-CD1 4.01Å
291E90.1Very high87.4Confident91 Ų9147.3 Ų47.343%0.42525%0.248SC..Hα-helixtrans-61.6-44.6175.1-171.9173.4173.800111.7Y219 S287 M288 Y293 M294 D295Y219-E291 HydrophobicContact CE2-CG 4.48Å; S287-E291 WeakPolarHBondContact O-CB 3.17Å; S287-E291 PolarHBondContact O-N 2.92Å; M288-E291 HydrophobicContact CE-CB 3.76Å; M288-E291 VanDerWaalsContact CE-CD 3.49Å; M288-E291 HydrophobicContact CE-CG 3.87Å; M288-E291 WeakPolarHBondContact CE-OE2 3.31Å; M288-E291 PolarHBondContact O-N 3.14Å; E291-Y293 VanDerWaalsContact C-N 3.3Å; E291-Y293 PolarHBondContact O-N 3.3Å; E291-M294 PolarHBondContact O-N 3.11Å; E291-D295 WeakPolarHBondContact O-CB 3.41Å; E291-D295 PolarHBondContact O-N 2.75Å
292V88.5Confident87.2Confident0 Ų047.8 Ų47.80%025%0.252CS..Hα-helixtrans-54.1-47.7170.7168.10000111.1F218 Y219 L222 M288 M294 D295 C296F218-V292 HydrophobicContact CE1-CG2 4.4Å; Y219-V292 HydrophobicContact CD2-CG2 3.6Å; Y219-V292 HydrophobicContact CE2-CG2 4.33Å; L222-V292 HydrophobicContact CD2-CB 4.43Å; L222-V292 HydrophobicContact CD2-CG1 3.47Å; L222-V292 VanDerWaalsContact CD2-CG1 3.47Å; L222-V292 HydrophobicContact CD2-CG2 4.05Å; M288-V292 WeakPolarHBondContact O-CG2 3.39Å; M288-V292 PolarHBondContact O-N 3.49Å; V292-M294 PolarHBondContact O-N 3.42Å; V292-D295 PolarHBondContact O-N 2.94Å; V292-C296 WeakPolarHBondContact O-CB 3.25Å; V292-C296 PolarHBondContact O-N 2.96Å; V292-C296 PolarHBondContact O-SG 2.91Å
293Y88.6Confident87Confident21 Ų2146 Ų468%0.08224%0.243CC..Hα-helixtrans-60.8-46-179.5174.2-88.8000111.7L289 V290 E291 C296 K297 V303 L322 I328L289-Y293 PolarHBondContact O-N 3.5Å; V290-Y293 WeakPolarHBondContact O-CB 3.46Å; V290-Y293 PolarHBondContact O-N 2.89Å; E291-Y293 VanDerWaalsContact C-N 3.3Å; E291-Y293 PolarHBondContact O-N 3.3Å; Y293-C296 PolarHBondContact O-N 3.36Å; Y293-K297 HydrophobicContact CE1-CD 4.21Å; Y293-K297 WeakPolarHBondContact O-CB 3.34Å; Y293-K297 PolarHBondContact O-N 2.82Å; Y293-V303 HydrophobicContact CD2-CB 3.86Å; Y293-V303 HydrophobicContact CD2-CG1 4.16Å; Y293-V303 HydrophobicContact CE2-CB 4.18Å; Y293-L322 HydrophobicContact CD1-CD2 3.49Å; Y293-L322 VanDerWaalsContact CD1-CD2 3.49Å; Y293-L322 HydrophobicContact CE1-CD2 3.22Å; Y293-L322 HydrophobicContact CG-CD2 4.26Å; Y293-I328 HydrophobicContact CD2-CG2 4.42Å; Y293-I328 HydrophobicContact CE2-CD1 4.23Å; Y293-I328 HydrophobicContact CE2-CG1 4.3Å; Y293-I328 HydrophobicContact CE2-CG2 3.87Å; Y293-I328 VanDerWaalsContact OH-CD1 3.31Å; Y293-I328 WeakPolarHBondContact OH-CD1 3.23Å
294M86.8Confident86.9Confident84 Ų8438.6 Ų38.641%0.41422%0.215SC..Hα-helixtrans-66.7-41.2179.7-65.8-60.2-178.400112V290 E291 V292 K297 G298 L322V290-M294 HydrophobicContact CG1-CE 4.37Å; V290-M294 HydrophobicContact CG1-CG 4.37Å; V290-M294 WeakPolarHBondContact O-CG 3.27Å; V290-M294 PolarHBondContact O-N 3Å; E291-M294 PolarHBondContact O-N 3.11Å; V292-M294 PolarHBondContact O-N 3.42Å; M294-K297 PolarHBondContact O-N 3.45Å; M294-G298 PolarHBondContact O-N 3.49Å; M294-L322 HydrophobicContact CE-CD2 4.27Å
295D88Confident86.8Confident55 Ų5536.7 Ų36.729%0.29420%0.202SC..Hα-helixtrans-64.7-41.2177.4-83-4.6000112.4Y219 M223 E291 V292 G298 R299Y219-D295 VanDerWaalsContact CE2-OD2 3.3Å; Y219-D295 WeakPolarHBondContact CE2-OD2 3.3Å; Y219-D295 VanDerWaalsContact CZ-OD2 3.32Å; Y219-D295 PolarHBondContact OH-OD2 3.42Å; M223-D295 HydrophobicContact CE-CB 4.04Å; E291-D295 WeakPolarHBondContact O-CB 3.41Å; E291-D295 PolarHBondContact O-N 2.75Å; V292-D295 PolarHBondContact O-N 2.94Å; D295-G298 PolarHBondContact O-N 3.38Å; D295-R299 WeakPolarHBondContact O-CG 3.41Å; D295-R299 PolarHBondContact O-N 3.3Å
296C84.9Confident86.8Confident1 Ų136.7 Ų36.71%0.00720%0.202CC..Hα-helixtrans-65.8-42175.1-71.90000111.7V292 Y293 G298 R299 S300 V301 V303V292-C296 WeakPolarHBondContact O-CB 3.25Å; V292-C296 PolarHBondContact O-N 2.96Å; V292-C296 PolarHBondContact O-SG 2.91Å; Y293-C296 PolarHBondContact O-N 3.36Å; C296-G298 VanDerWaalsContact C-N 3.29Å; C296-G298 PolarHBondContact O-N 3.4Å; C296-R299 CarbonylContact O-C 3.58Å; C296-R299 WeakPolarHBondContact O-CA 3.47Å; C296-R299 PolarHBondContact O-N 2.68Å; C296-S300 PolarHBondContact O-N 3.41Å; C296-V301 CarbonylContact C-O 3.55Å; C296-V301 HydrophobicContact CB-CB 4.37Å; C296-V301 PolarHBondContact O-N 2.94Å; C296-V301 VanDerWaalsContact O-N 3.09Å; C296-V303 HydrophobicContact CB-CG2 3.23Å
297K83.1Confident86.7Confident108 Ų10840.1 Ų40.147%0.4722%0.217SC..Hα-helixtrans-60.8-39.2175.5-171.5175.6-177.4175.70111.7Y293 M294 R299 S300Y293-K297 HydrophobicContact CE1-CD 4.21Å; Y293-K297 WeakPolarHBondContact O-CB 3.34Å; Y293-K297 PolarHBondContact O-N 2.82Å; M294-K297 PolarHBondContact O-N 3.45Å; K297-R299 PolarHBondContact O-N 3.06Å; K297-S300 PolarHBondContact O-N 3.25Å
298G80.6Confident86.5Confident68 Ų6839.9 Ų39.970%0.70122%0.215SC*.Hα-helixtrans-64.3-20.6173.600000114.3M294 D295 C296M294-G298 PolarHBondContact O-N 3.49Å; D295-G298 PolarHBondContact O-N 3.38Å; C296-G298 VanDerWaalsContact C-N 3.29Å; C296-G298 PolarHBondContact O-N 3.4Å
299R81.3Confident86.4Confident117 Ų11742.3 Ų42.344%0.44223%0.231SC..THydrogen-bonded Turntrans-98.515.1177.5-66.1175.2-177.5-137.3-1.1113.5D295 C296 K297 V301D295-R299 WeakPolarHBondContact O-CG 3.41Å; D295-R299 PolarHBondContact O-N 3.3Å; C296-R299 CarbonylContact O-C 3.58Å; C296-R299 WeakPolarHBondContact O-CA 3.47Å; C296-R299 PolarHBondContact O-N 2.68Å; K297-R299 PolarHBondContact O-N 3.06Å; R299-V301 HydrophobicContact CB-CG2 4.41Å; R299-V301 PolarHBondContact O-N 3.3Å
300S79.1Confident86.2Confident82 Ų8246.1 Ų46.157%0.57326%0.263SS*.THydrogen-bonded Turntrans60.125.3-176.1-55.70000114.5C296 K297C296-S300 PolarHBondContact O-N 3.41Å; K297-S300 PolarHBondContact O-N 3.25Å
301V82.3Confident86.2Confident11 Ų1149.7 Ų49.77%0.06729%0.288CS..EExtended strand (participates in β ladder)trans-100.5116.1172.7-176.30000109C269 L271 C296 R299 V303C269-V301 HydrophobicContact CB-CG1 4.43Å; C269-V301 HydrophobicContact CB-CG2 4.27Å; C269-V301 WeakPolarHBondContact O-CA 3.29Å; L271-V301 HydrophobicContact CB-CG1 3.79Å; C296-V301 CarbonylContact C-O 3.55Å; C296-V301 HydrophobicContact CB-CB 4.37Å; C296-V301 PolarHBondContact O-N 2.94Å; C296-V301 VanDerWaalsContact O-N 3.09Å; R299-V301 HydrophobicContact CB-CG2 4.41Å; R299-V301 PolarHBondContact O-N 3.3Å; V301-V303 PolarHBondContact O-N 3.38Å
302D84.1Confident86Confident53 Ų5345.4 Ų45.428%0.28327%0.268SS..EExtended strand (participates in β ladder)trans-78.4114.2177-88-25.9000109.5C269 Y270 L271C269-D302 PolarHBondContact O-N 3.44Å; Y270-D302 WeakPolarHBondContact CA-O 3.43Å; Y270-D302 HydrophobicContact CD1-CB 3.52Å; Y270-D302 HydrophobicContact CE1-CB 3.48Å; Y270-D302 VanDerWaalsContact CE1-CB 3.48Å; Y270-D302 HydrophobicContact CG-CB 4.47Å; L271-D302 PolarHBondContact N-O 2.93Å
303V87.1Confident86Confident10 Ų1048.1 Ų48.16%0.06128%0.282CS..EExtended strand (participates in β ladder)trans-95.8128.1-178.6-176.40000111.2L271 L273 Y293 C296 V301L271-V303 HydrophobicContact CB-CG2 4.36Å; L271-V303 HydrophobicContact CD2-CG2 4.26Å; L271-V303 CarbonylContact O-C 3.52Å; L271-V303 WeakPolarHBondContact O-CA 3.49Å; L273-V303 HydrophobicContact CD1-CG1 3.49Å; L273-V303 VanDerWaalsContact CD1-CG1 3.49Å; L273-V303 HydrophobicContact CG-CG1 4.4Å; Y293-V303 HydrophobicContact CD2-CB 3.86Å; Y293-V303 HydrophobicContact CD2-CG1 4.16Å; Y293-V303 HydrophobicContact CE2-CB 4.18Å; C296-V303 HydrophobicContact CB-CG2 3.23Å; V301-V303 PolarHBondContact O-N 3.38Å
304L89.1Confident86Confident11 Ų1155 Ų556%0.05831%0.312CS..EExtended strand (participates in β ladder)trans-119.4131.6177.4-57.3156.1000108.6Y270 L271 I272 L273 F330 A336 I340Y270-L304 HydrophobicContact CD1-CD1 4.05Å; L271-L304 PolarHBondContact O-N 3.02Å; I272-L304 CarbonylContact C-O 3.57Å; I272-L304 WeakPolarHBondContact CA-O 3.48Å; I272-L304 HydrophobicContact CG1-CB 4.36Å; I272-L304 HydrophobicContact CG1-CD1 4.18Å; L273-L304 PolarHBondContact N-O 3.21Å; L304-F330 HydrophobicContact CB-CD2 4.22Å; L304-F330 HydrophobicContact CB-CE2 4.05Å; L304-F330 HydrophobicContact CD2-CD2 4.29Å; L304-F330 HydrophobicContact CD2-CE2 3.31Å; L304-F330 HydrophobicContact CD2-CZ 3.77Å; L304-F330 HydrophobicContact CG-CE2 4.21Å; L304-A336 HydrophobicContact CB-CB 4.34Å; L304-I340 HydrophobicContact CD1-CD1 3.57Å; L304-I340 HydrophobicContact CD1-CG1 3.53Å
305L89.4Confident86Confident1 Ų152.3 Ų52.31%0.00530%0.304CS..EExtended strand (participates in β ladder)trans-106119.5-177.9-70.8152.2000109.3L273 C275 L289 C308 M316 I328 F329 F330L273-L305 HydrophobicContact CB-CD2 3.75Å; L273-L305 HydrophobicContact CD1-CD2 3.97Å; L273-L305 WeakPolarHBondContact O-CA 3.37Å; C275-L305 WeakPolarHBondContact SG-CD2 3.41Å; L289-L305 HydrophobicContact CD1-CD2 4.38Å; L289-L305 HydrophobicContact CD2-CD2 4.49Å; L305-C308 VanDerWaalsContact CB-SG 3.58Å; L305-M316 HydrophobicContact CD1-CE 3.81Å; L305-M316 HydrophobicContact CD1-SD 3.96Å; L305-I328 HydrophobicContact CD1-CG2 3.83Å; L305-I328 PolarHBondContact N-O 2.91Å; L305-F329 HydrophobicContact CB-CD1 4.09Å; L305-F329 HydrophobicContact CB-CE1 4.49Å; L305-F329 HydrophobicContact CD1-CD1 4.21Å; L305-F329 HydrophobicContact CD1-CE1 3.8Å; L305-F329 CarbonylContact O-C 3.29Å; L305-F329 WeakPolarHBondContact O-CA 3.38Å; L305-F330 PolarHBondContact O-N 3.42Å
306A88.6Confident86Confident0 Ų049.7 Ų49.70%029%0.29CS..EExtended strand (participates in β ladder)trans-107.7152.6-179.200000111.8I272 L273 C275 C308 F330 V333I272-A306 HydrophobicContact CG2-CB 4.16Å; L273-A306 PolarHBondContact O-N 3.45Å; C275-A306 VanDerWaalsContact CB-O 3.23Å; C275-A306 WeakPolarHBondContact CB-O 3.43Å; C275-A306 PolarHBondContact N-O 3.5Å; A306-C308 VanDerWaalsContact C-N 3.28Å; A306-C308 PolarHBondContact O-N 3.45Å; A306-F330 CarbonylContact C-O 3.4Å; A306-F330 WeakPolarHBondContact CA-O 3.26Å; A306-V333 HydrophobicContact CB-CB 4.43Å; A306-V333 HydrophobicContact CB-CG2 3.74Å
307H88.8Confident86.1Confident79 Ų7951.7 Ų51.737%0.36630%0.301SS..SBendtrans5535.7-179.3-57.2117.4000114.5D274 F330 E331D274-H307 IonicContact OD1-CE1 3.81Å; D274-H307 IonicContact OD1-CG 3.61Å; D274-H307 IonicContact OD1-ND1 2.8Å; D274-H307 PolarHBondContact OD1-ND1 2.95Å; H307-F330 PolarHBondContact N-O 2.95Å; H307-E331 PolarHBondContact CD2-O 3.1Å
308C85.9Confident86.2Confident19 Ų1956.8 Ų56.813%0.12832%0.319CS..  trans-75.2131176-62.80000111.4C275 L305 A306 L312 I313 F329C275-C308 VanDerWaalsContact SG-SG 3.7Å; L305-C308 VanDerWaalsContact CB-SG 3.58Å; A306-C308 VanDerWaalsContact C-N 3.28Å; A306-C308 PolarHBondContact O-N 3.45Å; C308-L312 HydrophobicContact CB-CD2 4.24Å; C308-I313 HydrophobicContact CB-CD1 4.07Å; C308-I313 HydrophobicContact CB-CG1 3.65Å; C308-F329 HydrophobicContact CB-CD1 4.17Å
309T87.3Confident86.3Confident68 Ų6857.8 Ų57.842%0.41730%0.302SS..  trans-67.8150.6170.960.40000110.6S311 L312 I313T309-S311 PolarHBondContact O-N 3.31Å; T309-S311 VanDerWaalsContact O-N 3.17Å; T309-L312 WeakPolarHBondContact O-CB 3.23Å; T309-L312 PolarHBondContact O-N 3.1Å; T309-L312 WeakPolarHBondContact OG1-CB 3.39Å; T309-L312 PolarHBondContact OG1-N 3.37Å; T309-I313 WeakPolarHBondContact O-CG1 3.28Å; T309-I313 PolarHBondContact O-N 3.25Å
310A87.5Confident86Confident82 Ų8252.9 Ų52.968%0.67829%0.289SS*.Hα-helixtrans-55.6-36.1178.400000112.7K314A310-K314 WeakPolarHBondContact O-CB 3.18Å; A310-K314 PolarHBondContact O-N 3.07Å
311S88.4Confident85.6Confident82 Ų8255.3 Ų55.357%0.57330%0.295SS*.Hα-helixtrans-63-41.1174.7-56.30000112.4T309 A315T309-S311 PolarHBondContact O-N 3.31Å; T309-S311 VanDerWaalsContact O-N 3.17Å; S311-A315 WeakPolarHBondContact O-CB 3.42Å; S311-A315 PolarHBondContact O-N 3.09Å
312L87.3Confident84.9Confident2 Ų255.4 Ų55.41%0.0130%0.295CS..Hα-helixtrans-68.7-43.8178.6-179.563000111.3C275 F278 F281 V286 L289 C308 T309 K314 A315 M316C275-L312 HydrophobicContact CB-CD2 4.26Å; F278-L312 HydrophobicContact CD2-CD2 3.65Å; F278-L312 HydrophobicContact CE2-CD2 4.34Å; F281-L312 HydrophobicContact CD1-CB 4.45Å; F281-L312 HydrophobicContact CD1-CD1 4Å; F281-L312 HydrophobicContact CD2-CD1 4.42Å; F281-L312 HydrophobicContact CE1-CB 3.75Å; F281-L312 HydrophobicContact CE1-CD1 4.01Å; F281-L312 HydrophobicContact CE1-CG 4.46Å; F281-L312 HydrophobicContact CE2-CD1 4.42Å; F281-L312 HydrophobicContact CG-CD1 4.22Å; F281-L312 HydrophobicContact CZ-CB 4.03Å; F281-L312 HydrophobicContact CZ-CD1 4.22Å; V286-L312 HydrophobicContact CG2-CD1 4.47Å; L289-L312 HydrophobicContact CD2-CD1 4.28Å; C308-L312 HydrophobicContact CB-CD2 4.24Å; T309-L312 WeakPolarHBondContact O-CB 3.23Å; T309-L312 PolarHBondContact O-N 3.1Å; T309-L312 WeakPolarHBondContact OG1-CB 3.39Å; T309-L312 PolarHBondContact OG1-N 3.37Å; L312-K314 PolarHBondContact O-N 3.12Å; L312-A315 PolarHBondContact O-N 3.47Å; L312-M316 HydrophobicContact CD1-CG 4.29Å; L312-M316 PolarHBondContact O-N 2.89Å
313I87.9Confident83.7Confident57 Ų5759.1 Ų59.129%0.29232%0.315SS..Hα-helixtrans-57.1-52.1175.7-62.4171.9000109.3C308 T309 A315 M316 T317 F329C308-I313 HydrophobicContact CB-CD1 4.07Å; C308-I313 HydrophobicContact CB-CG1 3.65Å; T309-I313 WeakPolarHBondContact O-CG1 3.28Å; T309-I313 PolarHBondContact O-N 3.25Å; I313-A315 VanDerWaalsContact C-N 3.31Å; I313-A315 PolarHBondContact O-N 3.02Å; I313-M316 PolarHBondContact O-N 3.39Å; I313-T317 WeakPolarHBondContact O-CB 3.41Å; I313-T317 PolarHBondContact O-N 2.98Å; I313-T317 PolarHBondContact O-OG1 3.17Å; I313-T317 VanDerWaalsContact O-OG1 3.05Å; I313-F329 HydrophobicContact CD1-CB 4.26Å; I313-F329 HydrophobicContact CD1-CG 4.44Å; I313-F329 HydrophobicContact CG1-CB 4.38Å; I313-F329 HydrophobicContact CG1-CD1 3.88Å; I313-F329 HydrophobicContact CG1-CE1 4.29Å; I313-F329 HydrophobicContact CG1-CG 4.04Å; I313-F329 HydrophobicContact CG2-CD2 4.03Å; I313-F329 HydrophobicContact CG2-CE2 4.11Å; I313-F329 HydrophobicContact CG2-CG 4.3Å; I313-F329 HydrophobicContact CG2-CZ 4.44Å
314K88.1Confident82Confident165 Ų16561.3 Ų61.372%0.71733%0.331SS*.Hα-helixtrans-57.7-42.5178.4-172.5178.3-178.6179.70112.4A310 L312 Y318A310-K314 WeakPolarHBondContact O-CB 3.18Å; A310-K314 PolarHBondContact O-N 3.07Å; L312-K314 PolarHBondContact O-N 3.12Å; K314-Y318 VanDerWaalsContact O-CB 3.27Å; K314-Y318 WeakPolarHBondContact O-CB 3.32Å; K314-Y318 PolarHBondContact O-N 2.78Å
315A88.1Confident80.2Confident28 Ų2870.4 Ų70.423%0.23137%0.373CS..Hα-helixtrans-67.1-43.2-18000000112.3F281 V286 S311 L312 I313 Y319F281-A315 HydrophobicContact CE2-CB 3.82Å; F281-A315 HydrophobicContact CZ-CB 4.36Å; V286-A315 HydrophobicContact CG1-CB 4.16Å; V286-A315 HydrophobicContact CG2-CB 3.96Å; S311-A315 WeakPolarHBondContact O-CB 3.42Å; S311-A315 PolarHBondContact O-N 3.09Å; L312-A315 PolarHBondContact O-N 3.47Å; I313-A315 VanDerWaalsContact C-N 3.31Å; I313-A315 PolarHBondContact O-N 3.02Å; A315-Y319 VanDerWaalsContact O-CB 3.32Å; A315-Y319 WeakPolarHBondContact O-CB 3.28Å; A315-Y319 PolarHBondContact O-N 3.28Å
316M86.8Confident78.9Confident0 Ų075.7 Ų75.70%040%0.396CS..Hα-helixtrans-67.4-44.8177.1-77-165.769.100112.2V286 L289 V290 L305 L312 I313 Y318 Y319 G320 L322 F329V286-M316 HydrophobicContact CG1-CG 4.14Å; L289-M316 HydrophobicContact CD2-CE 4.31Å; L289-M316 HydrophobicContact CD2-SD 3.5Å; L289-M316 WeakPolarHBondContact CD2-SD 3.32Å; L289-M316 HydrophobicContact CG-CE 4.1Å; L289-M316 HydrophobicContact CG-SD 3.95Å; V290-M316 HydrophobicContact CG2-CB 4.44Å; V290-M316 HydrophobicContact CG2-CE 3.75Å; V290-M316 HydrophobicContact CG2-CG 4.23Å; L305-M316 HydrophobicContact CD1-CE 3.81Å; L305-M316 HydrophobicContact CD1-SD 3.96Å; L312-M316 HydrophobicContact CD1-CG 4.29Å; L312-M316 PolarHBondContact O-N 2.89Å; I313-M316 PolarHBondContact O-N 3.39Å; M316-Y318 VanDerWaalsContact C-N 3.33Å; M316-Y318 PolarHBondContact O-N 3.26Å; M316-Y319 PolarHBondContact O-N 3.47Å; M316-G320 PolarHBondContact O-N 3.04Å; M316-L322 HydrophobicContact CB-CD1 4.14Å; M316-L322 HydrophobicContact CE-CD1 3.79Å; M316-F329 HydrophobicContact CB-CE1 4.42Å; M316-F329 HydrophobicContact CB-CZ 4.01Å; M316-F329 HydrophobicContact SD-CE1 3.97Å; M316-F329 HydrophobicContact SD-CZ 4.33Å
317T86.9Confident78Confident42 Ų4278.9 Ų78.926%0.25842%0.417SS..Hα-helixtrans-60.6-44.2177.4-57.40000111I313 N321 D323I313-T317 WeakPolarHBondContact O-CB 3.41Å; I313-T317 PolarHBondContact O-N 2.98Å; I313-T317 PolarHBondContact O-OG1 3.17Å; I313-T317 VanDerWaalsContact O-OG1 3.05Å; T317-N321 WeakPolarHBondContact O-CA 3.29Å; T317-N321 PolarHBondContact O-N 3.37Å; T317-N321 VanDerWaalsContact O-N 3.13Å; T317-D323 WeakPolarHBondContact CG2-OD1 3.48Å
318Y85.9Confident77.7Confident215 Ų21575.7 Ų75.784%0.84340%0.402SS*.Hα-helixtrans-65-39.9178.3-173.8-98.3000113K314 M316K314-Y318 VanDerWaalsContact O-CB 3.27Å; K314-Y318 WeakPolarHBondContact O-CB 3.32Å; K314-Y318 PolarHBondContact O-N 2.78Å; M316-Y318 VanDerWaalsContact C-N 3.33Å; M316-Y318 PolarHBondContact O-N 3.26Å
319Y83Confident77.7Confident89 Ų8977.1 Ų77.135%0.34941%0.406SS..Hα-helixtrans-78.4-49.1-177.9-176.4-88.7000113Y283 V286 S287 V290 A315 M316Y283-Y319 HydrophobicContact CD2-CD2 4.44Å; Y283-Y319 HydrophobicContact CE1-CE2 4.4Å; Y283-Y319 AromaticContact CE2-CD2 3.72Å; Y283-Y319 HydrophobicContact CE2-CD2 3.72Å; Y283-Y319 AromaticContact CE2-CE2 3.66Å; Y283-Y319 HydrophobicContact CE2-CE2 3.66Å; Y283-Y319 AromaticContact CZ-CE2 3.58Å; Y283-Y319 WeakPolarHBondContact OH-CE2 3.48Å; V286-Y319 HydrophobicContact CG1-CG 4.44Å; S287-Y319 WeakPolarHBondContact CB-OH 3.29Å; S287-Y319 PolarHBondContact OG-OH 3.35Å; V290-Y319 HydrophobicContact CB-CD1 3.85Å; V290-Y319 HydrophobicContact CB-CE1 4.12Å; V290-Y319 HydrophobicContact CG1-CD1 3.98Å; V290-Y319 HydrophobicContact CG1-CE1 4.2Å; V290-Y319 HydrophobicContact CG2-CD1 3.81Å; A315-Y319 VanDerWaalsContact O-CB 3.32Å; A315-Y319 WeakPolarHBondContact O-CB 3.28Å; A315-Y319 PolarHBondContact O-N 3.28Å; M316-Y319 PolarHBondContact O-N 3.47Å
320G73.5Confident77.8Confident15 Ų1575 Ų7516%0.15539%0.392CS..Hα-helixtrans-95.1-1.9-169.200000115.1M316 L322M316-G320 PolarHBondContact O-N 3.04Å; G320-L322 PolarHBondContact O-N 3.32Å
321N71.3Confident77.7Confident132 Ų13279.6 Ų79.671%0.70640%0.399SS*.  trans46.845.2-171.6-159.949.5000111.7T317 D323T317-N321 WeakPolarHBondContact O-CA 3.29Å; T317-N321 PolarHBondContact O-N 3.37Å; T317-N321 VanDerWaalsContact O-N 3.13Å; N321-D323 PolarHBondContact O-N 2.89Å
322L68.4Low77.6Confident14 Ų1477.2 Ų77.27%0.07338%0.382CS..  trans-76.732-171.4-78.8150.8000113.3V290 Y293 M294 M316 G320 S324 I328V290-L322 HydrophobicContact CG2-CD1 4.01Å; Y293-L322 HydrophobicContact CD1-CD2 3.49Å; Y293-L322 VanDerWaalsContact CD1-CD2 3.49Å; Y293-L322 HydrophobicContact CE1-CD2 3.22Å; Y293-L322 HydrophobicContact CG-CD2 4.26Å; M294-L322 HydrophobicContact CE-CD2 4.27Å; M316-L322 HydrophobicContact CB-CD1 4.14Å; M316-L322 HydrophobicContact CE-CD1 3.79Å; G320-L322 PolarHBondContact O-N 3.32Å; L322-S324 PolarHBondContact O-N 3.17Å; L322-I328 HydrophobicContact CB-CD1 4.25Å; L322-I328 HydrophobicContact CD2-CD1 3.79Å
323D57.3Low77.5Confident130 Ų13078.3 Ų78.370%0.69539%0.389SS*.  trans-78.467.1172.6-69.5-20.4000109.2T317 N321T317-D323 WeakPolarHBondContact CG2-OD1 3.48Å; N321-D323 PolarHBondContact O-N 2.89Å
324S52.7Low77.3Confident56 Ų5679.3 Ų79.339%0.39240%0.401SS..  trans-98.2144.7174.1-170.50000110L322 K326L322-S324 PolarHBondContact O-N 3.17Å; S324-K326 PolarHBondContact O-N 3.14Å
325E51.1Low77.2Confident203 Ų20373.2 Ų73.295%0.94938%0.381SS*.SBendtrans-55.5-3.4-179.3-64.2178.1155.500116.3
326K62.2Low77Confident112 Ų11271.9 Ų71.949%0.48737%0.37SS..SBendtrans-115.8136.8179.8-66.8-178.7-178.7177.30110.2S324 I328S324-K326 PolarHBondContact O-N 3.14Å; K326-I328 PolarHBondContact O-N 3.12Å
327P68.9Low76.9Confident67 Ų6774 Ų7444%0.43538%0.381SS..  trans-65.7119.7178.627.2-33.1000110.2F330 H339P327-F330 HydrophobicContact CB-CE1 4.41Å; P327-F330 HydrophobicContact CB-CZ 4.03Å; P327-F330 HydrophobicContact CG-CE1 4.39Å; P327-F330 HydrophobicContact CG-CZ 4Å; P327-F330 VanDerWaalsContact O-CE2 3.27Å; P327-F330 WeakPolarHBondContact O-CE2 3.41Å; P327-F330 VanDerWaalsContact O-CZ 3.28Å; P327-F330 WeakPolarHBondContact O-CZ 3.46Å; P327-H339 VanDerWaalsContact CG-NE2 3.27Å; P327-H339 WeakPolarHBondContact CG-NE2 3.4Å
328I82.4Confident76.7Confident12 Ų1275.6 Ų75.66%0.06239%0.394CS..  trans-93.6-32.3178.6-63.4166000110.8Y293 L305 L322 K326Y293-I328 HydrophobicContact CD2-CG2 4.42Å; Y293-I328 HydrophobicContact CE2-CD1 4.23Å; Y293-I328 HydrophobicContact CE2-CG1 4.3Å; Y293-I328 HydrophobicContact CE2-CG2 3.87Å; Y293-I328 VanDerWaalsContact OH-CD1 3.31Å; Y293-I328 WeakPolarHBondContact OH-CD1 3.23Å; L305-I328 HydrophobicContact CD1-CG2 3.83Å; L305-I328 PolarHBondContact N-O 2.91Å; L322-I328 HydrophobicContact CB-CD1 4.25Å; L322-I328 HydrophobicContact CD2-CD1 3.79Å; K326-I328 PolarHBondContact O-N 3.12Å
329F87.5Confident76.6Confident48 Ų4867.6 Ų67.621%0.21136%0.364CS..EExtended strand (participates in β ladder)trans-105.4132.9-173.1-55.5-77.8000111.3L305 C308 I313 M316L305-F329 HydrophobicContact CB-CD1 4.09Å; L305-F329 HydrophobicContact CB-CE1 4.49Å; L305-F329 HydrophobicContact CD1-CD1 4.21Å; L305-F329 HydrophobicContact CD1-CE1 3.8Å; L305-F329 CarbonylContact O-C 3.29Å; L305-F329 WeakPolarHBondContact O-CA 3.38Å; C308-F329 HydrophobicContact CB-CD1 4.17Å; I313-F329 HydrophobicContact CD1-CB 4.26Å; I313-F329 HydrophobicContact CD1-CG 4.44Å; I313-F329 HydrophobicContact CG1-CB 4.38Å; I313-F329 HydrophobicContact CG1-CD1 3.88Å; I313-F329 HydrophobicContact CG1-CE1 4.29Å; I313-F329 HydrophobicContact CG1-CG 4.04Å; I313-F329 HydrophobicContact CG2-CD2 4.03Å; I313-F329 HydrophobicContact CG2-CE2 4.11Å; I313-F329 HydrophobicContact CG2-CG 4.3Å; I313-F329 HydrophobicContact CG2-CZ 4.44Å; M316-F329 HydrophobicContact CB-CE1 4.42Å; M316-F329 HydrophobicContact CB-CZ 4.01Å; M316-F329 HydrophobicContact SD-CE1 3.97Å; M316-F329 HydrophobicContact SD-CZ 4.33Å
330F88.1Confident76.5Confident25 Ų2563.6 Ų63.611%0.1135%0.349CS..EExtended strand (participates in β ladder)trans-129.5145-179.5-62.3-91000111.1L304 L305 A306 H307 P327 S332 A335 A336 H339L304-F330 HydrophobicContact CB-CD2 4.22Å; L304-F330 HydrophobicContact CB-CE2 4.05Å; L304-F330 HydrophobicContact CD2-CD2 4.29Å; L304-F330 HydrophobicContact CD2-CE2 3.31Å; L304-F330 HydrophobicContact CD2-CZ 3.77Å; L304-F330 HydrophobicContact CG-CE2 4.21Å; L305-F330 PolarHBondContact O-N 3.42Å; A306-F330 CarbonylContact C-O 3.4Å; A306-F330 WeakPolarHBondContact CA-O 3.26Å; H307-F330 PolarHBondContact N-O 2.95Å; P327-F330 HydrophobicContact CB-CE1 4.41Å; P327-F330 HydrophobicContact CB-CZ 4.03Å; P327-F330 HydrophobicContact CG-CE1 4.39Å; P327-F330 HydrophobicContact CG-CZ 4Å; P327-F330 VanDerWaalsContact O-CE2 3.27Å; P327-F330 WeakPolarHBondContact O-CE2 3.41Å; P327-F330 VanDerWaalsContact O-CZ 3.28Å; P327-F330 WeakPolarHBondContact O-CZ 3.46Å; F330-S332 VanDerWaalsContact C-N 3.27Å; F330-S332 PolarHBondContact O-N 3.29Å; F330-A335 HydrophobicContact CB-CB 4.43Å; F330-A335 HydrophobicContact CD1-CB 4.35Å; F330-A336 HydrophobicContact CB-CB 4.03Å; F330-A336 HydrophobicContact CD1-CB 4.28Å; F330-A336 HydrophobicContact CD2-CB 3.85Å; F330-A336 HydrophobicContact CE2-CB 4.48Å; F330-A336 HydrophobicContact CG-CB 3.76Å; F330-H339 HydrophobicContact CD1-CB 4.47Å; F330-H339 HydrophobicContact CE1-CB 3.52Å; F330-H339 AromaticContact CE1-CG 3.67Å; F330-H339 HydrophobicContact CZ-CB 3.9Å; F330-H339 AromaticContact CZ-CG 3.66Å; F330-H339 AromaticContact CZ-ND1 3.66Å
331E85.8Confident76.6Confident178 Ų17866.9 Ų66.983%0.83236%0.36SS*.SBendtrans-65.7-31.3178.4-64.6-174.3163.900112.5H307H307-E331 PolarHBondContact CD2-O 3.1Å
332S87Confident76.7Confident31 Ų3164.2 Ų64.222%0.21735%0.351CS..SBendtrans-146.2160.2-178.162.40000111.9F330 S334 A335 A336F330-S332 VanDerWaalsContact C-N 3.27Å; F330-S332 PolarHBondContact O-N 3.29Å; S332-S334 VanDerWaalsContact C-N 3.27Å; S332-S334 PolarHBondContact O-N 2.94Å; S332-S334 PolarHBondContact OG-OG 3.22Å; S332-A335 PolarHBondContact O-N 2.82Å; S332-A335 WeakPolarHBondContact OG-CB 3.49Å; S332-A335 PolarHBondContact OG-N 2.85Å; S332-A336 PolarHBondContact O-N 3.33Å
333V84.6Confident76.7Confident26 Ų2666 Ų6616%0.15836%0.361CS..Hα-helixtrans-61-38.5174176.30000110.9I203 I272 D274 A306 A335 A336 I337I203-V333 HydrophobicContact CD1-CG1 3.91Å; I203-V333 HydrophobicContact CG2-CG1 4.11Å; I272-V333 HydrophobicContact CG2-CG1 4.32Å; D274-V333 HydrophobicContact CB-CG2 3.8Å; A306-V333 HydrophobicContact CB-CB 4.43Å; A306-V333 HydrophobicContact CB-CG2 3.74Å; V333-A335 PolarHBondContact O-N 3.48Å; V333-A336 PolarHBondContact O-N 3.04Å; V333-I337 HydrophobicContact CG1-CD1 3.93Å; V333-I337 HydrophobicContact CG1-CG1 4.47Å; V333-I337 WeakPolarHBondContact O-CG1 3.48Å; V333-I337 PolarHBondContact O-N 2.9Å
334S84.3Confident77Confident77 Ų7761 Ų6154%0.53833%0.333SS..Hα-helixtrans-61.8-40.9176.143.40000112.5S332 A336 I337 S338S332-S334 VanDerWaalsContact C-N 3.27Å; S332-S334 PolarHBondContact O-N 2.94Å; S332-S334 PolarHBondContact OG-OG 3.22Å; S334-A336 VanDerWaalsContact C-N 3.34Å; S334-A336 PolarHBondContact O-N 3.38Å; S334-I337 PolarHBondContact O-N 3.42Å; S334-S338 PolarHBondContact O-N 3.48Å; S334-S338 PolarHBondContact O-OG 3.26Å; S334-S338 VanDerWaalsContact O-OG 3.13Å
335A85.7Confident77.1Confident37 Ų3763.3 Ų63.331%0.30634%0.341SS..Hα-helixtrans-64.6-39.517700000111.8F330 S332 V333 S338 H339F330-A335 HydrophobicContact CB-CB 4.43Å; F330-A335 HydrophobicContact CD1-CB 4.35Å; S332-A335 PolarHBondContact O-N 2.82Å; S332-A335 WeakPolarHBondContact OG-CB 3.49Å; S332-A335 PolarHBondContact OG-N 2.85Å; V333-A335 PolarHBondContact O-N 3.48Å; A335-S338 PolarHBondContact O-N 3.29Å; A335-H339 PolarHBondContact O-N 3.41Å
336A84.6Confident77.1Confident0 Ų059.3 Ų59.30%033%0.326CS..Hα-helixtrans-62.9-42.8174.200000111.8I272 L304 F330 S332 V333 S334 H339 I340I272-A336 HydrophobicContact CD1-CB 4.07Å; I272-A336 HydrophobicContact CG1-CB 4.5Å; I272-A336 HydrophobicContact CG2-CB 4.24Å; L304-A336 HydrophobicContact CB-CB 4.34Å; F330-A336 HydrophobicContact CB-CB 4.03Å; F330-A336 HydrophobicContact CD1-CB 4.28Å; F330-A336 HydrophobicContact CD2-CB 3.85Å; F330-A336 HydrophobicContact CE2-CB 4.48Å; F330-A336 HydrophobicContact CG-CB 3.76Å; S332-A336 PolarHBondContact O-N 3.33Å; V333-A336 PolarHBondContact O-N 3.04Å; S334-A336 VanDerWaalsContact C-N 3.34Å; S334-A336 PolarHBondContact O-N 3.38Å; A336-H339 WeakPolarHBondContact O-CB 3.3Å; A336-H339 PolarHBondContact O-N 2.91Å; A336-I340 WeakPolarHBondContact O-CG1 3.36Å; A336-I340 PolarHBondContact O-N 3.32Å; A336-I340 VanDerWaalsContact O-N 3.15Å
337I82.8Confident76.5Confident46 Ų4656.8 Ų56.824%0.23632%0.322CS..Hα-helixtrans-63.3-46.3176.1-65.9166.6000110.9I203 I272 V333 S334 H339 I340 H341I203-I337 HydrophobicContact CD1-CD1 3.96Å; I272-I337 HydrophobicContact CD1-CG1 3.59Å; V333-I337 HydrophobicContact CG1-CD1 3.93Å; V333-I337 HydrophobicContact CG1-CG1 4.47Å; V333-I337 WeakPolarHBondContact O-CG1 3.48Å; V333-I337 PolarHBondContact O-N 2.9Å; S334-I337 PolarHBondContact O-N 3.42Å; I337-H339 VanDerWaalsContact C-N 3.26Å; I337-H339 PolarHBondContact O-N 3.24Å; I337-I340 WeakPolarHBondContact O-CB 3.42Å; I337-I340 PolarHBondContact O-N 3.15Å; I337-I340 VanDerWaalsContact O-N 3.14Å; I337-H341 PolarHBondContact O-CD2 2.98Å; I337-H341 PolarHBondContact O-N 3Å; I337-H341 VanDerWaalsContact O-N 3.12Å
338S83.4Confident75.4Confident75 Ų7558 Ų5852%0.52432%0.321SS..Hα-helixtrans-59.8-36.1176.7-62.80000112.6S334 A335 H341 S342S334-S338 PolarHBondContact O-N 3.48Å; S334-S338 PolarHBondContact O-OG 3.26Å; S334-S338 VanDerWaalsContact O-OG 3.13Å; A335-S338 PolarHBondContact O-N 3.29Å; S338-H341 PolarHBondContact O-N 3.02Å; S338-S342 PolarHBondContact O-N 2.97Å
339H83.8Confident73.2Confident46 Ų4663.3 Ų63.321%0.21335%0.348CS..Hα-helixtrans-65.1-41.1174.9178.8-97.6000112.3P327 F330 A335 A336 I337 H341 S342 N343P327-H339 VanDerWaalsContact CG-NE2 3.27Å; P327-H339 WeakPolarHBondContact CG-NE2 3.4Å; F330-H339 HydrophobicContact CD1-CB 4.47Å; F330-H339 HydrophobicContact CE1-CB 3.52Å; F330-H339 AromaticContact CE1-CG 3.67Å; F330-H339 HydrophobicContact CZ-CB 3.9Å; F330-H339 AromaticContact CZ-CG 3.66Å; F330-H339 AromaticContact CZ-ND1 3.66Å; A335-H339 PolarHBondContact O-N 3.41Å; A336-H339 WeakPolarHBondContact O-CB 3.3Å; A336-H339 PolarHBondContact O-N 2.91Å; I337-H339 VanDerWaalsContact C-N 3.26Å; I337-H339 PolarHBondContact O-N 3.24Å; H339-H341 VanDerWaalsContact C-N 3.3Å; H339-H341 PolarHBondContact O-N 3.5Å; H339-S342 PolarHBondContact O-N 3.48Å; H339-N343 WeakPolarHBondContact O-CB 3.34Å; H339-N343 PolarHBondContact O-N 3.22Å
340I80.7Confident70.9Confident6 Ų664.2 Ų64.23%0.03136%0.361CS..Hα-helixtrans-57.9-45.1173.1-62.5167.6000110.3V201 Y270 I272 L304 A336 I337 K344V201-I340 HydrophobicContact CG1-CD1 3.98Å; V201-I340 HydrophobicContact CG2-CD1 4.13Å; Y270-I340 HydrophobicContact CD1-CD1 4.07Å; Y270-I340 HydrophobicContact CD1-CG1 3.89Å; Y270-I340 HydrophobicContact CD2-CD1 4.49Å; Y270-I340 HydrophobicContact CD2-CG2 3.84Å; Y270-I340 HydrophobicContact CE1-CG1 4.23Å; Y270-I340 HydrophobicContact CE2-CG2 3.85Å; Y270-I340 HydrophobicContact CG-CD1 3.88Å; Y270-I340 HydrophobicContact CG-CG1 4.06Å; Y270-I340 HydrophobicContact CG-CG2 4.22Å; I272-I340 HydrophobicContact CD1-CD1 3.98Å; I272-I340 HydrophobicContact CG1-CD1 4.37Å; L304-I340 HydrophobicContact CD1-CD1 3.57Å; L304-I340 HydrophobicContact CD1-CG1 3.53Å; A336-I340 WeakPolarHBondContact O-CG1 3.36Å; A336-I340 PolarHBondContact O-N 3.32Å; A336-I340 VanDerWaalsContact O-N 3.15Å; I337-I340 WeakPolarHBondContact O-CB 3.42Å; I337-I340 PolarHBondContact O-N 3.15Å; I337-I340 VanDerWaalsContact O-N 3.14Å; I340-K344 PolarHBondContact O-N 3.34Å
341H76.3Confident68.6Low84 Ų8469 Ų6939%0.38939%0.387SS..Hα-helixtrans-63.5-41.9177.5-71-67000113.1I337 S338 H339 K344 N345I337-H341 PolarHBondContact O-CD2 2.98Å; I337-H341 PolarHBondContact O-N 3Å; I337-H341 VanDerWaalsContact O-N 3.12Å; S338-H341 PolarHBondContact O-N 3.02Å; H339-H341 VanDerWaalsContact C-N 3.3Å; H339-H341 PolarHBondContact O-N 3.5Å; H341-K344 PolarHBondContact O-N 3.22Å; H341-N345 PolarHBondContact O-N 2.95Å
342S73.3Confident66.4Low75 Ų7568.1 Ų68.152%0.52438%0.383SS..Hα-helixtrans-67.3-40.8-179.7-177.30000112.3S338 H339 K344 N345 L346S338-S342 PolarHBondContact O-N 2.97Å; H339-S342 PolarHBondContact O-N 3.48Å; S342-K344 VanDerWaalsContact C-N 3.29Å; S342-K344 PolarHBondContact O-N 2.89Å; S342-N345 PolarHBondContact O-N 3.13Å; S342-N345 VanDerWaalsContact O-N 3.17Å; S342-L346 PolarHBondContact O-N 3.06Å; S342-L346 VanDerWaalsContact O-N 3.12Å
343N69.4Low64.1Low51 Ų5171.3 Ų71.327%0.27341%0.405SS..Hα-helixtrans-66.2-32.2179.5-141.7-7.8000112H339 L346 S347H339-N343 WeakPolarHBondContact O-CB 3.34Å; H339-N343 PolarHBondContact O-N 3.22Å; N343-L346 PolarHBondContact O-N 3.16Å; N343-S347 PolarHBondContact O-N 3.23Å; N343-S347 VanDerWaalsContact O-N 3.12Å; N343-S347 PolarHBondContact O-OG 3.36Å
344K62.5Low61.8Low26 Ų2678.6 Ų78.611%0.11344%0.438CS..Hα-helixtrans-64.5-39.6172.5-173.5178.8-176.41750112.6I340 H341 S342 L346 S347 K348I340-K344 PolarHBondContact O-N 3.34Å; H341-K344 PolarHBondContact O-N 3.22Å; S342-K344 VanDerWaalsContact C-N 3.29Å; S342-K344 PolarHBondContact O-N 2.89Å; K344-L346 VanDerWaalsContact C-N 3.34Å; K344-S347 PolarHBondContact O-OG 2.94Å; K344-K348 PolarHBondContact O-N 3.49Å
345N54.1Low59.5Low104 Ų10484.3 Ų84.356%0.55647%0.469SS*.Hα-helixtrans-71.4-32.2178.6-70.2-19.4000111.9H341 S342 L349H341-N345 PolarHBondContact O-N 2.95Å; S342-N345 PolarHBondContact O-N 3.13Å; S342-N345 VanDerWaalsContact O-N 3.17Å; N345-L349 PolarHBondContact O-N 3.26Å
346L51.4Low58.2Low120 Ų12086.7 Ų86.763%0.62848%0.477SS*.Hα-helixtrans-72.1-39.4177.8-153.674.1000112.2S342 N343 K344 K348 L349 S350S342-L346 PolarHBondContact O-N 3.06Å; S342-L346 VanDerWaalsContact O-N 3.12Å; N343-L346 PolarHBondContact O-N 3.16Å; K344-L346 VanDerWaalsContact C-N 3.34Å; L346-K348 VanDerWaalsContact C-N 3.34Å; L346-K348 PolarHBondContact O-N 3.21Å; L346-L349 PolarHBondContact O-N 3.18Å; L346-S350 PolarHBondContact O-N 3.06Å
347S51.1Low56.8Low59 Ų5991.3 Ų91.341%0.41350%0.502SS..Hα-helixtrans-67.6-31.5174.561.70000113.1N343 K344 S350 D351N343-S347 PolarHBondContact O-N 3.23Å; N343-S347 VanDerWaalsContact O-N 3.12Å; N343-S347 PolarHBondContact O-OG 3.36Å; K344-S347 PolarHBondContact O-OG 2.94Å; S347-S350 PolarHBondContact O-OG 3.37Å; S347-D351 PolarHBondContact O-N 3.38Å
348K43.9Very low55.3Low93 Ų9393.8 Ų93.840%0.40452%0.517SS..Hα-helixtrans-69.8-29.9173-78.3-170.5173.5-162.90113.1K344 L346 H352K344-K348 PolarHBondContact O-N 3.49Å; L346-K348 VanDerWaalsContact C-N 3.34Å; L346-K348 PolarHBondContact O-N 3.21Å; K348-H352 PolarHBondContact O-CD2 3.48Å
349L37.8Very low53.7Low122 Ų12294.9 Ų94.964%0.63952%0.517SS*.Hα-helixtrans-75.7-33178.3-115.490.9000112.8N345 L346 S353N345-L349 PolarHBondContact O-N 3.26Å; L346-L349 PolarHBondContact O-N 3.18Å; L349-S353 PolarHBondContact O-OG 3.43Å
350S38.1Very low51.8Low67 Ų6797.9 Ų97.947%0.46954%0.536SS..Hα-helixtrans-68-37.6176.152.60000112.3L346 S347 H352 S353L346-S350 PolarHBondContact O-N 3.06Å; S347-S350 PolarHBondContact O-OG 3.37Å; S350-H352 VanDerWaalsContact C-N 3.29Å; S350-H352 PolarHBondContact O-N 2.86Å; S350-S353 PolarHBondContact O-N 3.38Å
351D40Very low49.9Very low125 Ų125104.1 Ų104.167%0.66857%0.569SS**Hα-helixtrans-71.2-22.6179.8-69.7-12.2000113S347S347-D351 PolarHBondContact O-N 3.38Å
352H40.9Very low48Very low160 Ų160105.5 Ų105.574%0.74158%0.582SS**THydrogen-bonded Turntrans-88-2.3174.9-77.2-52.9000114.4K348 S350K348-H352 PolarHBondContact O-CD2 3.48Å; S350-H352 VanDerWaalsContact C-N 3.29Å; S350-H352 PolarHBondContact O-N 2.86Å
353S36.8Very low46Very low98 Ų98107.8 Ų107.869%0.68559%0.586SS**SBendtrans-98.1-5.6-179.5-54.50000113.4L349 S350L349-S353 PolarHBondContact O-OG 3.43Å; S350-S353 PolarHBondContact O-N 3.38Å
354E37.3Very low44.1Very low180 Ų180112.6 Ų112.684%0.84161%0.613SS**  trans-110.362.6172.6-70-168.9159.400111.2
355V35.3Very low42.4Very low197 Ų197120.5 Ų120.5100%1.19466%0.658SS**  trans-1340163-176.80000110.1

Retrieved 355 of 355 residues in 585.5 ms (Link to these results)

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