A0A087XCS1_POEFO Loading...

Required for meiotic nuclear division 5 homolog B

AlphaFold DB , UniProt , Accession A0A087XCS1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 395 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
1M58.5Low79.5Confident202 Ų20294.4 Ų94.4100%0.99547%0.473SS*.  0-56.50-74-98.7-85.600111.5Q3 C4 A5M1-Q3 PolarHBondContact O-N 3.35Å; M1-C4 PolarHBondContact O-N 3.46Å; M1-A5 PolarHBondContact O-N 2.89Å
2E70.1Confident80.4Confident175 Ų17595.9 Ų95.982%0.81848%0.477SS*.Hα-helixtrans-62.8-38.8179.7-68.6-174.2161.400114.6A5 C6E2-A5 PolarHBondContact O-N 3.48Å; E2-C6 WeakPolarHBondContact O-CB 3.45Å; E2-C6 PolarHBondContact O-N 3.37Å
3Q75Confident80.9Confident107 Ų10797.1 Ų97.150%0.548%0.478SS..Hα-helixtrans-60.7-46.2174-75.3171.2-25.100111.8M1 C6 V7 N96M1-Q3 PolarHBondContact O-N 3.35Å; Q3-C6 WeakPolarHBondContact O-CB 3.3Å; Q3-C6 PolarHBondContact O-N 3.4Å; Q3-V7 PolarHBondContact O-N 3.49Å; Q3-V7 VanDerWaalsContact O-N 3.16Å; Q3-N96 HydrophobicContact CB-CB 4.12Å; Q3-N96 HydrophobicContact CG-CB 4.32Å
4C76Confident81.4Confident66 Ų6691.1 Ų91.145%0.44645%0.449SS..Hα-helixtrans-60.1-46.2174.1-540000111.2M1 C6 V7 E8M1-C4 PolarHBondContact O-N 3.46Å; C4-C6 PolarHBondContact O-N 3.16Å; C4-V7 PolarHBondContact O-N 3.47Å; C4-V7 VanDerWaalsContact O-N 3.16Å; C4-E8 VanDerWaalsContact O-CB 3.32Å; C4-E8 WeakPolarHBondContact O-CB 3.49Å; C4-E8 PolarHBondContact O-N 2.94Å
5A79.6Confident81.8Confident38 Ų3891.5 Ų91.531%0.31445%0.453SS..Hα-helixtrans-66.1-24.9177.800000113M1 E2 R9M1-A5 PolarHBondContact O-N 2.89Å; E2-A5 PolarHBondContact O-N 3.48Å; A5-R9 WeakPolarHBondContact O-CB 3.26Å; A5-R9 VanDerWaalsContact O-CG 3.28Å; A5-R9 WeakPolarHBondContact O-CG 3.34Å; A5-R9 PolarHBondContact O-N 3.16Å; A5-R9 PolarHBondContact O-NE 3.26Å; A5-R9 VanDerWaalsContact O-NE 3.11Å
6C81.3Confident82.2Confident41 Ų4193.3 Ų93.328%0.27746%0.46SS..Hα-helixtrans-70.8-43172.9-170.40000111.4E2 Q3 C4 E10E2-C6 WeakPolarHBondContact O-CB 3.45Å; E2-C6 PolarHBondContact O-N 3.37Å; Q3-C6 WeakPolarHBondContact O-CB 3.3Å; Q3-C6 PolarHBondContact O-N 3.4Å; C4-C6 PolarHBondContact O-N 3.16Å; C6-E10 PolarHBondContact O-N 3.05Å
7V85.4Confident82.4Confident17 Ų1796 Ų9610%0.10346%0.464CS..Hα-helixtrans-72.6-40.6177.4176.80000111.4Q3 C4 R9 E10 L11 A92 I93 N96 F97Q3-V7 PolarHBondContact O-N 3.49Å; Q3-V7 VanDerWaalsContact O-N 3.16Å; C4-V7 PolarHBondContact O-N 3.47Å; C4-V7 VanDerWaalsContact O-N 3.16Å; V7-R9 PolarHBondContact O-N 3.47Å; V7-E10 PolarHBondContact O-N 3.41Å; V7-E10 VanDerWaalsContact O-N 3.13Å; V7-L11 WeakPolarHBondContact O-CB 3.36Å; V7-L11 PolarHBondContact O-N 3.05Å; V7-A92 HydrophobicContact CG2-CB 4.38Å; V7-I93 HydrophobicContact CG1-CD1 4.49Å; V7-I93 HydrophobicContact CG1-CG1 3.67Å; V7-I93 HydrophobicContact CG2-CG1 4.5Å; V7-N96 HydrophobicContact CG2-CB 4.02Å; V7-F97 HydrophobicContact CB-CE2 4.2Å; V7-F97 HydrophobicContact CG1-CE2 4.43Å; V7-F97 HydrophobicContact CG2-CD2 4.28Å; V7-F97 HydrophobicContact CG2-CE2 3.65Å; V7-F97 HydrophobicContact CG2-CZ 4.49Å
8E87Confident82.7Confident111 Ų11195.7 Ų95.752%0.51946%0.46SS..Hα-helixtrans-57.6-45.2175.6-173.6173.4-159.600111.7C4 E10 L11 E12C4-E8 VanDerWaalsContact O-CB 3.32Å; C4-E8 WeakPolarHBondContact O-CB 3.49Å; C4-E8 PolarHBondContact O-N 2.94Å; E8-E10 VanDerWaalsContact C-N 3.3Å; E8-E10 PolarHBondContact O-N 3.05Å; E8-L11 WeakPolarHBondContact O-CB 3.2Å; E8-L11 PolarHBondContact O-N 2.96Å; E8-L11 VanDerWaalsContact O-N 3.12Å; E8-E12 WeakPolarHBondContact O-CG 3.48Å; E8-E12 PolarHBondContact O-N 3.28Å
9R86.8Confident83Confident145 Ų14594.9 Ų94.955%0.54746%0.462SS..Hα-helixtrans-60.1-36.7175.2-80.7-176.8-69.2164.7-3.8113.6A5 V7 K13A5-R9 WeakPolarHBondContact O-CB 3.26Å; A5-R9 VanDerWaalsContact O-CG 3.28Å; A5-R9 WeakPolarHBondContact O-CG 3.34Å; A5-R9 PolarHBondContact O-N 3.16Å; A5-R9 PolarHBondContact O-NE 3.26Å; A5-R9 VanDerWaalsContact O-NE 3.11Å; V7-R9 PolarHBondContact O-N 3.47Å; R9-K13 WeakPolarHBondContact O-CD 3.3Å; R9-K13 VanDerWaalsContact O-CG 3.26Å; R9-K13 WeakPolarHBondContact O-CG 2.83Å; R9-K13 PolarHBondContact O-N 3.09Å
10E85.8Confident83.1Confident54 Ų5494.6 Ų94.625%0.25246%0.46SS..Hα-helixtrans-74.8-35.7175.8-67.7-56.9128.800111.5C6 V7 E8 K13 V14 V89 A92C6-E10 PolarHBondContact O-N 3.05Å; V7-E10 PolarHBondContact O-N 3.41Å; V7-E10 VanDerWaalsContact O-N 3.13Å; E8-E10 VanDerWaalsContact C-N 3.3Å; E8-E10 PolarHBondContact O-N 3.05Å; E10-K13 PolarHBondContact O-N 3.16Å; E10-K13 IonicContact OE1-NZ 2.67Å; E10-K13 PolarHBondContact OE1-NZ 3.4Å; E10-V14 WeakPolarHBondContact O-CG2 3.17Å; E10-V14 PolarHBondContact O-N 3.03Å; E10-V89 HydrophobicContact CB-CG2 4.28Å; E10-A92 HydrophobicContact CG-CB 4.29Å
11L89.1Confident83.3Confident82 Ų8292.4 Ų92.443%0.42945%0.448SS..Hα-helixtrans-62.8-47.8174.6-176.367.4000111.6V7 E8 K13 V14 L15V7-L11 WeakPolarHBondContact O-CB 3.36Å; V7-L11 PolarHBondContact O-N 3.05Å; E8-L11 WeakPolarHBondContact O-CB 3.2Å; E8-L11 PolarHBondContact O-N 2.96Å; E8-L11 VanDerWaalsContact O-N 3.12Å; L11-K13 VanDerWaalsContact C-N 3.32Å; L11-K13 PolarHBondContact O-N 3.41Å; L11-V14 PolarHBondContact O-N 3.08Å; L11-L15 HydrophobicContact CG-CD1 4.1Å; L11-L15 HydrophobicContact CG-CG 4.44Å; L11-L15 WeakPolarHBondContact O-CG 3.19Å; L11-L15 PolarHBondContact O-N 2.61Å
12E89.9Confident84.6Confident113 Ų11384 Ų8453%0.52841%0.412SS..Hα-helixtrans-58-42.8177.1-76.2-176.9160.500112.1E8 V14 L15 H16E8-E12 WeakPolarHBondContact O-CG 3.48Å; E8-E12 PolarHBondContact O-N 3.28Å; E12-V14 VanDerWaalsContact C-N 3.26Å; E12-V14 PolarHBondContact O-N 3Å; E12-L15 PolarHBondContact O-N 3.32Å; E12-H16 WeakPolarHBondContact O-CB 2.95Å; E12-H16 PolarHBondContact O-N 2.83Å
13K86.8Confident85.4Confident111 Ų11181.2 Ų81.248%0.48340%0.399SS..Hα-helixtrans-60.1-37.9175.7-72.8170-168.81730112.1R9 E10 L11 R17R9-K13 WeakPolarHBondContact O-CD 3.3Å; R9-K13 VanDerWaalsContact O-CG 3.26Å; R9-K13 WeakPolarHBondContact O-CG 2.83Å; R9-K13 PolarHBondContact O-N 3.09Å; E10-K13 PolarHBondContact O-N 3.16Å; E10-K13 IonicContact OE1-NZ 2.67Å; E10-K13 PolarHBondContact OE1-NZ 3.4Å; L11-K13 VanDerWaalsContact C-N 3.32Å; L11-K13 PolarHBondContact O-N 3.41Å; K13-R17 VanDerWaalsContact O-CG 3.3Å; K13-R17 WeakPolarHBondContact O-CG 3.38Å; K13-R17 PolarHBondContact O-N 2.96Å
14V88.1Confident86Confident13 Ų1379.5 Ų79.58%0.07939%0.391CS..Hα-helixtrans-72-48.2177.8172.90000110.3E10 L11 E12 H16 R17 F18 S85 V86 V89E10-V14 WeakPolarHBondContact O-CG2 3.17Å; E10-V14 PolarHBondContact O-N 3.03Å; L11-V14 PolarHBondContact O-N 3.08Å; E12-V14 VanDerWaalsContact C-N 3.26Å; E12-V14 PolarHBondContact O-N 3Å; V14-H16 VanDerWaalsContact C-N 3.31Å; V14-H16 PolarHBondContact O-N 3.33Å; V14-R17 WeakPolarHBondContact O-CA 3.14Å; V14-R17 WeakPolarHBondContact O-CB 3.35Å; V14-R17 PolarHBondContact O-N 3.23Å; V14-F18 HydrophobicContact CG1-CD2 3.52Å; V14-F18 HydrophobicContact CG1-CE2 3.45Å; V14-F18 VanDerWaalsContact CG1-CE2 3.45Å; V14-F18 WeakPolarHBondContact O-CD2 3.45Å; V14-F18 PolarHBondContact O-N 3.04Å; V14-S85 WeakPolarHBondContact CG2-O 3.32Å; V14-V86 HydrophobicContact CG1-CG2 4.22Å; V14-V89 HydrophobicContact CB-CG2 4.3Å; V14-V89 HydrophobicContact CG2-CG2 3.57Å
15L88.2Confident86.5Confident97 Ų9776.9 Ų76.951%0.50837%0.374SS..Hα-helixtrans-56-45.5176.8-71172.8000111.8L11 E12 R17 F18 V19L11-L15 HydrophobicContact CG-CD1 4.1Å; L11-L15 HydrophobicContact CG-CG 4.44Å; L11-L15 WeakPolarHBondContact O-CG 3.19Å; L11-L15 PolarHBondContact O-N 2.61Å; E12-L15 PolarHBondContact O-N 3.32Å; L15-R17 VanDerWaalsContact C-N 3.33Å; L15-R17 PolarHBondContact O-N 3.39Å; L15-F18 PolarHBondContact O-N 3.38Å; L15-V19 WeakPolarHBondContact O-CG2 3.25Å; L15-V19 PolarHBondContact O-N 3Å
16H88.1Confident86.9Confident121 Ų12180.8 Ų80.856%0.5639%0.385SS*.Hα-helixtrans-60.6-42176-173.667.2000112.1E12 V14 V19 M20E12-H16 WeakPolarHBondContact O-CB 2.95Å; E12-H16 PolarHBondContact O-N 2.83Å; V14-H16 VanDerWaalsContact C-N 3.31Å; V14-H16 PolarHBondContact O-N 3.33Å; H16-V19 PolarHBondContact O-N 3.25Å; H16-M20 WeakPolarHBondContact O-CB 3.46Å; H16-M20 WeakPolarHBondContact O-CG 3.43Å; H16-M20 PolarHBondContact O-N 3.31Å
17R85.7Confident87.3Confident139 Ų13984.3 Ų84.353%0.52540%0.398SS..Hα-helixtrans-63.7-39.7174.9-75.8175.1-177.1-148.8-8.1112.5K13 V14 L15 Y21 S85K13-R17 VanDerWaalsContact O-CG 3.3Å; K13-R17 WeakPolarHBondContact O-CG 3.38Å; K13-R17 PolarHBondContact O-N 2.96Å; V14-R17 WeakPolarHBondContact O-CA 3.14Å; V14-R17 WeakPolarHBondContact O-CB 3.35Å; V14-R17 PolarHBondContact O-N 3.23Å; L15-R17 VanDerWaalsContact C-N 3.33Å; L15-R17 PolarHBondContact O-N 3.39Å; R17-Y21 WeakPolarHBondContact O-CB 3.24Å; R17-Y21 PolarHBondContact O-N 2.87Å; R17-S85 WeakPolarHBondContact CD-OG 3.35Å; R17-S85 PolarHBondContact NH1-OG 3.28Å
18F86.7Confident87.4Confident90 Ų9087.7 Ų87.740%0.39541%0.409SS..Hα-helixtrans-64.3-45.5176.7-92.3-84.8000111.8V14 L15 Y21 G22 I82 V86V14-F18 HydrophobicContact CG1-CD2 3.52Å; V14-F18 HydrophobicContact CG1-CE2 3.45Å; V14-F18 VanDerWaalsContact CG1-CE2 3.45Å; V14-F18 WeakPolarHBondContact O-CD2 3.45Å; V14-F18 PolarHBondContact O-N 3.04Å; L15-F18 PolarHBondContact O-N 3.38Å; F18-Y21 PolarHBondContact O-N 3.04Å; F18-G22 PolarHBondContact O-N 3.14Å; F18-I82 HydrophobicContact CD1-CG2 4.33Å; F18-I82 HydrophobicContact CD2-CG2 4.19Å; F18-I82 HydrophobicContact CE1-CD1 4.46Å; F18-I82 HydrophobicContact CE1-CG2 3.58Å; F18-I82 HydrophobicContact CE2-CG2 3.4Å; F18-I82 VanDerWaalsContact CE2-CG2 3.4Å; F18-I82 HydrophobicContact CZ-CG2 3.07Å; F18-V86 HydrophobicContact CE2-CG2 3.86Å; F18-V86 HydrophobicContact CZ-CG2 4.08Å
19V88.1Confident87.5Confident82 Ų8286.4 Ų86.450%0.49741%0.405SS..Hα-helixtrans-62.8-47.1178171.70000110.9L15 H16 Y21 G22 H23L15-V19 WeakPolarHBondContact O-CG2 3.25Å; L15-V19 PolarHBondContact O-N 3Å; H16-V19 PolarHBondContact O-N 3.25Å; V19-Y21 VanDerWaalsContact C-N 3.33Å; V19-Y21 PolarHBondContact O-N 3.35Å; V19-G22 PolarHBondContact O-N 3.04Å; V19-H23 PolarHBondContact O-CD2 3.37Å; V19-H23 PolarHBondContact O-N 2.83Å
20M86.1Confident87.7Confident87 Ų8783.7 Ų83.743%0.42940%0.401SS..Hα-helixtrans-63.9-38.5177.5-68-64.6-80.100112.1H16 Q24H16-M20 WeakPolarHBondContact O-CB 3.46Å; H16-M20 WeakPolarHBondContact O-CG 3.43Å; H16-M20 PolarHBondContact O-N 3.31Å; M20-Q24 WeakPolarHBondContact O-CB 3.11Å; M20-Q24 WeakPolarHBondContact O-CG 3.41Å; M20-Q24 PolarHBondContact O-N 3.45Å; M20-Q24 VanDerWaalsContact O-N 3.09Å
21Y86.4Confident87.8Confident50 Ų5085.8 Ų85.820%0.19641%0.411CS..Hα-helixtrans-65.3-44.7174.4173.9-99.7000111.8R17 F18 V19 Q24 S25 L75 R78 I82R17-Y21 WeakPolarHBondContact O-CB 3.24Å; R17-Y21 PolarHBondContact O-N 2.87Å; F18-Y21 PolarHBondContact O-N 3.04Å; V19-Y21 VanDerWaalsContact C-N 3.33Å; V19-Y21 PolarHBondContact O-N 3.35Å; Y21-Q24 PolarHBondContact O-N 2.96Å; Y21-S25 WeakPolarHBondContact CE2-OG 3.14Å; Y21-S25 VanDerWaalsContact O-CB 3.24Å; Y21-S25 WeakPolarHBondContact O-CB 3.29Å; Y21-S25 PolarHBondContact O-N 3.43Å; Y21-S25 PolarHBondContact O-OG 3.36Å; Y21-L75 HydrophobicContact CE2-CD2 4.3Å; Y21-L75 PolarHBondContact OH-O 3.4Å; Y21-R78 HydrophobicContact CD2-CB 3.9Å; Y21-R78 HydrophobicContact CE2-CB 3.5Å; Y21-R78 VanDerWaalsContact CE2-CB 3.5Å; Y21-I82 HydrophobicContact CD1-CD1 3.62Å; Y21-I82 HydrophobicContact CD2-CD1 4.13Å; Y21-I82 HydrophobicContact CE1-CD1 3.99Å; Y21-I82 HydrophobicContact CE2-CD1 4.47Å; Y21-I82 HydrophobicContact CG-CD1 3.69Å
22G86Confident87.8Confident25 Ų2583 Ų8326%0.25840%0.397SS..Hα-helixtrans-56.4-56.1177.200000111.4F18 V19 Q24 S25 E26F18-G22 PolarHBondContact O-N 3.14Å; V19-G22 PolarHBondContact O-N 3.04Å; G22-Q24 PolarHBondContact O-N 3.43Å; G22-S25 PolarHBondContact O-N 2.93Å; G22-S25 VanDerWaalsContact O-N 3.12Å; G22-E26 WeakPolarHBondContact O-CG 3.35Å; G22-E26 PolarHBondContact O-N 3.12Å
23H88.4Confident87.8Confident117 Ų11782.9 Ų82.954%0.54240%0.399SS..Hα-helixtrans-57.9-46.7178.7-78.3-57.8000113.2V19 S25 E26 E27V19-H23 PolarHBondContact O-CD2 3.37Å; V19-H23 PolarHBondContact O-N 2.83Å; H23-S25 VanDerWaalsContact C-N 3.26Å; H23-S25 PolarHBondContact O-N 3.2Å; H23-E26 PolarHBondContact O-N 3.18Å; H23-E27 WeakPolarHBondContact O-CB 3.36Å; H23-E27 PolarHBondContact O-N 2.94Å
24Q86.3Confident88Confident70 Ų7083.8 Ų83.833%0.32740%0.399SS..Hα-helixtrans-67.7-28.3179.4-71.61778.300112.9M20 Y21 G22 R28M20-Q24 WeakPolarHBondContact O-CB 3.11Å; M20-Q24 WeakPolarHBondContact O-CG 3.41Å; M20-Q24 PolarHBondContact O-N 3.45Å; M20-Q24 VanDerWaalsContact O-N 3.09Å; Y21-Q24 PolarHBondContact O-N 2.96Å; G22-Q24 PolarHBondContact O-N 3.43Å; Q24-R28 WeakPolarHBondContact O-CB 3.45Å; Q24-R28 WeakPolarHBondContact O-CD 3.32Å; Q24-R28 WeakPolarHBondContact O-CG 3.28Å; Q24-R28 PolarHBondContact O-N 3.14Å
25S86.3Confident87.9Confident12 Ų1284.9 Ų84.98%0.08441%0.408CS..Hα-helixtrans-76-45.1177.1-57.40000110.7Y21 G22 H23 R28 L29 L75Y21-S25 WeakPolarHBondContact CE2-OG 3.14Å; Y21-S25 VanDerWaalsContact O-CB 3.24Å; Y21-S25 WeakPolarHBondContact O-CB 3.29Å; Y21-S25 PolarHBondContact O-N 3.43Å; Y21-S25 PolarHBondContact O-OG 3.36Å; G22-S25 PolarHBondContact O-N 2.93Å; G22-S25 VanDerWaalsContact O-N 3.12Å; H23-S25 VanDerWaalsContact C-N 3.26Å; H23-S25 PolarHBondContact O-N 3.2Å; S25-R28 PolarHBondContact O-N 2.77Å; S25-L29 WeakPolarHBondContact O-CB 3.36Å; S25-L29 WeakPolarHBondContact O-CG 3.47Å; S25-L29 PolarHBondContact O-N 3.29Å; S25-L75 WeakPolarHBondContact OG-CD2 3.46Å
26E89.3Confident87.9Confident119 Ų11983.4 Ų83.456%0.55640%0.403SS*.Hα-helixtrans-59.9-51.1175.9-75.117717500111.5G22 H23 R28 L29 D30G22-E26 WeakPolarHBondContact O-CG 3.35Å; G22-E26 PolarHBondContact O-N 3.12Å; H23-E26 PolarHBondContact O-N 3.18Å; E26-R28 VanDerWaalsContact C-N 3.28Å; E26-R28 PolarHBondContact O-N 3.04Å; E26-L29 PolarHBondContact O-N 3.25Å; E26-L29 VanDerWaalsContact O-N 3.15Å; E26-D30 WeakPolarHBondContact O-CB 3.26Å; E26-D30 PolarHBondContact O-N 2.73Å
27E89.2Confident87.9Confident116 Ų11679.8 Ų79.854%0.54239%0.39SS..Hα-helixtrans-56.4-43.3-179.4-173.9179.9-165.900112H23 D30 E31H23-E27 WeakPolarHBondContact O-CB 3.36Å; H23-E27 PolarHBondContact O-N 2.94Å; E27-D30 PolarHBondContact O-N 3.35Å; E27-E31 WeakPolarHBondContact O-CG 3.03Å; E27-E31 PolarHBondContact O-N 3.25Å
28R86.7Confident87.9Confident87 Ų8778.6 Ų78.633%0.32839%0.391SS..Hα-helixtrans-72.2-38.2179-72.2177.1178.2-142.8-2.6113.1Q24 S25 E26 D30 E31 L32 T71Q24-R28 WeakPolarHBondContact O-CB 3.45Å; Q24-R28 WeakPolarHBondContact O-CD 3.32Å; Q24-R28 WeakPolarHBondContact O-CG 3.28Å; Q24-R28 PolarHBondContact O-N 3.14Å; S25-R28 PolarHBondContact O-N 2.77Å; E26-R28 VanDerWaalsContact C-N 3.28Å; E26-R28 PolarHBondContact O-N 3.04Å; R28-D30 VanDerWaalsContact C-N 3.3Å; R28-E31 PolarHBondContact O-N 3.35Å; R28-L32 WeakPolarHBondContact O-CG 3.34Å; R28-L32 PolarHBondContact O-N 3.18Å; R28-T71 HydrophobicContact CB-CG2 4.24Å
29L89.2Confident87.8Confident85 Ų8575.2 Ų75.245%0.44538%0.376SS..Hα-helixtrans-65.7-38174.7-72.9171.6000110.5S25 E26 L32 L33 L75S25-L29 WeakPolarHBondContact O-CB 3.36Å; S25-L29 WeakPolarHBondContact O-CG 3.47Å; S25-L29 PolarHBondContact O-N 3.29Å; E26-L29 PolarHBondContact O-N 3.25Å; E26-L29 VanDerWaalsContact O-N 3.15Å; L29-L32 PolarHBondContact O-N 3.35Å; L29-L33 VanDerWaalsContact O-CB 3.29Å; L29-L33 WeakPolarHBondContact O-CB 3.44Å; L29-L33 PolarHBondContact O-N 2.65Å; L29-L75 HydrophobicContact CD1-CD1 4.48Å; L29-L75 HydrophobicContact CD2-CD1 4.03Å; L29-L75 HydrophobicContact CG-CD1 4.25Å
30D91.2Very high87.7Confident87 Ų8779 Ų7947%0.46538%0.382SS..Hα-helixtrans-66.4-39.3175.2-76.7-20.2000112.5E26 E27 R28 L33 R34E26-D30 WeakPolarHBondContact O-CB 3.26Å; E26-D30 PolarHBondContact O-N 2.73Å; E27-D30 PolarHBondContact O-N 3.35Å; R28-D30 VanDerWaalsContact C-N 3.3Å; D30-L33 PolarHBondContact O-N 3.41Å; D30-R34 WeakPolarHBondContact O-CB 3.4Å; D30-R34 WeakPolarHBondContact O-CG 3.34Å; D30-R34 PolarHBondContact O-N 2.89Å; D30-R34 PolarHBondContact O-NE 3.49Å
31E88.5Confident87.6Confident99 Ų9977.6 Ų77.646%0.46338%0.384SS..Hα-helixtrans-62.4-44.5172.9-77.5178.4171.400112.1E27 R28 L33 R34 S35E27-E31 WeakPolarHBondContact O-CG 3.03Å; E27-E31 PolarHBondContact O-N 3.25Å; R28-E31 PolarHBondContact O-N 3.35Å; E31-L33 VanDerWaalsContact C-N 3.35Å; E31-R34 PolarHBondContact O-N 3.36Å; E31-S35 PolarHBondContact O-N 2.93Å
32L88.9Confident87.3Confident23 Ų2379.1 Ų79.112%0.1239%0.393CS..Hα-helixtrans-63.2-42.7175.1-72.5177.3000111.5R28 L29 R34 S35 V36 N67 I68 T71R28-L32 WeakPolarHBondContact O-CG 3.34Å; R28-L32 PolarHBondContact O-N 3.18Å; L29-L32 PolarHBondContact O-N 3.35Å; L32-R34 VanDerWaalsContact C-N 3.34Å; L32-S35 PolarHBondContact O-N 3.03Å; L32-V36 VanDerWaalsContact O-CG2 3.31Å; L32-V36 WeakPolarHBondContact O-CG2 3.08Å; L32-V36 PolarHBondContact O-N 3.34Å; L32-N67 HydrophobicContact CD2-CB 4.08Å; L32-I68 HydrophobicContact CD1-CG1 4.28Å; L32-I68 HydrophobicContact CD2-CG1 3.95Å; L32-T71 HydrophobicContact CD1-CG2 3.68Å
33L90.2Very high86.8Confident110 Ų11082 Ų8258%0.57640%0.402SS*.Hα-helixtrans-65.5-39179.4-165.4142000111.4L29 D30 E31 C37L29-L33 VanDerWaalsContact O-CB 3.29Å; L29-L33 WeakPolarHBondContact O-CB 3.44Å; L29-L33 PolarHBondContact O-N 2.65Å; D30-L33 PolarHBondContact O-N 3.41Å; E31-L33 VanDerWaalsContact C-N 3.35Å; L33-C37 WeakPolarHBondContact O-CB 3.43Å; L33-C37 PolarHBondContact O-N 2.99Å; L33-C37 PolarHBondContact O-SG 3.47Å
34R89.9Confident86.4Confident131 Ų13182.2 Ų82.249%0.49441%0.412SS..Hα-helixtrans-59.9-49.8170.2-81.6179.7-97.1137.4-5.4111.6D30 E31 L32 V36 C37 E38D30-R34 WeakPolarHBondContact O-CB 3.4Å; D30-R34 WeakPolarHBondContact O-CG 3.34Å; D30-R34 PolarHBondContact O-N 2.89Å; D30-R34 PolarHBondContact O-NE 3.49Å; E31-R34 PolarHBondContact O-N 3.36Å; L32-R34 VanDerWaalsContact C-N 3.34Å; R34-V36 VanDerWaalsContact C-N 3.34Å; R34-V36 PolarHBondContact O-N 2.92Å; R34-C37 WeakPolarHBondContact O-CB 3.43Å; R34-C37 PolarHBondContact O-N 3.39Å; R34-C37 VanDerWaalsContact O-N 3.14Å; R34-E38 WeakPolarHBondContact O-CG 3.4Å; R34-E38 PolarHBondContact O-N 3.07Å
35S86.1Confident85.8Confident36 Ų3682.7 Ų82.725%0.25243%0.428SS..Hα-helixtrans-59.2-43178.6-179.40000112.4E31 L32 E38 I39E31-S35 PolarHBondContact O-N 2.93Å; L32-S35 PolarHBondContact O-N 3.03Å; S35-E38 PolarHBondContact O-N 2.78Å; S35-I39 VanDerWaalsContact O-CG1 3.3Å; S35-I39 WeakPolarHBondContact O-CG1 3.1Å; S35-I39 PolarHBondContact O-N 3.49Å
36V88.6Confident84.9Confident66 Ų6686 Ų8640%0.444%0.441SS..Hα-helixtrans-65.5-41.4175.8172.40000111.5L32 R34 I39 R40 I68L32-V36 VanDerWaalsContact O-CG2 3.31Å; L32-V36 WeakPolarHBondContact O-CG2 3.08Å; L32-V36 PolarHBondContact O-N 3.34Å; R34-V36 VanDerWaalsContact C-N 3.34Å; R34-V36 PolarHBondContact O-N 2.92Å; V36-I39 PolarHBondContact O-N 3.02Å; V36-R40 WeakPolarHBondContact O-CB 3.47Å; V36-R40 PolarHBondContact O-N 3.48Å; V36-I68 HydrophobicContact CG2-CD1 4.03Å
37C88.6Confident83.3Confident44 Ų4485.1 Ų85.130%0.29745%0.454SS..Hα-helixtrans-63.5-40176.1-800000112.5L33 R34 R40 A41L33-C37 WeakPolarHBondContact O-CB 3.43Å; L33-C37 PolarHBondContact O-N 2.99Å; L33-C37 PolarHBondContact O-SG 3.47Å; R34-C37 WeakPolarHBondContact O-CB 3.43Å; R34-C37 PolarHBondContact O-N 3.39Å; R34-C37 VanDerWaalsContact O-N 3.14Å; C37-R40 PolarHBondContact O-N 3.15Å; C37-A41 WeakPolarHBondContact O-CB 3.19Å; C37-A41 PolarHBondContact O-N 2.81Å
38E85.9Confident82Confident115 Ų11582.9 Ų82.954%0.53746%0.461SS..Hα-helixtrans-64.3-46.2176.3-75.1171.1-173.400111.6R34 S35 R40 A41 Q42R34-E38 WeakPolarHBondContact O-CG 3.4Å; R34-E38 PolarHBondContact O-N 3.07Å; S35-E38 PolarHBondContact O-N 2.78Å; E38-R40 VanDerWaalsContact C-N 3.3Å; E38-R40 PolarHBondContact O-N 3.27Å; E38-A41 PolarHBondContact O-N 3.34Å; E38-Q42 WeakPolarHBondContact O-CG 3.43Å; E38-Q42 PolarHBondContact O-N 3.43Å
39I84.6Confident80.7Confident19 Ų1983.4 Ų83.410%0.09747%0.474CS..Hα-helixtrans-61.1-41.9175.7-68.5167.6000110.5S35 V36 Q42 L43 M61 C64S35-I39 VanDerWaalsContact O-CG1 3.3Å; S35-I39 WeakPolarHBondContact O-CG1 3.1Å; S35-I39 PolarHBondContact O-N 3.49Å; V36-I39 PolarHBondContact O-N 3.02Å; I39-Q42 PolarHBondContact O-N 2.98Å; I39-L43 HydrophobicContact CG2-CD1 4.1Å; I39-L43 WeakPolarHBondContact O-CG 3.45Å; I39-L43 PolarHBondContact O-N 3.48Å; I39-M61 HydrophobicContact CG2-CG 3.67Å; I39-M61 HydrophobicContact CG2-SD 4.44Å; I39-C64 HydrophobicContact CD1-CB 3.5Å; I39-C64 VanDerWaalsContact CD1-CB 3.5Å
40R84.5Confident79.5Confident160 Ų16086.3 Ų86.360%0.60449%0.485SS*.Hα-helixtrans-62.8-42.8175.1-174.9-177.366.3-172.8-2.3111.9V36 C37 E38 Q42 L43 V44V36-R40 WeakPolarHBondContact O-CB 3.47Å; V36-R40 PolarHBondContact O-N 3.48Å; C37-R40 PolarHBondContact O-N 3.15Å; E38-R40 VanDerWaalsContact C-N 3.3Å; E38-R40 PolarHBondContact O-N 3.27Å; R40-Q42 VanDerWaalsContact C-N 3.35Å; R40-L43 PolarHBondContact O-N 3.38Å; R40-V44 WeakPolarHBondContact O-CG2 3.2Å; R40-V44 PolarHBondContact O-N 3.46Å
41A84.3Confident78.1Confident59 Ų5989 Ų8949%0.48850%0.5SS..Hα-helixtrans-64.5-40.717800000111.4C37 E38 V44 A45C37-A41 WeakPolarHBondContact O-CB 3.19Å; C37-A41 PolarHBondContact O-N 2.81Å; E38-A41 PolarHBondContact O-N 3.34Å; A41-V44 PolarHBondContact O-N 3.02Å; A41-A45 WeakPolarHBondContact O-CB 3.47Å; A41-A45 PolarHBondContact O-N 2.71Å
42Q80.2Confident76.9Confident82 Ų8287.2 Ų87.238%0.38350%0.502SS..Hα-helixtrans-59.1-52.6172.5-70.7170.816.700110.3E38 I39 R40 V44 A45 F46 L57E38-Q42 WeakPolarHBondContact O-CG 3.43Å; E38-Q42 PolarHBondContact O-N 3.43Å; I39-Q42 PolarHBondContact O-N 2.98Å; R40-Q42 VanDerWaalsContact C-N 3.35Å; Q42-V44 VanDerWaalsContact C-N 3.26Å; Q42-V44 PolarHBondContact O-N 3.39Å; Q42-A45 CarbonylContact O-C 3.57Å; Q42-A45 PolarHBondContact O-N 2.87Å; Q42-F46 WeakPolarHBondContact O-CD2 3.45Å; Q42-F46 PolarHBondContact O-N 3.36Å; Q42-L57 HydrophobicContact CB-CD1 4.28Å
43L76.9Confident75.9Confident84 Ų8489.4 Ų89.444%0.4451%0.513SS..Hα-helixtrans-54.1-37.8178-78.4164.6000113.7I39 R40 L57 M61I39-L43 HydrophobicContact CG2-CD1 4.1Å; I39-L43 WeakPolarHBondContact O-CG 3.45Å; I39-L43 PolarHBondContact O-N 3.48Å; R40-L43 PolarHBondContact O-N 3.38Å; L43-L57 HydrophobicContact CD2-CD2 3.49Å; L43-L57 VanDerWaalsContact CD2-CD2 3.49Å; L43-L57 HydrophobicContact CD2-CG 4.43Å; L43-L57 HydrophobicContact CG-CD2 4.06Å; L43-M61 HydrophobicContact CD1-SD 4.39Å
44V79.7Confident75Confident123 Ų12389 Ų8975%0.74551%0.512SS*.Hα-helixtrans-76.4-33.3178.1173.70000111.9R40 A41 Q42 F46R40-V44 WeakPolarHBondContact O-CG2 3.2Å; R40-V44 PolarHBondContact O-N 3.46Å; A41-V44 PolarHBondContact O-N 3.02Å; Q42-V44 VanDerWaalsContact C-N 3.26Å; Q42-V44 PolarHBondContact O-N 3.39Å; V44-F46 VanDerWaalsContact C-N 3.3Å
45A73.5Confident74.4Confident80 Ų8086 Ų8666%0.66151%0.51SS*.Hα-helixtrans-79.1-9.7177.700000113.8A41 Q42 A47A41-A45 WeakPolarHBondContact O-CB 3.47Å; A41-A45 PolarHBondContact O-N 2.71Å; Q42-A45 CarbonylContact O-C 3.57Å; Q42-A45 PolarHBondContact O-N 2.87Å; A45-A47 PolarHBondContact O-N 3.28Å
46F66.4Low74.1Confident82 Ų8287.8 Ų87.836%0.3652%0.519SS..  trans-71.670178.8-105-82.7000112Q42 V44 D53 L57Q42-F46 WeakPolarHBondContact O-CD2 3.45Å; Q42-F46 PolarHBondContact O-N 3.36Å; V44-F46 VanDerWaalsContact C-N 3.3Å; F46-D53 HydrophobicContact CE1-CB 3.77Å; F46-D53 HydrophobicContact CZ-CB 3.83Å; F46-L57 HydrophobicContact CD2-CD2 3.95Å; F46-L57 HydrophobicContact CE2-CD1 4.35Å; F46-L57 HydrophobicContact CE2-CD2 3.74Å; F46-L57 HydrophobicContact CE2-CG 4.45Å; F46-L57 HydrophobicContact CZ-CD2 4.28Å
47A55.7Low73.6Confident100 Ų10085.3 Ų85.383%0.82650%0.504SS*.  trans-100.975.1168.900000110.3A45A45-A47 PolarHBondContact O-N 3.28Å
48G62.4Low73.2Confident68 Ų6886.9 Ų86.970%0.70152%0.516SS*.SBendtrans87.583.3160.300000118.3
49V60.1Low73.2Confident98 Ų9887.4 Ų87.459%0.59452%0.518SS*.  trans-152.2171.6159.2-1660000110.4
50Q64Low73.1Confident147 Ų14790 Ų9069%0.68753%0.532SS*.  trans-56.4161.4-160.7-61.7170.6100119.1A52 D53Q50-A52 PolarHBondContact O-N 2.8Å; Q50-A52 VanDerWaalsContact O-N 3.07Å; Q50-D53 PolarHBondContact O-N 2.81Å
51D61.4Low73.1Confident143 Ų14386.2 Ų86.277%0.76552%0.522SS*.Hα-helixtrans-53.1-27.3179.6-1260.5000114.9S55D51-S55 PolarHBondContact O-N 3.05Å
52A62.4Low73.2Confident61 Ų6186.5 Ų86.550%0.50453%0.525SS..Hα-helixtrans-66.8-35.7177.800000112.8Q50 S55 V56Q50-A52 PolarHBondContact O-N 2.8Å; Q50-A52 VanDerWaalsContact O-N 3.07Å; A52-S55 PolarHBondContact O-N 2.98Å; A52-V56 WeakPolarHBondContact O-CG2 3.03Å; A52-V56 PolarHBondContact O-N 3.22Å
53D68.9Low73.6Confident69 Ų6987 Ų8737%0.36953%0.527SS..Hα-helixtrans-75.5-29.4-178.4-65.5-35.7000111.9F46 Q50 L57F46-D53 HydrophobicContact CE1-CB 3.77Å; F46-D53 HydrophobicContact CZ-CB 3.83Å; Q50-D53 PolarHBondContact O-N 2.81Å; D53-L57 WeakPolarHBondContact O-CB 3.38Å; D53-L57 PolarHBondContact O-N 3.32Å
54L71.5Confident74.1Confident103 Ų10383.4 Ų83.454%0.53951%0.508SS..Hα-helixtrans-66.8-39.1172.9-109110.8000112.4L57 S58L54-L57 PolarHBondContact O-N 2.86Å; L54-S58 WeakPolarHBondContact O-CB 3.49Å; L54-S58 PolarHBondContact O-N 3.02Å
55S76.4Confident74.5Confident67 Ų6781.5 Ų81.547%0.46950%0.5SS..Hα-helixtrans-64.7-42.8177.4-1740000111.5D51 A52 S58 Q59D51-S55 PolarHBondContact O-N 3.05Å; A52-S55 PolarHBondContact O-N 2.98Å; S55-S58 PolarHBondContact O-N 2.86Å; S55-Q59 WeakPolarHBondContact O-CG 3.26Å; S55-Q59 PolarHBondContact O-N 3.31Å
56V79.8Confident75.3Confident73 Ų7383 Ų8344%0.44249%0.491SS..Hα-helixtrans-64.9-43.2176.6175.70000111.3A52 Q59 N60A52-V56 WeakPolarHBondContact O-CG2 3.03Å; A52-V56 PolarHBondContact O-N 3.22Å; V56-Q59 PolarHBondContact O-N 3.11Å; V56-N60 VanDerWaalsContact O-CG 3.25Å; V56-N60 PolarHBondContact O-N 2.89Å; V56-N60 PolarHBondContact O-ND2 3.03Å
57L78.3Confident76.4Confident15 Ų1581.8 Ų81.88%0.07949%0.489CS..Hα-helixtrans-64.1-41.9177.5-17265.3000112.3Q42 L43 F46 D53 L54 Q59 N60 M61Q42-L57 HydrophobicContact CB-CD1 4.28Å; L43-L57 HydrophobicContact CD2-CD2 3.49Å; L43-L57 VanDerWaalsContact CD2-CD2 3.49Å; L43-L57 HydrophobicContact CD2-CG 4.43Å; L43-L57 HydrophobicContact CG-CD2 4.06Å; F46-L57 HydrophobicContact CD2-CD2 3.95Å; F46-L57 HydrophobicContact CE2-CD1 4.35Å; F46-L57 HydrophobicContact CE2-CD2 3.74Å; F46-L57 HydrophobicContact CE2-CG 4.45Å; F46-L57 HydrophobicContact CZ-CD2 4.28Å; D53-L57 WeakPolarHBondContact O-CB 3.38Å; D53-L57 PolarHBondContact O-N 3.32Å; L54-L57 PolarHBondContact O-N 2.86Å; L57-Q59 PolarHBondContact O-N 2.83Å; L57-N60 PolarHBondContact O-N 3.09Å; L57-M61 WeakPolarHBondContact O-CG 3.28Å; L57-M61 PolarHBondContact O-N 3.49Å
58S81.2Confident78Confident77 Ų7780 Ų8054%0.53847%0.465SS..Hα-helixtrans-60.7-42.6174.8-178.80000112L54 S55 M61 A62L54-S58 WeakPolarHBondContact O-CB 3.49Å; L54-S58 PolarHBondContact O-N 3.02Å; S55-S58 PolarHBondContact O-N 2.86Å; S58-M61 PolarHBondContact O-N 2.82Å; S58-A62 WeakPolarHBondContact O-CB 3.35Å; S58-A62 PolarHBondContact O-N 3.38Å
59Q84.3Confident79.4Confident125 Ų12583.2 Ų83.258%0.58446%0.459SS*.Hα-helixtrans-64-43.1174.5-74.2179.9-2.700112.2S55 V56 L57 M61 A62 Q63S55-Q59 WeakPolarHBondContact O-CG 3.26Å; S55-Q59 PolarHBondContact O-N 3.31Å; V56-Q59 PolarHBondContact O-N 3.11Å; L57-Q59 PolarHBondContact O-N 2.83Å; Q59-M61 PolarHBondContact O-N 3.37Å; Q59-A62 PolarHBondContact O-N 3.17Å; Q59-Q63 WeakPolarHBondContact O-CB 3.4Å; Q59-Q63 PolarHBondContact O-N 3.14Å
60N83.9Confident80.9Confident73 Ų7383.2 Ų83.239%0.3945%0.453SS..Hα-helixtrans-63.6-40.5177.2-71.1-18.8000112V56 L57 Q63 C64V56-N60 VanDerWaalsContact O-CG 3.25Å; V56-N60 PolarHBondContact O-N 2.89Å; V56-N60 PolarHBondContact O-ND2 3.03Å; L57-N60 PolarHBondContact O-N 3.09Å; N60-Q63 PolarHBondContact O-N 3.07Å; N60-C64 WeakPolarHBondContact O-CB 3.47Å; N60-C64 PolarHBondContact O-N 2.99Å
61M83Confident82Confident82 Ų8277.2 Ų77.240%0.40443%0.426SS..Hα-helixtrans-64.1-45.2173.7-74.4-179.67400112I39 L43 L57 S58 Q59 Q63 C64 C65I39-M61 HydrophobicContact CG2-CG 3.67Å; I39-M61 HydrophobicContact CG2-SD 4.44Å; L43-M61 HydrophobicContact CD1-SD 4.39Å; L57-M61 WeakPolarHBondContact O-CG 3.28Å; L57-M61 PolarHBondContact O-N 3.49Å; S58-M61 PolarHBondContact O-N 2.82Å; Q59-M61 PolarHBondContact O-N 3.37Å; M61-Q63 VanDerWaalsContact C-N 3.31Å; M61-Q63 PolarHBondContact O-N 3.39Å; M61-C64 PolarHBondContact O-N 3.3Å; M61-C65 PolarHBondContact O-N 3.02Å; M61-C65 PolarHBondContact O-SG 2.85Å; M61-C65 VanDerWaalsContact O-SG 3.41Å
62A87.3Confident83.3Confident65 Ų6574.2 Ų74.254%0.53741%0.413SS..Hα-helixtrans-61.2-41177.200000111.7S58 Q59 K66S58-A62 WeakPolarHBondContact O-CB 3.35Å; S58-A62 PolarHBondContact O-N 3.38Å; Q59-A62 PolarHBondContact O-N 3.17Å; A62-K66 PolarHBondContact O-N 3.39Å; A62-K66 VanDerWaalsContact O-N 3.08Å
63Q88.4Confident84.7Confident93 Ų9377 Ų7744%0.43542%0.415SS..Hα-helixtrans-67.2-40.9175.9-171.959.543.300112Q59 N60 M61 K66 N67Q59-Q63 WeakPolarHBondContact O-CB 3.4Å; Q59-Q63 PolarHBondContact O-N 3.14Å; N60-Q63 PolarHBondContact O-N 3.07Å; M61-Q63 VanDerWaalsContact C-N 3.31Å; M61-Q63 PolarHBondContact O-N 3.39Å; Q63-K66 WeakPolarHBondContact O-CB 3.37Å; Q63-K66 PolarHBondContact O-N 3.26Å; Q63-N67 PolarHBondContact NE2-OD1 3.46Å; Q63-N67 VanDerWaalsContact O-CG 3.22Å; Q63-N67 PolarHBondContact O-N 2.93Å; Q63-N67 PolarHBondContact O-OD1 2.81Å
64C87.8Confident85.5Confident7 Ų776.6 Ų76.65%0.04741%0.413CS..Hα-helixtrans-61.3-47.4175.4-171.60000111.6I39 N60 M61 K66 N67 I68I39-C64 HydrophobicContact CD1-CB 3.5Å; I39-C64 VanDerWaalsContact CD1-CB 3.5Å; N60-C64 WeakPolarHBondContact O-CB 3.47Å; N60-C64 PolarHBondContact O-N 2.99Å; M61-C64 PolarHBondContact O-N 3.3Å; C64-K66 VanDerWaalsContact C-N 3.27Å; C64-K66 PolarHBondContact O-N 2.6Å; C64-N67 PolarHBondContact O-N 3.29Å; C64-N67 VanDerWaalsContact O-N 3.16Å; C64-I68 VanDerWaalsContact O-CG1 3.31Å; C64-I68 WeakPolarHBondContact O-CG1 3.24Å; C64-I68 PolarHBondContact O-N 2.92Å
65C87.9Confident86.2Confident84 Ų8473 Ų7357%0.56839%0.394SS*.Hα-helixtrans-58-38.8175.1-73.70000112.5M61 K69M61-C65 PolarHBondContact O-N 3.02Å; M61-C65 PolarHBondContact O-SG 2.85Å; M61-C65 VanDerWaalsContact O-SG 3.41Å; C65-K69 PolarHBondContact O-N 3.16Å; C65-K69 VanDerWaalsContact O-N 3.11Å
66K91.3Very high86.8Confident111 Ų11172.7 Ų72.748%0.48340%0.396SS..Hα-helixtrans-65.5-46.9175.1-173.1179173.7-175.30111.5A62 Q63 C64 I68 K69 E70A62-K66 PolarHBondContact O-N 3.39Å; A62-K66 VanDerWaalsContact O-N 3.08Å; Q63-K66 WeakPolarHBondContact O-CB 3.37Å; Q63-K66 PolarHBondContact O-N 3.26Å; C64-K66 VanDerWaalsContact C-N 3.27Å; C64-K66 PolarHBondContact O-N 2.6Å; K66-I68 VanDerWaalsContact C-N 3.34Å; K66-I68 PolarHBondContact O-N 3.2Å; K66-K69 PolarHBondContact O-N 2.9Å; K66-E70 WeakPolarHBondContact CE-OE1 3.36Å; K66-E70 WeakPolarHBondContact O-CG 3.22Å; K66-E70 PolarHBondContact O-N 2.66Å
67N88.8Confident87.1Confident57 Ų5771.9 Ų71.931%0.30539%0.393SS..Hα-helixtrans-61.9-40178.1-68-1.8000112L32 Q63 C64 E70 T71L32-N67 HydrophobicContact CD2-CB 4.08Å; Q63-N67 PolarHBondContact NE2-OD1 3.46Å; Q63-N67 VanDerWaalsContact O-CG 3.22Å; Q63-N67 PolarHBondContact O-N 2.93Å; Q63-N67 PolarHBondContact O-OD1 2.81Å; C64-N67 PolarHBondContact O-N 3.29Å; C64-N67 VanDerWaalsContact O-N 3.16Å; N67-E70 PolarHBondContact O-N 3.05Å; N67-T71 WeakPolarHBondContact O-CB 3.47Å; N67-T71 PolarHBondContact O-N 3Å; N67-T71 PolarHBondContact O-OG1 3.47Å
68I89.3Confident87.3Confident62 Ų6274.6 Ų74.632%0.31840%0.403SS..Hα-helixtrans-60.4-49174.5-68.8167.3000109.8L32 V36 C64 K66 E70 T71 V72L32-I68 HydrophobicContact CD1-CG1 4.28Å; L32-I68 HydrophobicContact CD2-CG1 3.95Å; V36-I68 HydrophobicContact CG2-CD1 4.03Å; C64-I68 VanDerWaalsContact O-CG1 3.31Å; C64-I68 WeakPolarHBondContact O-CG1 3.24Å; C64-I68 PolarHBondContact O-N 2.92Å; K66-I68 VanDerWaalsContact C-N 3.34Å; K66-I68 PolarHBondContact O-N 3.2Å; I68-E70 PolarHBondContact O-N 3.3Å; I68-T71 PolarHBondContact O-N 2.98Å; I68-V72 HydrophobicContact CG2-CG2 4.33Å; I68-V72 WeakPolarHBondContact O-CB 3.45Å; I68-V72 VanDerWaalsContact O-CG2 3.29Å; I68-V72 WeakPolarHBondContact O-CG2 3.43Å; I68-V72 PolarHBondContact O-N 3.29Å
69K91.4Very high87.5Confident136 Ų13675.5 Ų75.559%0.59140%0.398SS*.Hα-helixtrans-60.7-46.2-179.7-173.1178.5179.9-179.80112C65 K66 Q73C65-K69 PolarHBondContact O-N 3.16Å; C65-K69 VanDerWaalsContact O-N 3.11Å; K66-K69 PolarHBondContact O-N 2.9Å; K69-Q73 WeakPolarHBondContact O-CB 3.09Å; K69-Q73 VanDerWaalsContact O-CG 3.26Å; K69-Q73 WeakPolarHBondContact O-CG 3.36Å; K69-Q73 PolarHBondContact O-N 3.2Å
70E91.8Very high87.6Confident97 Ų9777.1 Ų77.145%0.45340%0.403SS..Hα-helixtrans-63.3-41.7178.2-72.4175.6-175.500111.7K66 N67 I68 Q73 L74K66-E70 WeakPolarHBondContact CE-OE1 3.36Å; K66-E70 WeakPolarHBondContact O-CG 3.22Å; K66-E70 PolarHBondContact O-N 2.66Å; N67-E70 PolarHBondContact O-N 3.05Å; I68-E70 PolarHBondContact O-N 3.3Å; E70-Q73 PolarHBondContact O-N 2.98Å; E70-L74 WeakPolarHBondContact O-CB 3.38Å; E70-L74 PolarHBondContact O-N 2.7Å
71T87.8Confident87.5Confident22 Ų2279 Ų7914%0.13541%0.414CS..Hα-helixtrans-67.3-44.8179.1-55.60000111.7R28 L32 N67 I68 Q73 L74 L75R28-T71 HydrophobicContact CB-CG2 4.24Å; L32-T71 HydrophobicContact CD1-CG2 3.68Å; N67-T71 WeakPolarHBondContact O-CB 3.47Å; N67-T71 PolarHBondContact O-N 3Å; N67-T71 PolarHBondContact O-OG1 3.47Å; I68-T71 PolarHBondContact O-N 2.98Å; T71-Q73 VanDerWaalsContact C-N 3.34Å; T71-Q73 PolarHBondContact O-N 2.9Å; T71-L74 PolarHBondContact O-N 2.86Å; T71-L75 HydrophobicContact CG2-CD1 4.17Å; T71-L75 HydrophobicContact CG2-CG 4.41Å; T71-L75 VanDerWaalsContact O-CG 3.29Å; T71-L75 WeakPolarHBondContact O-CG 3.26Å; T71-L75 PolarHBondContact O-N 3.17Å
72V88.3Confident87.5Confident80 Ų8076 Ų7649%0.48540%0.399SS..Hα-helixtrans-62.1-41.4176.5171.50000111.3I68 L74 L75 A76I68-V72 HydrophobicContact CG2-CG2 4.33Å; I68-V72 WeakPolarHBondContact O-CB 3.45Å; I68-V72 VanDerWaalsContact O-CG2 3.29Å; I68-V72 WeakPolarHBondContact O-CG2 3.43Å; I68-V72 PolarHBondContact O-N 3.29Å; V72-L74 VanDerWaalsContact C-N 3.34Å; V72-L74 PolarHBondContact O-N 2.99Å; V72-L75 PolarHBondContact O-N 3.35Å; V72-A76 WeakPolarHBondContact O-CB 3.34Å; V72-A76 PolarHBondContact O-N 3.16Å
73Q90.7Very high87.4Confident118 Ų11878.7 Ų78.755%0.55140%0.4SS*.Hα-helixtrans-63.5-40175.8-75.3178.4-15.500112.3K69 E70 T71 A76 S77K69-Q73 WeakPolarHBondContact O-CB 3.09Å; K69-Q73 VanDerWaalsContact O-CG 3.26Å; K69-Q73 WeakPolarHBondContact O-CG 3.36Å; K69-Q73 PolarHBondContact O-N 3.2Å; E70-Q73 PolarHBondContact O-N 2.98Å; T71-Q73 VanDerWaalsContact C-N 3.34Å; T71-Q73 PolarHBondContact O-N 2.9Å; Q73-A76 PolarHBondContact O-N 3Å; Q73-S77 PolarHBondContact O-N 2.72Å; Q73-S77 PolarHBondContact O-OG 2.86Å
74L87.4Confident87.3Confident62 Ų6276.2 Ų76.233%0.32540%0.399SS..Hα-helixtrans-70.5-36.7177.3-179.158.1000112.9E70 T71 V72 S77 R78E70-L74 WeakPolarHBondContact O-CB 3.38Å; E70-L74 PolarHBondContact O-N 2.7Å; T71-L74 PolarHBondContact O-N 2.86Å; V72-L74 VanDerWaalsContact C-N 3.34Å; V72-L74 PolarHBondContact O-N 2.99Å; L74-S77 PolarHBondContact O-N 2.98Å; L74-S77 PolarHBondContact O-OG 3.29Å; L74-R78 HydrophobicContact CD1-CG 4.25Å; L74-R78 WeakPolarHBondContact O-CB 3.2Å; L74-R78 VanDerWaalsContact O-CG 3.31Å; L74-R78 WeakPolarHBondContact O-CG 3.41Å; L74-R78 PolarHBondContact O-N 2.81Å
75L86.3Confident87.1Confident26 Ų2676.3 Ų76.314%0.13640%0.4CS..Hα-helixtrans-63.7-44.5172.5-71.4172.8000110.6Y21 S25 L29 T71 V72 S77 R78 H79Y21-L75 HydrophobicContact CE2-CD2 4.3Å; Y21-L75 PolarHBondContact OH-O 3.4Å; S25-L75 WeakPolarHBondContact OG-CD2 3.46Å; L29-L75 HydrophobicContact CD1-CD1 4.48Å; L29-L75 HydrophobicContact CD2-CD1 4.03Å; L29-L75 HydrophobicContact CG-CD1 4.25Å; T71-L75 HydrophobicContact CG2-CD1 4.17Å; T71-L75 HydrophobicContact CG2-CG 4.41Å; T71-L75 VanDerWaalsContact O-CG 3.29Å; T71-L75 WeakPolarHBondContact O-CG 3.26Å; T71-L75 PolarHBondContact O-N 3.17Å; V72-L75 PolarHBondContact O-N 3.35Å; L75-S77 PolarHBondContact O-N 3.11Å; L75-R78 PolarHBondContact O-N 3.25Å; L75-H79 WeakPolarHBondContact O-CB 3.39Å; L75-H79 PolarHBondContact O-N 3.31Å
76A87.3Confident87.1Confident62 Ų6275.7 Ų75.751%0.51239%0.394SS..Hα-helixtrans-62.3-40.817700000112.8V72 Q73 K80V72-A76 WeakPolarHBondContact O-CB 3.34Å; V72-A76 PolarHBondContact O-N 3.16Å; Q73-A76 PolarHBondContact O-N 3Å; A76-K80 PolarHBondContact O-N 3.21Å
77S87.1Confident86.9Confident55 Ų5573.3 Ų73.339%0.38539%0.391SS..Hα-helixtrans-67.9-44.6177.566.80000112Q73 L74 L75 H79 K80 D81Q73-S77 PolarHBondContact O-N 2.72Å; Q73-S77 PolarHBondContact O-OG 2.86Å; L74-S77 PolarHBondContact O-N 2.98Å; L74-S77 PolarHBondContact O-OG 3.29Å; L75-S77 PolarHBondContact O-N 3.11Å; S77-H79 PolarHBondContact O-N 2.84Å; S77-K80 VanDerWaalsContact O-CB 3.28Å; S77-K80 WeakPolarHBondContact O-CB 3.36Å; S77-K80 PolarHBondContact O-N 3.32Å; S77-K80 VanDerWaalsContact O-N 3.11Å; S77-D81 PolarHBondContact O-N 3.1Å
78R83.3Confident86.9Confident73 Ų7376.4 Ų76.428%0.27540%0.402SS..Hα-helixtrans-64.5-37.9176.7-74.8178.4170.8-148.5-4.3112.7Y21 L74 L75 K80 D81 I82Y21-R78 HydrophobicContact CD2-CB 3.9Å; Y21-R78 HydrophobicContact CE2-CB 3.5Å; Y21-R78 VanDerWaalsContact CE2-CB 3.5Å; L74-R78 HydrophobicContact CD1-CG 4.25Å; L74-R78 WeakPolarHBondContact O-CB 3.2Å; L74-R78 VanDerWaalsContact O-CG 3.31Å; L74-R78 WeakPolarHBondContact O-CG 3.41Å; L74-R78 PolarHBondContact O-N 2.81Å; L75-R78 PolarHBondContact O-N 3.25Å; R78-K80 VanDerWaalsContact C-N 3.26Å; R78-K80 PolarHBondContact O-N 3.15Å; R78-D81 PolarHBondContact O-N 3.07Å; R78-D81 VanDerWaalsContact O-N 3.17Å; R78-I82 WeakPolarHBondContact O-CG1 3.44Å; R78-I82 PolarHBondContact O-N 2.84Å
79H83.5Confident86.8Confident95 Ų9574.2 Ų74.244%0.4439%0.391SS..Hα-helixtrans-59.8-37.5172.7-176.7-88.7000111.8L75 S77 D81 I82 H83L75-H79 WeakPolarHBondContact O-CB 3.39Å; L75-H79 PolarHBondContact O-N 3.31Å; S77-H79 PolarHBondContact O-N 2.84Å; H79-D81 VanDerWaalsContact C-N 3.34Å; H79-D81 PolarHBondContact O-N 3Å; H79-I82 WeakPolarHBondContact O-CB 3.38Å; H79-I82 PolarHBondContact O-N 2.93Å; H79-H83 AromaticContact CE1-NE2 3.46Å; H79-H83 PolarHBondContact CE1-NE2 3.19Å; H79-H83 AromaticContact ND1-NE2 3.82Å
80K86.5Confident86.5Confident159 Ų15969.1 Ų69.169%0.69138%0.378SS*.Hα-helixtrans-63.5-39175.2-167.6-179.7178.9-179.20112.4A76 S77 R78 I82 H83A76-K80 PolarHBondContact O-N 3.21Å; S77-K80 VanDerWaalsContact O-CB 3.28Å; S77-K80 WeakPolarHBondContact O-CB 3.36Å; S77-K80 PolarHBondContact O-N 3.32Å; S77-K80 VanDerWaalsContact O-N 3.11Å; R78-K80 VanDerWaalsContact C-N 3.26Å; R78-K80 PolarHBondContact O-N 3.15Å; K80-I82 PolarHBondContact O-N 3.35Å; K80-H83 PolarHBondContact O-N 2.97Å
81D81.6Confident86.3Confident114 Ų11471.1 Ų71.161%0.6139%0.385SS*.Hα-helixtrans-66.2-27.9179.6-67.2-25.2000112.7S77 R78 H79 H83 G84 S85S77-D81 PolarHBondContact O-N 3.1Å; R78-D81 PolarHBondContact O-N 3.07Å; R78-D81 VanDerWaalsContact O-N 3.17Å; H79-D81 VanDerWaalsContact C-N 3.34Å; H79-D81 PolarHBondContact O-N 3Å; D81-H83 VanDerWaalsContact C-N 3.35Å; D81-H83 PolarHBondContact O-N 3.26Å; D81-G84 PolarHBondContact O-N 3.08Å; D81-S85 PolarHBondContact O-N 2.93Å
82I83.7Confident86.2Confident19 Ų1970.8 Ų70.810%0.09738%0.384CS..Hα-helixtrans-63.9-38.6176-66.9173000111.5F18 Y21 R78 H79 K80 G84 S85 V86F18-I82 HydrophobicContact CD1-CG2 4.33Å; F18-I82 HydrophobicContact CD2-CG2 4.19Å; F18-I82 HydrophobicContact CE1-CD1 4.46Å; F18-I82 HydrophobicContact CE1-CG2 3.58Å; F18-I82 HydrophobicContact CE2-CG2 3.4Å; F18-I82 VanDerWaalsContact CE2-CG2 3.4Å; F18-I82 HydrophobicContact CZ-CG2 3.07Å; Y21-I82 HydrophobicContact CD1-CD1 3.62Å; Y21-I82 HydrophobicContact CD2-CD1 4.13Å; Y21-I82 HydrophobicContact CE1-CD1 3.99Å; Y21-I82 HydrophobicContact CE2-CD1 4.47Å; Y21-I82 HydrophobicContact CG-CD1 3.69Å; R78-I82 WeakPolarHBondContact O-CG1 3.44Å; R78-I82 PolarHBondContact O-N 2.84Å; H79-I82 WeakPolarHBondContact O-CB 3.38Å; H79-I82 PolarHBondContact O-N 2.93Å; K80-I82 PolarHBondContact O-N 3.35Å; I82-G84 VanDerWaalsContact C-N 3.27Å; I82-G84 PolarHBondContact O-N 3.43Å; I82-S85 WeakPolarHBondContact O-CA 3.46Å; I82-S85 VanDerWaalsContact O-CB 3.25Å; I82-S85 WeakPolarHBondContact O-CB 3.45Å; I82-S85 PolarHBondContact O-N 3.45Å; I82-V86 HydrophobicContact CG2-CG2 4.33Å; I82-V86 PolarHBondContact O-N 3.06Å
83H84.9Confident85.9Confident120 Ų12070.5 Ų70.556%0.55638%0.379SS*.Hα-helixtrans-58.3-39.4177.5-75.7-78000112.5H79 K80 D81 S85 V86 S87H79-H83 AromaticContact CE1-NE2 3.46Å; H79-H83 PolarHBondContact CE1-NE2 3.19Å; H79-H83 AromaticContact ND1-NE2 3.82Å; K80-H83 PolarHBondContact O-N 2.97Å; D81-H83 VanDerWaalsContact C-N 3.35Å; D81-H83 PolarHBondContact O-N 3.26Å; H83-S85 VanDerWaalsContact C-N 3.29Å; H83-S85 PolarHBondContact O-N 3.33Å; H83-V86 PolarHBondContact O-N 3.13Å; H83-S87 WeakPolarHBondContact O-CB 3.47Å; H83-S87 PolarHBondContact O-N 3.35Å
84G86Confident85.5Confident41 Ų4168.9 Ų68.942%0.42337%0.374SS..Hα-helixtrans-64.9-35.4176.300000112.4D81 I82 K88D81-G84 PolarHBondContact O-N 3.08Å; I82-G84 VanDerWaalsContact C-N 3.27Å; I82-G84 PolarHBondContact O-N 3.43Å; G84-K88 WeakPolarHBondContact O-CG 3.49Å; G84-K88 PolarHBondContact O-N 2.77Å
85S84.3Confident85.2Confident9 Ų976.4 Ų76.46%0.06340%0.398CS..Hα-helixtrans-66.2-44.5173.9-104.10000112.3V14 R17 D81 I82 H83 K88 V89V14-S85 WeakPolarHBondContact CG2-O 3.32Å; R17-S85 WeakPolarHBondContact CD-OG 3.35Å; R17-S85 PolarHBondContact NH1-OG 3.28Å; D81-S85 PolarHBondContact O-N 2.93Å; I82-S85 WeakPolarHBondContact O-CA 3.46Å; I82-S85 VanDerWaalsContact O-CB 3.25Å; I82-S85 WeakPolarHBondContact O-CB 3.45Å; I82-S85 PolarHBondContact O-N 3.45Å; H83-S85 VanDerWaalsContact C-N 3.29Å; H83-S85 PolarHBondContact O-N 3.33Å; S85-K88 WeakPolarHBondContact O-CB 3.28Å; S85-K88 PolarHBondContact O-N 2.91Å; S85-V89 PolarHBondContact O-N 3.47Å
86V87.1Confident84.6Confident71 Ų7176.5 Ų76.543%0.4340%0.399SS..Hα-helixtrans-65.2-41176.3176.70000111.4V14 F18 I82 H83 K88 V89 G90V14-V86 HydrophobicContact CG1-CG2 4.22Å; F18-V86 HydrophobicContact CE2-CG2 3.86Å; F18-V86 HydrophobicContact CZ-CG2 4.08Å; I82-V86 HydrophobicContact CG2-CG2 4.33Å; I82-V86 PolarHBondContact O-N 3.06Å; H83-V86 PolarHBondContact O-N 3.13Å; V86-K88 PolarHBondContact O-N 3.45Å; V86-V89 WeakPolarHBondContact O-CB 3.41Å; V86-V89 PolarHBondContact O-N 3.34Å; V86-G90 PolarHBondContact O-N 3.3Å; V86-G90 VanDerWaalsContact O-N 3.13Å
87S88.6Confident83.9Confident62 Ų6278.3 Ų78.343%0.43440%0.395SS..Hα-helixtrans-61.1-32.5176.7-178.40000112.8H83 V89 G90 K91H83-S87 WeakPolarHBondContact O-CB 3.47Å; H83-S87 PolarHBondContact O-N 3.35Å; S87-V89 VanDerWaalsContact C-N 3.34Å; S87-G90 PolarHBondContact O-N 3.33Å; S87-K91 WeakPolarHBondContact O-CG 3.4Å; S87-K91 PolarHBondContact O-N 3Å
88K87.3Confident82.6Confident121 Ų12181.7 Ų81.753%0.52641%0.409SS..Hα-helixtrans-65.2-36.7174.2-73.4173.8-177.6-177.90112.5G84 S85 V86 K91 A92G84-K88 WeakPolarHBondContact O-CG 3.49Å; G84-K88 PolarHBondContact O-N 2.77Å; S85-K88 WeakPolarHBondContact O-CB 3.28Å; S85-K88 PolarHBondContact O-N 2.91Å; V86-K88 PolarHBondContact O-N 3.45Å; K88-K91 PolarHBondContact O-N 3.14Å; K88-A92 WeakPolarHBondContact O-CB 3.22Å; K88-A92 PolarHBondContact O-N 2.95Å
89V88.1Confident81.3Confident17 Ų1780.3 Ų80.310%0.10341%0.413CS..Hα-helixtrans-64.8-45.2174178.40000109.9E10 V14 S85 V86 S87 K91 A92 I93E10-V89 HydrophobicContact CB-CG2 4.28Å; V14-V89 HydrophobicContact CB-CG2 4.3Å; V14-V89 HydrophobicContact CG2-CG2 3.57Å; S85-V89 PolarHBondContact O-N 3.47Å; V86-V89 WeakPolarHBondContact O-CB 3.41Å; V86-V89 PolarHBondContact O-N 3.34Å; S87-V89 VanDerWaalsContact C-N 3.34Å; V89-K91 PolarHBondContact O-N 3.13Å; V89-A92 CarbonylContact O-C 3.59Å; V89-A92 WeakPolarHBondContact O-CB 3.49Å; V89-A92 PolarHBondContact O-N 3.24Å; V89-A92 VanDerWaalsContact O-N 3.08Å; V89-I93 HydrophobicContact CG1-CD1 4.01Å; V89-I93 HydrophobicContact CG1-CG1 4.45Å; V89-I93 WeakPolarHBondContact O-CG1 3.41Å; V89-I93 PolarHBondContact O-N 3.41Å
90G85.3Confident80.2Confident29 Ų2982 Ų8230%0.29942%0.421SS..Hα-helixtrans-54.2-51.4173.500000112.3V86 S87 A92 I93 D94V86-G90 PolarHBondContact O-N 3.3Å; V86-G90 VanDerWaalsContact O-N 3.13Å; S87-G90 PolarHBondContact O-N 3.33Å; G90-A92 VanDerWaalsContact C-N 3.27Å; G90-A92 PolarHBondContact O-N 3.35Å; G90-I93 WeakPolarHBondContact O-CB 3.43Å; G90-I93 PolarHBondContact O-N 3.17Å; G90-D94 PolarHBondContact O-N 3.01Å
91K87.2Confident78.9Confident139 Ų13978.4 Ų78.460%0.60441%0.409SS*.Hα-helixtrans-61.9-32.6176.3-69.3-179.9-177.9-174.80113.7S87 K88 V89 R95S87-K91 WeakPolarHBondContact O-CG 3.4Å; S87-K91 PolarHBondContact O-N 3Å; K88-K91 PolarHBondContact O-N 3.14Å; V89-K91 PolarHBondContact O-N 3.13Å; K91-R95 WeakPolarHBondContact O-CB 3.43Å; K91-R95 PolarHBondContact O-N 3.26Å
92A84.9Confident77.7Confident14 Ų1477.5 Ų77.512%0.11641%0.411CS..Hα-helixtrans-71.8-36.7175.800000111.2V7 E10 K88 V89 G90 N96V7-A92 HydrophobicContact CG2-CB 4.38Å; E10-A92 HydrophobicContact CG-CB 4.29Å; K88-A92 WeakPolarHBondContact O-CB 3.22Å; K88-A92 PolarHBondContact O-N 2.95Å; V89-A92 CarbonylContact O-C 3.59Å; V89-A92 WeakPolarHBondContact O-CB 3.49Å; V89-A92 PolarHBondContact O-N 3.24Å; V89-A92 VanDerWaalsContact O-N 3.08Å; G90-A92 VanDerWaalsContact C-N 3.27Å; G90-A92 PolarHBondContact O-N 3.35Å; A92-N96 WeakPolarHBondContact O-CB 3.31Å; A92-N96 PolarHBondContact O-N 3.42Å; A92-N96 VanDerWaalsContact O-N 3.14Å; A92-N96 PolarHBondContact O-ND2 2.88Å
93I83.8Confident76.6Confident74 Ų7478.5 Ų78.538%0.37942%0.422SS..Hα-helixtrans-62.1-56172.2-69.4166000108.9V7 V89 G90 R95 N96 F97V7-I93 HydrophobicContact CG1-CD1 4.49Å; V7-I93 HydrophobicContact CG1-CG1 3.67Å; V7-I93 HydrophobicContact CG2-CG1 4.5Å; V89-I93 HydrophobicContact CG1-CD1 4.01Å; V89-I93 HydrophobicContact CG1-CG1 4.45Å; V89-I93 WeakPolarHBondContact O-CG1 3.41Å; V89-I93 PolarHBondContact O-N 3.41Å; G90-I93 WeakPolarHBondContact O-CB 3.43Å; G90-I93 PolarHBondContact O-N 3.17Å; I93-R95 PolarHBondContact O-N 3Å; I93-N96 PolarHBondContact O-N 3.43Å; I93-N96 VanDerWaalsContact O-N 3.1Å; I93-F97 HydrophobicContact CB-CD2 4.41Å; I93-F97 HydrophobicContact CG2-CD2 4Å; I93-F97 WeakPolarHBondContact O-CB 3.44Å; I93-F97 WeakPolarHBondContact O-CD2 3.49Å; I93-F97 PolarHBondContact O-N 3.38Å
94D81.6Confident75.5Confident84 Ų8474 Ų7445%0.44940%0.403SS..Hα-helixtrans-53.2-54.6-179.9-56.9-24.9000109.7G90 N96 F97 D98G90-D94 PolarHBondContact O-N 3.01Å; D94-N96 VanDerWaalsContact C-N 3.27Å; D94-N96 PolarHBondContact O-N 3.46Å; D94-N96 VanDerWaalsContact O-N 3.11Å; D94-F97 PolarHBondContact O-N 2.86Å; D94-D98 WeakPolarHBondContact O-CB 3.32Å; D94-D98 PolarHBondContact O-N 3.15Å
95R80.4Confident74.5Confident220 Ų22075.5 Ų75.583%0.8340%0.404SS*.Hα-helixtrans-58.4-32.5-178.9-176.1176.8176.9-177.40.1114.8K91 I93K91-R95 WeakPolarHBondContact O-CB 3.43Å; K91-R95 PolarHBondContact O-N 3.26Å; I93-R95 PolarHBondContact O-N 3Å
96N75.3Confident73.6Confident28 Ų2877.3 Ų77.315%0.1542%0.42CS..Hα-helixtrans-97.1-20.1-175.3-74.1-71.6000113.4Q3 V7 A92 I93 D94Q3-N96 HydrophobicContact CB-CB 4.12Å; Q3-N96 HydrophobicContact CG-CB 4.32Å; V7-N96 HydrophobicContact CG2-CB 4.02Å; A92-N96 WeakPolarHBondContact O-CB 3.31Å; A92-N96 PolarHBondContact O-N 3.42Å; A92-N96 VanDerWaalsContact O-N 3.14Å; A92-N96 PolarHBondContact O-ND2 2.88Å; I93-N96 PolarHBondContact O-N 3.43Å; I93-N96 VanDerWaalsContact O-N 3.1Å; D94-N96 VanDerWaalsContact C-N 3.27Å; D94-N96 PolarHBondContact O-N 3.46Å; D94-N96 VanDerWaalsContact O-N 3.11Å
97F72.5Confident72.5Confident100 Ų10082.8 Ų82.844%0.43944%0.441SS..Hα-helixtrans-122.3-0.9-174-61.1-70.6000114.4V7 I93 D94 A99V7-F97 HydrophobicContact CB-CE2 4.2Å; V7-F97 HydrophobicContact CG1-CE2 4.43Å; V7-F97 HydrophobicContact CG2-CD2 4.28Å; V7-F97 HydrophobicContact CG2-CE2 3.65Å; V7-F97 HydrophobicContact CG2-CZ 4.49Å; I93-F97 HydrophobicContact CB-CD2 4.41Å; I93-F97 HydrophobicContact CG2-CD2 4Å; I93-F97 WeakPolarHBondContact O-CB 3.44Å; I93-F97 WeakPolarHBondContact O-CD2 3.49Å; I93-F97 PolarHBondContact O-N 3.38Å; D94-F97 PolarHBondContact O-N 2.86Å; F97-A99 PolarHBondContact O-N 3.43Å
98D58.6Low71.5Confident127 Ų12784 Ų8468%0.67945%0.446SS*.  trans-70.311.8175.1-107.9-18.9000115.4D94 E100D94-D98 WeakPolarHBondContact O-CB 3.32Å; D94-D98 PolarHBondContact O-N 3.15Å; D98-E100 PolarHBondContact O-N 3.35Å
99A56.8Low70.6Confident44 Ų4480 Ų8036%0.36443%0.431SS..  trans-70.1119.7173.300000108.5F97 I101 M298F97-A99 PolarHBondContact O-N 3.43Å; A99-I101 HydrophobicContact CB-CG1 4.03Å; A99-I101 WeakPolarHBondContact O-CG1 3.2Å; A99-I101 PolarHBondContact O-N 2.88Å; A99-M298 HydrophobicContact CB-CE 3.69Å
100E59.1Low69.9Low129 Ų12985 Ų8560%0.60345%0.448SS*.  trans-56.961.5164.4-63.7178.5153.900111.7D98 S102 A103 K301D98-E100 PolarHBondContact O-N 3.35Å; E100-S102 PolarHBondContact O-N 3.41Å; E100-A103 HydrophobicContact CB-CB 3.77Å; E100-A103 PolarHBondContact O-N 3.04Å; E100-K301 IonicContact OE2-NZ 3.4Å
101I59.4Low69.6Low85 Ų8588.9 Ų88.944%0.43646%0.462SS..G310 helixtrans-60.5-37.3176-68.2167.3000108.8A99 A103 V104 L294 M298A99-I101 HydrophobicContact CB-CG1 4.03Å; A99-I101 WeakPolarHBondContact O-CG1 3.2Å; A99-I101 PolarHBondContact O-N 2.88Å; I101-A103 PolarHBondContact O-N 2.83Å; I101-V104 PolarHBondContact O-N 2.93Å; I101-L294 HydrophobicContact CD1-CD2 4.42Å; I101-L294 HydrophobicContact CG1-CD2 4.23Å; I101-L294 HydrophobicContact CG2-CD1 4.06Å; I101-L294 HydrophobicContact CG2-CD2 3.72Å; I101-M298 HydrophobicContact CG1-SD 4.46Å
102S57.3Low69.4Low94 Ų9484.6 Ų84.666%0.65745%0.448SS*.G310 helixtrans-58.3-28.4174.331.80000113E100 V104 V105E100-S102 PolarHBondContact O-N 3.41Å; S102-V104 VanDerWaalsContact C-N 3.28Å; S102-V104 PolarHBondContact O-N 3.46Å; S102-V105 PolarHBondContact O-N 3.01Å
103A59.6Low69.3Low40 Ų4088.6 Ų88.633%0.33147%0.473SS..G310 helixtrans-86.13.9-176.300000113.8E100 I101 K301E100-A103 HydrophobicContact CB-CB 3.77Å; E100-A103 PolarHBondContact O-N 3.04Å; I101-A103 PolarHBondContact O-N 2.83Å; A103-K301 PolarHBondContact O-NZ 3.42Å
104V63.3Low69.3Low26 Ų2691.6 Ų91.616%0.15849%0.485CS..G310 helixtrans-86.9-22.8166.6179.60000111I101 S102 L294 L297 M298 K301I101-V104 PolarHBondContact O-N 2.93Å; S102-V104 VanDerWaalsContact C-N 3.28Å; S102-V104 PolarHBondContact O-N 3.46Å; V104-L294 HydrophobicContact CB-CD1 4.42Å; V104-L294 HydrophobicContact CG1-CD1 4.44Å; V104-L294 HydrophobicContact CG2-CD1 4.29Å; V104-L297 HydrophobicContact CG1-CB 3.68Å; V104-L297 HydrophobicContact CG1-CD1 4.14Å; V104-M298 HydrophobicContact CG2-CG 3.72Å; V104-K301 HydrophobicContact CG2-CD 4.39Å
105V64.1Low69.3Low73 Ų7393.2 Ų93.244%0.44249%0.485SS..SBendtrans-106.9142.5-177.7-174.70000108.4S102 E107 V109S102-V105 PolarHBondContact O-N 3.01Å; V105-E107 PolarHBondContact O-N 2.93Å; V105-V109 HydrophobicContact CG1-CB 3.94Å; V105-V109 HydrophobicContact CG1-CG1 4.33Å; V105-V109 HydrophobicContact CG1-CG2 3.62Å
106A65.3Low69.4Low47 Ų4787.6 Ų87.639%0.38847%0.468SS..  trans-64.7133.1173.800000109.8T108 V109A106-T108 PolarHBondContact O-N 3.16Å; A106-V109 HydrophobicContact CB-CG2 4.03Å; A106-V109 WeakPolarHBondContact O-CB 3.27Å; A106-V109 VanDerWaalsContact O-CG2 3.25Å; A106-V109 WeakPolarHBondContact O-CG2 3.49Å; A106-V109 PolarHBondContact O-N 3.41Å
107E63.6Low69.9Low186 Ų18691.5 Ų91.587%0.86948%0.484SS*.G310 helixtrans-55.1-28.4-178.4-70.3179.9164.400112.3V105 V109V105-E107 PolarHBondContact O-N 2.93Å; E107-V109 VanDerWaalsContact C-N 3.33Å; E107-V109 PolarHBondContact O-N 2.77Å
108T67.3Low70.5Confident88 Ų8893.8 Ų93.854%0.5449%0.49SS..G310 helixtrans-83.72-177.560.90000115.1A106 W110 D111A106-T108 PolarHBondContact O-N 3.16Å; T108-W110 PolarHBondContact O-N 3.26Å; T108-W110 VanDerWaalsContact O-N 3.16Å; T108-D111 VanDerWaalsContact CA-OD2 3.3Å; T108-D111 WeakPolarHBondContact CA-OD2 3.17Å; T108-D111 WeakPolarHBondContact CG2-OD2 3.33Å; T108-D111 PolarHBondContact O-N 2.75Å
109V69.8Low71.8Confident36 Ų3690.7 Ų90.722%0.21847%0.473CS..G310 helixtrans-59.9-31.4-175.3168.30000112.1V105 A106 E107 R115V105-V109 HydrophobicContact CG1-CB 3.94Å; V105-V109 HydrophobicContact CG1-CG1 4.33Å; V105-V109 HydrophobicContact CG1-CG2 3.62Å; A106-V109 HydrophobicContact CB-CG2 4.03Å; A106-V109 WeakPolarHBondContact O-CB 3.27Å; A106-V109 VanDerWaalsContact O-CG2 3.25Å; A106-V109 WeakPolarHBondContact O-CG2 3.49Å; A106-V109 PolarHBondContact O-N 3.41Å; E107-V109 VanDerWaalsContact C-N 3.33Å; E107-V109 PolarHBondContact O-N 2.77Å; V109-R115 WeakPolarHBondContact O-CD 3.25Å; V109-R115 PolarHBondContact O-NH1 3.09Å
110W73.6Confident73.2Confident123 Ų12389.7 Ų89.747%0.46646%0.464SS..G310 helixtrans-110.79.3-176.4-55.2110.8000114.3T108 T112 R115 Q116 L119T108-W110 PolarHBondContact O-N 3.26Å; T108-W110 VanDerWaalsContact O-N 3.16Å; W110-T112 VanDerWaalsContact C-N 3.28Å; W110-T112 PolarHBondContact O-N 2.88Å; W110-R115 HydrophobicContact CE3-CB 4.12Å; W110-R115 HydrophobicContact CZ3-CB 4.38Å; W110-Q116 WeakPolarHBondContact O-CG 3.45Å; W110-Q116 PolarHBondContact O-NE2 2.92Å; W110-L119 HydrophobicContact CD2-CD2 4.37Å; W110-L119 HydrophobicContact CE3-CB 4.42Å; W110-L119 HydrophobicContact CE3-CD2 4.05Å; W110-L119 HydrophobicContact CH2-CB 4.4Å; W110-L119 HydrophobicContact CH2-CD1 4.17Å; W110-L119 HydrophobicContact CH2-CD2 4.12Å; W110-L119 HydrophobicContact CH2-CG 4.47Å; W110-L119 HydrophobicContact CZ2-CD2 4.42Å; W110-L119 HydrophobicContact CZ3-CB 3.84Å; W110-L119 HydrophobicContact CZ3-CD1 4.45Å; W110-L119 HydrophobicContact CZ3-CD2 3.93Å; W110-L119 HydrophobicContact CZ3-CG 4.29Å
111D78.6Confident74.5Confident109 Ų10986.2 Ų86.258%0.58345%0.448SS*.  trans-71.3-24.2-176.2-74.7-11.2000113.2T108T108-D111 VanDerWaalsContact CA-OD2 3.3Å; T108-D111 WeakPolarHBondContact CA-OD2 3.17Å; T108-D111 WeakPolarHBondContact CG2-OD2 3.33Å; T108-D111 PolarHBondContact O-N 2.75Å
112T82.9Confident75.8Confident50 Ų5084.5 Ų84.531%0.30744%0.443SS..SBendtrans-80128.6178.852.90000110.8W110 E114 R115 Q116W110-T112 VanDerWaalsContact C-N 3.28Å; W110-T112 PolarHBondContact O-N 2.88Å; T112-E114 PolarHBondContact O-N 3.46Å; T112-E114 VanDerWaalsContact O-N 3.14Å; T112-R115 PolarHBondContact O-N 3.43Å; T112-R115 WeakPolarHBondContact OG1-CB 3.47Å; T112-R115 WeakPolarHBondContact OG1-CD 3.44Å; T112-R115 WeakPolarHBondContact OG1-CG 3.49Å; T112-Q116 PolarHBondContact O-N 2.89Å
113P81.6Confident77.3Confident98 Ų9882.7 Ų82.764%0.63643%0.425SS*.Hα-helixtrans-60.1-28.1179.923.7-33.6000112.6Q116 K117P113-Q116 PolarHBondContact O-N 3.2Å; P113-K117 WeakPolarHBondContact O-CB 3.43Å; P113-K117 PolarHBondContact O-N 3.4Å
114E84.1Confident78.6Confident136 Ų13680.8 Ų80.864%0.63641%0.41SS*.Hα-helixtrans-63.2-43.7175-66.4161.5-171.400112.4T112 K117 Y118T112-E114 PolarHBondContact O-N 3.46Å; T112-E114 VanDerWaalsContact O-N 3.14Å; E114-K117 WeakPolarHBondContact O-CB 3.33Å; E114-K117 PolarHBondContact O-N 3.29Å; E114-Y118 HydrophobicContact CB-CE2 4.48Å; E114-Y118 WeakPolarHBondContact O-CD2 3.46Å; E114-Y118 PolarHBondContact O-N 3.15Å
115R82.3Confident79.5Confident118 Ų11882 Ų8245%0.44541%0.414SS..Hα-helixtrans-70.7-37.4178-69.2179.2-171.8172.43112.1V109 W110 T112 K117 Y118 L119V109-R115 WeakPolarHBondContact O-CD 3.25Å; V109-R115 PolarHBondContact O-NH1 3.09Å; W110-R115 HydrophobicContact CE3-CB 4.12Å; W110-R115 HydrophobicContact CZ3-CB 4.38Å; T112-R115 PolarHBondContact O-N 3.43Å; T112-R115 WeakPolarHBondContact OG1-CB 3.47Å; T112-R115 WeakPolarHBondContact OG1-CD 3.44Å; T112-R115 WeakPolarHBondContact OG1-CG 3.49Å; R115-K117 VanDerWaalsContact C-N 3.3Å; R115-Y118 PolarHBondContact O-N 2.89Å; R115-L119 WeakPolarHBondContact O-CB 3.32Å; R115-L119 PolarHBondContact O-N 3.28Å
116Q83.1Confident80.6Confident103 Ų10380.4 Ų80.448%0.48140%0.401SS..Hα-helixtrans-61-43.2172.5-65.2-175.7-5.100110.6W110 T112 P113 L119 S120W110-Q116 WeakPolarHBondContact O-CG 3.45Å; W110-Q116 PolarHBondContact O-NE2 2.92Å; T112-Q116 PolarHBondContact O-N 2.89Å; P113-Q116 PolarHBondContact O-N 3.2Å; Q116-L119 PolarHBondContact O-N 3.26Å; Q116-S120 WeakPolarHBondContact O-CB 3.43Å; Q116-S120 PolarHBondContact O-N 3.38Å; Q116-S120 PolarHBondContact O-OG 3.11Å
117K84.9Confident81.6Confident110 Ų11079 Ų7948%0.47839%0.387SS..Hα-helixtrans-58.4-50.1174.9-175.1-177.8172.9-175.60112.2P113 E114 R115 L119 S120 E121 V145P113-K117 WeakPolarHBondContact O-CB 3.43Å; P113-K117 PolarHBondContact O-N 3.4Å; E114-K117 WeakPolarHBondContact O-CB 3.33Å; E114-K117 PolarHBondContact O-N 3.29Å; R115-K117 VanDerWaalsContact C-N 3.3Å; K117-L119 VanDerWaalsContact C-N 3.31Å; K117-L119 PolarHBondContact O-N 2.83Å; K117-S120 PolarHBondContact O-N 3.16Å; K117-E121 WeakPolarHBondContact CE-OE1 3.41Å; K117-E121 IonicContact NZ-OE1 3.64Å; K117-E121 WeakPolarHBondContact O-CB 3.42Å; K117-E121 WeakPolarHBondContact O-CG 3.44Å; K117-E121 PolarHBondContact O-N 2.97Å; K117-V145 HydrophobicContact CG-CG2 4.18Å
118Y84.8Confident82.5Confident148 Ų14870.4 Ų70.458%0.5835%0.347SS*.Hα-helixtrans-63.1-36.1178.6-67.9-53.2000113.3E114 R115 S122E114-Y118 HydrophobicContact CB-CE2 4.48Å; E114-Y118 WeakPolarHBondContact O-CD2 3.46Å; E114-Y118 PolarHBondContact O-N 3.15Å; R115-Y118 PolarHBondContact O-N 2.89Å; Y118-S122 WeakPolarHBondContact O-CB 3.36Å; Y118-S122 PolarHBondContact O-N 3.49Å; Y118-S122 PolarHBondContact O-OG 2.88Å
119L86Confident83.1Confident61 Ų6167.8 Ų67.832%0.31933%0.327SS..Hα-helixtrans-64.3-49.5174.4178.562.2000110.6W110 R115 Q116 K117 E121 S122 I123W110-L119 HydrophobicContact CD2-CD2 4.37Å; W110-L119 HydrophobicContact CE3-CB 4.42Å; W110-L119 HydrophobicContact CE3-CD2 4.05Å; W110-L119 HydrophobicContact CH2-CB 4.4Å; W110-L119 HydrophobicContact CH2-CD1 4.17Å; W110-L119 HydrophobicContact CH2-CD2 4.12Å; W110-L119 HydrophobicContact CH2-CG 4.47Å; W110-L119 HydrophobicContact CZ2-CD2 4.42Å; W110-L119 HydrophobicContact CZ3-CB 3.84Å; W110-L119 HydrophobicContact CZ3-CD1 4.45Å; W110-L119 HydrophobicContact CZ3-CD2 3.93Å; W110-L119 HydrophobicContact CZ3-CG 4.29Å; R115-L119 WeakPolarHBondContact O-CB 3.32Å; R115-L119 PolarHBondContact O-N 3.28Å; Q116-L119 PolarHBondContact O-N 3.26Å; K117-L119 VanDerWaalsContact C-N 3.31Å; K117-L119 PolarHBondContact O-N 2.83Å; L119-E121 PolarHBondContact O-N 3.2Å; L119-S122 PolarHBondContact O-N 3.02Å; L119-I123 HydrophobicContact CD1-CD1 4.01Å; L119-I123 HydrophobicContact CD1-CG1 4.33Å; L119-I123 HydrophobicContact CG-CD1 3.86Å; L119-I123 VanDerWaalsContact O-CG1 3.28Å; L119-I123 WeakPolarHBondContact O-CG1 3.44Å; L119-I123 PolarHBondContact O-N 3.29Å
120S87.4Confident83.7Confident23 Ų2370.8 Ų70.816%0.16134%0.339CS..Hα-helixtrans-59-44.7176.4-66.50000111.6Q116 K117 S122 I123 V124Q116-S120 WeakPolarHBondContact O-CB 3.43Å; Q116-S120 PolarHBondContact O-N 3.38Å; Q116-S120 PolarHBondContact O-OG 3.11Å; K117-S120 PolarHBondContact O-N 3.16Å; S120-S122 VanDerWaalsContact C-N 3.35Å; S120-S122 PolarHBondContact O-N 3.46Å; S120-I123 PolarHBondContact O-N 2.96Å; S120-V124 WeakPolarHBondContact O-CB 3.28Å; S120-V124 WeakPolarHBondContact O-CG2 3.38Å; S120-V124 PolarHBondContact O-N 3.34Å
121E86.1Confident84.1Confident57 Ų5765.8 Ų65.827%0.26633%0.325SS..Hα-helixtrans-57.1-46.2174.2-76.9174.317800112K117 L119 I123 V124 E125 V145K117-E121 WeakPolarHBondContact CE-OE1 3.41Å; K117-E121 IonicContact NZ-OE1 3.64Å; K117-E121 WeakPolarHBondContact O-CB 3.42Å; K117-E121 WeakPolarHBondContact O-CG 3.44Å; K117-E121 PolarHBondContact O-N 2.97Å; L119-E121 PolarHBondContact O-N 3.2Å; E121-I123 PolarHBondContact O-N 3.46Å; E121-V124 PolarHBondContact O-N 3.47Å; E121-E125 WeakPolarHBondContact O-CB 3.46Å; E121-E125 PolarHBondContact O-N 3.32Å; E121-V145 HydrophobicContact CB-CG1 4.47Å; E121-V145 HydrophobicContact CG-CG1 3.36Å; E121-V145 HydrophobicContact CG-CG2 4.39Å
122S85.9Confident84.4Confident49 Ų4964.5 Ų64.534%0.34332%0.317SS..Hα-helixtrans-65.2-37.7179.3-59.10000112.6Y118 L119 S120 H126Y118-S122 WeakPolarHBondContact O-CB 3.36Å; Y118-S122 PolarHBondContact O-N 3.49Å; Y118-S122 PolarHBondContact O-OG 2.88Å; L119-S122 PolarHBondContact O-N 3.02Å; S120-S122 VanDerWaalsContact C-N 3.35Å; S120-S122 PolarHBondContact O-N 3.46Å; S122-H126 WeakPolarHBondContact O-CB 3.49Å; S122-H126 PolarHBondContact O-N 3.13Å; S122-H126 VanDerWaalsContact O-N 3.09Å
123I88.2Confident84.4Confident56 Ų5664.6 Ų64.629%0.28732%0.315SS..Hα-helixtrans-68.3-48.2175.9-66.3165.8000110L119 S120 E121 E125 H126 L127 L139 L283L119-I123 HydrophobicContact CD1-CD1 4.01Å; L119-I123 HydrophobicContact CD1-CG1 4.33Å; L119-I123 HydrophobicContact CG-CD1 3.86Å; L119-I123 VanDerWaalsContact O-CG1 3.28Å; L119-I123 WeakPolarHBondContact O-CG1 3.44Å; L119-I123 PolarHBondContact O-N 3.29Å; S120-I123 PolarHBondContact O-N 2.96Å; E121-I123 PolarHBondContact O-N 3.46Å; I123-E125 VanDerWaalsContact C-N 3.34Å; I123-E125 PolarHBondContact O-N 3.27Å; I123-H126 WeakPolarHBondContact O-CA 3.25Å; I123-H126 WeakPolarHBondContact O-CB 3.34Å; I123-H126 PolarHBondContact O-N 3.47Å; I123-H126 VanDerWaalsContact O-N 3.11Å; I123-L127 HydrophobicContact CG2-CD1 4.11Å; I123-L127 HydrophobicContact CG2-CG 4.29Å; I123-L127 WeakPolarHBondContact O-CG 3.33Å; I123-L127 PolarHBondContact O-N 2.88Å; I123-L139 HydrophobicContact CB-CD2 4.16Å; I123-L139 HydrophobicContact CG2-CD2 3.53Å; I123-L283 HydrophobicContact CB-CD2 4.36Å; I123-L283 HydrophobicContact CG1-CD2 3.85Å
124V87.3Confident84.6Confident0 Ų063.6 Ų63.60%031%0.31CS..Hα-helixtrans-61.8-43.3179.5174.80000110.8S120 E121 H126 L127 Y128 A136 L139 C140 I147S120-V124 WeakPolarHBondContact O-CB 3.28Å; S120-V124 WeakPolarHBondContact O-CG2 3.38Å; S120-V124 PolarHBondContact O-N 3.34Å; E121-V124 PolarHBondContact O-N 3.47Å; V124-H126 VanDerWaalsContact C-N 3.28Å; V124-H126 PolarHBondContact O-N 3.32Å; V124-L127 PolarHBondContact O-N 3.43Å; V124-Y128 HydrophobicContact CG1-CD2 3.63Å; V124-Y128 HydrophobicContact CG1-CE2 3.33Å; V124-Y128 VanDerWaalsContact O-CD2 3.28Å; V124-Y128 WeakPolarHBondContact O-CD2 3.48Å; V124-Y128 PolarHBondContact O-N 2.94Å; V124-A136 HydrophobicContact CG1-CB 4.15Å; V124-L139 HydrophobicContact CG2-CB 4.17Å; V124-L139 HydrophobicContact CG2-CD2 3.62Å; V124-L139 HydrophobicContact CG2-CG 3.82Å; V124-C140 WeakPolarHBondContact CG1-SG 3.42Å; V124-I147 HydrophobicContact CB-CD1 3.71Å; V124-I147 HydrophobicContact CG1-CD1 3.23Å; V124-I147 HydrophobicContact CG1-CG1 4.28Å
125E83.1Confident84.8Confident52 Ų5260.4 Ų60.424%0.24330%0.3CS..Hα-helixtrans-59.1-41.2174.6-167.1-16415500111.5E121 I123 Y128 R129 F155E121-E125 WeakPolarHBondContact O-CB 3.46Å; E121-E125 PolarHBondContact O-N 3.32Å; I123-E125 VanDerWaalsContact C-N 3.34Å; I123-E125 PolarHBondContact O-N 3.27Å; E125-Y128 PolarHBondContact O-N 3.18Å; E125-R129 VanDerWaalsContact O-CG 3.32Å; E125-R129 WeakPolarHBondContact O-CG 3.32Å; E125-R129 PolarHBondContact O-N 2.87Å; E125-R129 IonicContact OE1-CZ 2.9Å; E125-R129 IonicContact OE1-NE 3.08Å; E125-R129 PolarHBondContact OE1-NE 3.32Å; E125-R129 IonicContact OE1-NH2 2.65Å; E125-R129 PolarHBondContact OE1-NH2 3.16Å; E125-F155 HydrophobicContact CG-CE2 4.49Å; E125-F155 HydrophobicContact CG-CZ 4.49Å
126H86.5Confident85Confident38 Ų3854.8 Ų54.818%0.17628%0.279CS..Hα-helixtrans-62.1-45.3174.3-177.784.9000112.2S122 I123 V124 Y128 R129 Q130 S281 L283S122-H126 WeakPolarHBondContact O-CB 3.49Å; S122-H126 PolarHBondContact O-N 3.13Å; S122-H126 VanDerWaalsContact O-N 3.09Å; I123-H126 WeakPolarHBondContact O-CA 3.25Å; I123-H126 WeakPolarHBondContact O-CB 3.34Å; I123-H126 PolarHBondContact O-N 3.47Å; I123-H126 VanDerWaalsContact O-N 3.11Å; V124-H126 VanDerWaalsContact C-N 3.28Å; V124-H126 PolarHBondContact O-N 3.32Å; H126-Y128 VanDerWaalsContact C-N 3.33Å; H126-Y128 PolarHBondContact O-N 3.2Å; H126-R129 WeakPolarHBondContact O-CB 3.38Å; H126-R129 PolarHBondContact O-N 3.17Å; H126-R129 VanDerWaalsContact O-N 3.16Å; H126-Q130 WeakPolarHBondContact O-CG 3.32Å; H126-Q130 PolarHBondContact O-N 3.43Å; H126-S281 VanDerWaalsContact ND1-CB 3.25Å; H126-S281 WeakPolarHBondContact ND1-CB 3.3Å; H126-S281 PolarHBondContact ND1-OG 3.29Å; H126-L283 HydrophobicContact CB-CB 4.26Å; H126-L283 HydrophobicContact CB-CD2 3.76Å
127L86.2Confident85.1Confident19 Ų1955.1 Ų55.110%0.09928%0.28CS..Hα-helixtrans-61.5-42.1178-66.8174.3000111.4I123 V124 Q130 G131 M132 V135 A136 L139I123-L127 HydrophobicContact CG2-CD1 4.11Å; I123-L127 HydrophobicContact CG2-CG 4.29Å; I123-L127 WeakPolarHBondContact O-CG 3.33Å; I123-L127 PolarHBondContact O-N 2.88Å; V124-L127 PolarHBondContact O-N 3.43Å; L127-Q130 PolarHBondContact O-N 3.45Å; L127-G131 PolarHBondContact O-N 2.95Å; L127-M132 HydrophobicContact CB-CB 4.44Å; L127-M132 HydrophobicContact CD2-CB 4.28Å; L127-M132 HydrophobicContact CD2-CE 3.37Å; L127-M132 HydrophobicContact CD2-SD 4.23Å; L127-M132 PolarHBondContact O-N 3.49Å; L127-V135 HydrophobicContact CD1-CB 4.42Å; L127-V135 HydrophobicContact CD1-CG1 3.97Å; L127-V135 HydrophobicContact CD2-CG1 4.43Å; L127-A136 HydrophobicContact CB-CB 3.77Å; L127-A136 HydrophobicContact CD1-CB 4.3Å; L127-L139 HydrophobicContact CD1-CD2 3.95Å
128Y82.8Confident85.3Confident5 Ų554.2 Ų54.22%0.0228%0.281CS..Hα-helixtrans-61-43.8172.7-79-54000111.7V124 E125 H126 Q130 G131 L133 A136 I147 K152 N159V124-Y128 HydrophobicContact CG1-CD2 3.63Å; V124-Y128 HydrophobicContact CG1-CE2 3.33Å; V124-Y128 VanDerWaalsContact O-CD2 3.28Å; V124-Y128 WeakPolarHBondContact O-CD2 3.48Å; V124-Y128 PolarHBondContact O-N 2.94Å; E125-Y128 PolarHBondContact O-N 3.18Å; H126-Y128 VanDerWaalsContact C-N 3.33Å; H126-Y128 PolarHBondContact O-N 3.2Å; Y128-Q130 PolarHBondContact O-N 2.89Å; Y128-G131 PolarHBondContact O-N 3.42Å; Y128-G131 VanDerWaalsContact O-N 3.17Å; Y128-L133 HydrophobicContact CD1-CD2 3.58Å; Y128-L133 HydrophobicContact CE1-CD2 3.99Å; Y128-A136 HydrophobicContact CD1-CB 4.03Å; Y128-A136 HydrophobicContact CD2-CB 4.23Å; Y128-A136 HydrophobicContact CE1-CB 3.76Å; Y128-A136 HydrophobicContact CE2-CB 4.01Å; Y128-A136 HydrophobicContact CG-CB 4.22Å; Y128-I147 HydrophobicContact CE2-CD1 4.27Å; Y128-K152 HydrophobicContact CE1-CD 4.41Å; Y128-K152 HydrophobicContact CE2-CD 4.01Å; Y128-K152 HydrophobicContact CE2-CG 4.08Å; Y128-K152 WeakPolarHBondContact OH-CE 3.49Å; Y128-K152 PolarHBondContact OH-NZ 2.92Å; Y128-N159 PolarHBondContact O-ND2 3.31Å
129R80.6Confident85.4Confident33 Ų3349.1 Ų49.113%0.12526%0.263CS..Hα-helixtrans-63.1-28.2175.9-74.1165.5176.6-123.411.8113.7E125 H126 F155 S278 E280E125-R129 VanDerWaalsContact O-CG 3.32Å; E125-R129 WeakPolarHBondContact O-CG 3.32Å; E125-R129 PolarHBondContact O-N 2.87Å; E125-R129 IonicContact OE1-CZ 2.9Å; E125-R129 IonicContact OE1-NE 3.08Å; E125-R129 PolarHBondContact OE1-NE 3.32Å; E125-R129 IonicContact OE1-NH2 2.65Å; E125-R129 PolarHBondContact OE1-NH2 3.16Å; H126-R129 WeakPolarHBondContact O-CB 3.38Å; H126-R129 PolarHBondContact O-N 3.17Å; H126-R129 VanDerWaalsContact O-N 3.16Å; R129-F155 HydrophobicContact CG-CD1 3.68Å; R129-F155 HydrophobicContact CG-CE1 3.3Å; R129-F155 HydrophobicContact CG-CZ 3.92Å; R129-S278 PolarHBondContact NH1-O 3.22Å; R129-S278 PolarHBondContact NH1-OG 3.13Å; R129-S278 PolarHBondContact NH2-OG 3.02Å; R129-E280 PolarHBondContact NH1-O 3.02Å
130Q82.3Confident85.4Confident98 Ų9847 Ų4746%0.45825%0.253SS..Hα-helixtrans-86.1-8.2177.7-66.5-61.3-26.100113.8H126 L127 Y128 M132H126-Q130 WeakPolarHBondContact O-CG 3.32Å; H126-Q130 PolarHBondContact O-N 3.43Å; L127-Q130 PolarHBondContact O-N 3.45Å; Y128-Q130 PolarHBondContact O-N 2.89Å; Q130-M132 HydrophobicContact CB-CE 3.84Å; Q130-M132 HydrophobicContact CG-CE 4.28Å
131G81.3Confident85.4Confident18 Ų1853.7 Ų53.719%0.18628%0.282CS..THydrogen-bonded Turntrans8210.6-175.500000114.5L127 Y128 L133 N159L127-G131 PolarHBondContact O-N 2.95Å; Y128-G131 PolarHBondContact O-N 3.42Å; Y128-G131 VanDerWaalsContact O-N 3.17Å; G131-L133 VanDerWaalsContact C-N 3.25Å; G131-L133 PolarHBondContact O-N 3Å; G131-N159 VanDerWaalsContact CA-CG 3.47Å; G131-N159 WeakPolarHBondContact CA-ND2 3.3Å; G131-N159 WeakPolarHBondContact CA-OD1 3.25Å; G131-N159 PolarHBondContact N-OD1 3.49Å
132M84.4Confident85.4Confident82 Ų8258.9 Ų58.940%0.40431%0.306SS..  trans-84.567.3176.5-68.6-173.1-7800110.9L127 Q130 V135 A136L127-M132 HydrophobicContact CB-CB 4.44Å; L127-M132 HydrophobicContact CD2-CB 4.28Å; L127-M132 HydrophobicContact CD2-CE 3.37Å; L127-M132 HydrophobicContact CD2-SD 4.23Å; L127-M132 PolarHBondContact O-N 3.49Å; Q130-M132 HydrophobicContact CB-CE 3.84Å; Q130-M132 HydrophobicContact CG-CE 4.28Å; M132-V135 HydrophobicContact CB-CB 4.38Å; M132-V135 HydrophobicContact CB-CG2 4.44Å; M132-A136 WeakPolarHBondContact O-CB 3.37Å; M132-A136 PolarHBondContact O-N 2.61Å; M132-A136 VanDerWaalsContact O-N 3.07Å
133L83.4Confident85.1Confident53 Ų5358.7 Ų58.728%0.27731%0.305SS..Hα-helixtrans-65.8-44.6-170.8-54.8-179.7000113.2Y128 G131 V135 A136 E137 L156Y128-L133 HydrophobicContact CD1-CD2 3.58Å; Y128-L133 HydrophobicContact CE1-CD2 3.99Å; G131-L133 VanDerWaalsContact C-N 3.25Å; G131-L133 PolarHBondContact O-N 3Å; L133-V135 PolarHBondContact O-N 2.68Å; L133-A136 WeakPolarHBondContact O-CB 3.48Å; L133-A136 PolarHBondContact O-N 3.07Å; L133-E137 WeakPolarHBondContact O-CG 3.43Å; L133-E137 PolarHBondContact O-N 3.2Å; L133-L156 HydrophobicContact CD1-CD2 3.41Å; L133-L156 VanDerWaalsContact CD1-CD2 3.41Å; L133-L156 HydrophobicContact CD2-CD2 3.48Å; L133-L156 VanDerWaalsContact CD2-CD2 3.48Å; L133-L156 HydrophobicContact CG-CD2 4.05Å
134S85.9Confident84.7Confident76 Ų7659 Ų5953%0.53132%0.322SS..Hα-helixtrans-61.4-47.1-179.855.40000111.6A136 E137 D138S134-A136 VanDerWaalsContact C-N 3.29Å; S134-A136 PolarHBondContact O-N 3.27Å; S134-E137 PolarHBondContact O-N 3.22Å; S134-E137 VanDerWaalsContact O-N 3.15Å; S134-D138 VanDerWaalsContact O-CG 3.3Å; S134-D138 PolarHBondContact O-N 3.43Å
135V89Confident84.4Confident70 Ų7059.2 Ų59.242%0.42432%0.324SS..Hα-helixtrans-63.8-37.8178.9-172.60000111L127 M132 L133 E137 L139L127-V135 HydrophobicContact CD1-CB 4.42Å; L127-V135 HydrophobicContact CD1-CG1 3.97Å; L127-V135 HydrophobicContact CD2-CG1 4.43Å; M132-V135 HydrophobicContact CB-CB 4.38Å; M132-V135 HydrophobicContact CB-CG2 4.44Å; L133-V135 PolarHBondContact O-N 2.68Å; V135-E137 VanDerWaalsContact C-N 3.35Å; V135-L139 VanDerWaalsContact O-CB 3.31Å; V135-L139 WeakPolarHBondContact O-CB 3.41Å; V135-L139 PolarHBondContact O-N 3.45Å
136A85.9Confident83.9Confident0 Ų063.1 Ų63.10%035%0.35CS..Hα-helixtrans-64.3-40175.700000112V124 L127 Y128 M132 L133 S134 C140V124-A136 HydrophobicContact CG1-CB 4.15Å; L127-A136 HydrophobicContact CB-CB 3.77Å; L127-A136 HydrophobicContact CD1-CB 4.3Å; Y128-A136 HydrophobicContact CD1-CB 4.03Å; Y128-A136 HydrophobicContact CD2-CB 4.23Å; Y128-A136 HydrophobicContact CE1-CB 3.76Å; Y128-A136 HydrophobicContact CE2-CB 4.01Å; Y128-A136 HydrophobicContact CG-CB 4.22Å; M132-A136 WeakPolarHBondContact O-CB 3.37Å; M132-A136 PolarHBondContact O-N 2.61Å; M132-A136 VanDerWaalsContact O-N 3.07Å; L133-A136 WeakPolarHBondContact O-CB 3.48Å; L133-A136 PolarHBondContact O-N 3.07Å; S134-A136 VanDerWaalsContact C-N 3.29Å; S134-A136 PolarHBondContact O-N 3.27Å; A136-C140 PolarHBondContact O-N 2.93Å; A136-C140 PolarHBondContact O-SG 3.38Å
137E85Confident83.2Confident109 Ų10962.8 Ų62.851%0.50935%0.35SS..Hα-helixtrans-68.7-45.9177.8-73.6174.9179.400112.2L133 S134 V135 L139 C140 Q141L133-E137 WeakPolarHBondContact O-CG 3.43Å; L133-E137 PolarHBondContact O-N 3.2Å; S134-E137 PolarHBondContact O-N 3.22Å; S134-E137 VanDerWaalsContact O-N 3.15Å; V135-E137 VanDerWaalsContact C-N 3.35Å; E137-L139 VanDerWaalsContact C-N 3.32Å; E137-L139 PolarHBondContact O-N 2.96Å; E137-C140 WeakPolarHBondContact O-CB 3.43Å; E137-C140 PolarHBondContact O-N 3.15Å; E137-Q141 PolarHBondContact O-N 2.67Å
138D88.8Confident82.6Confident91 Ų9166.6 Ų66.649%0.48737%0.37SS..Hα-helixtrans-58.3-46.5175.4-66.2-24.8000110.4S134 C140 Q141 E142S134-D138 VanDerWaalsContact O-CG 3.3Å; S134-D138 PolarHBondContact O-N 3.43Å; D138-C140 PolarHBondContact O-N 2.97Å; D138-Q141 WeakPolarHBondContact O-CB 3.49Å; D138-Q141 PolarHBondContact O-N 2.9Å; D138-Q141 VanDerWaalsContact O-N 3.14Å; D138-E142 WeakPolarHBondContact O-CG 3.38Å; D138-E142 PolarHBondContact O-N 3.38Å
139L87.4Confident81.8Confident41 Ų4171.8 Ų71.822%0.21540%0.396CS..Hα-helixtrans-64.3-36.7177.5-176.561.1000112.4I123 V124 L127 V135 E137 Q141 S143I123-L139 HydrophobicContact CB-CD2 4.16Å; I123-L139 HydrophobicContact CG2-CD2 3.53Å; V124-L139 HydrophobicContact CG2-CB 4.17Å; V124-L139 HydrophobicContact CG2-CD2 3.62Å; V124-L139 HydrophobicContact CG2-CG 3.82Å; L127-L139 HydrophobicContact CD1-CD2 3.95Å; V135-L139 VanDerWaalsContact O-CB 3.31Å; V135-L139 WeakPolarHBondContact O-CB 3.41Å; V135-L139 PolarHBondContact O-N 3.45Å; E137-L139 VanDerWaalsContact C-N 3.32Å; E137-L139 PolarHBondContact O-N 2.96Å; L139-Q141 VanDerWaalsContact C-N 3.33Å; L139-S143 VanDerWaalsContact O-CB 3.26Å; L139-S143 WeakPolarHBondContact O-CB 3.34Å; L139-S143 PolarHBondContact O-N 3.09Å; L139-S143 PolarHBondContact O-OG 3.11Å
140C86.4Confident81.3Confident16 Ų1673.5 Ų73.511%0.10841%0.413CS..Hα-helixtrans-61.5-43.2173.3-72.80000111.4V124 A136 E137 D138 G144 V145V124-C140 WeakPolarHBondContact CG1-SG 3.42Å; A136-C140 PolarHBondContact O-N 2.93Å; A136-C140 PolarHBondContact O-SG 3.38Å; E137-C140 WeakPolarHBondContact O-CB 3.43Å; E137-C140 PolarHBondContact O-N 3.15Å; D138-C140 PolarHBondContact O-N 2.97Å; C140-G144 PolarHBondContact O-N 2.95Å; C140-V145 PolarHBondContact O-N 3.43Å
141Q86.3Confident80.7Confident165 Ų16573.9 Ų73.977%0.77142%0.416SS*.Hα-helixtrans-66.3-41.8-179.4-174175.1-1.800111.6E137 D138 L139E137-Q141 PolarHBondContact O-N 2.67Å; D138-Q141 WeakPolarHBondContact O-CB 3.49Å; D138-Q141 PolarHBondContact O-N 2.9Å; D138-Q141 VanDerWaalsContact O-N 3.14Å; L139-Q141 VanDerWaalsContact C-N 3.33Å
142E85.8Confident80.3Confident165 Ų16574 Ų7477%0.77141%0.412SS*.Hα-helixtrans-72.5-40.1179.6-70.5-178.4172.400113.1D138D138-E142 WeakPolarHBondContact O-CG 3.38Å; D138-E142 PolarHBondContact O-N 3.38Å
143S81.6Confident80Confident45 Ų4575.5 Ų75.532%0.31542%0.417SS..Hα-helixtrans-85.3-10.2-177.962.90000114.1L139 V145L139-S143 VanDerWaalsContact O-CB 3.26Å; L139-S143 WeakPolarHBondContact O-CB 3.34Å; L139-S143 PolarHBondContact O-N 3.09Å; L139-S143 PolarHBondContact O-OG 3.11Å; S143-V145 PolarHBondContact O-N 3.43Å; S143-V145 WeakPolarHBondContact OG-CG2 3.43Å
144G79.3Confident79.9Confident62 Ų6274.5 Ų74.564%0.63941%0.414SS*.THydrogen-bonded Turntrans67.814.5-17500000113.9C140C140-G144 PolarHBondContact O-N 2.95Å
145V79.6Confident79.5Confident6 Ų671.3 Ų71.34%0.03639%0.391CS..  trans-79.5122.2179.4174.50000109.8K117 E121 C140 S143 I147K117-V145 HydrophobicContact CG-CG2 4.18Å; E121-V145 HydrophobicContact CB-CG1 4.47Å; E121-V145 HydrophobicContact CG-CG1 3.36Å; E121-V145 HydrophobicContact CG-CG2 4.39Å; C140-V145 PolarHBondContact O-N 3.43Å; S143-V145 PolarHBondContact O-N 3.43Å; S143-V145 WeakPolarHBondContact OG-CG2 3.43Å; V145-I147 HydrophobicContact CG1-CG1 3.91Å
146V73.9Confident79.2Confident133 Ų13370.4 Ų70.481%0.80638%0.383SS*.  trans-100104.5174.4-175.80000108.8
147I71.3Confident79.2Confident31 Ų3175.2 Ų75.216%0.15941%0.406CS..  trans-88.1128.7169.5-58-165.8000109V124 Y128 V145 M149 M151 K152V124-I147 HydrophobicContact CB-CD1 3.71Å; V124-I147 HydrophobicContact CG1-CD1 3.23Å; V124-I147 HydrophobicContact CG1-CG1 4.28Å; Y128-I147 HydrophobicContact CE2-CD1 4.27Å; V145-I147 HydrophobicContact CG1-CG1 3.91Å; I147-M149 PolarHBondContact O-N 2.86Å; I147-M151 HydrophobicContact CG2-CB 4.38Å; I147-K152 VanDerWaalsContact CB-CE 3.5Å; I147-K152 HydrophobicContact CG2-CD 4.49Å; I147-K152 HydrophobicContact CG2-CG 3.96Å; I147-K152 VanDerWaalsContact O-CE 3.25Å; I147-K152 WeakPolarHBondContact O-CE 3.26Å
148D73Confident79.2Confident100 Ų10070.6 Ų70.654%0.53539%0.385SS..  trans-59.2133.4176-173.13.4000110.8S150 M151 K152D148-S150 PolarHBondContact O-N 2.9Å; D148-S150 PolarHBondContact OD1-N 3.46Å; D148-S150 PolarHBondContact OD2-OG 3.27Å; D148-M151 HydrophobicContact CB-CG 4.49Å; D148-M151 WeakPolarHBondContact O-CB 3.5Å; D148-M151 PolarHBondContact O-N 3.21Å; D148-M151 VanDerWaalsContact O-N 3.07Å; D148-K152 PolarHBondContact O-N 3.17Å
149M67.3Low79.1Confident113 Ų11366.8 Ų66.856%0.55736%0.364SS*.Hα-helixtrans-59.4-30177.7-73.5-67.4178.400112I147 M151 K152 Q153I147-M149 PolarHBondContact O-N 2.86Å; M149-M151 PolarHBondContact O-N 3.36Å; M149-K152 PolarHBondContact O-N 3.07Å; M149-K152 HydrophobicContact SD-CD 3.76Å; M149-Q153 WeakPolarHBondContact O-CG 3.45Å; M149-Q153 PolarHBondContact O-N 2.68Å
150S70.4Confident79.2Confident70 Ų7073.5 Ų73.549%0.4939%0.387SS..Hα-helixtrans-57.6-34.8175.771.90000112.7D148 P154D148-S150 PolarHBondContact O-N 2.9Å; D148-S150 PolarHBondContact OD1-N 3.46Å; D148-S150 PolarHBondContact OD2-OG 3.27Å; S150-P154 VanDerWaalsContact O-CD 3.31Å; S150-P154 WeakPolarHBondContact O-CD 3.19Å
151M69.5Low79.3Confident105 Ų10573 Ų7352%0.51738%0.383SS..Hα-helixtrans-80.5-23177.4-63.4-65.1-71.200112.1I147 D148 M149 F155I147-M151 HydrophobicContact CG2-CB 4.38Å; D148-M151 HydrophobicContact CB-CG 4.49Å; D148-M151 WeakPolarHBondContact O-CB 3.5Å; D148-M151 PolarHBondContact O-N 3.21Å; D148-M151 VanDerWaalsContact O-N 3.07Å; M149-M151 PolarHBondContact O-N 3.36Å; M151-F155 WeakPolarHBondContact O-CD2 3.17Å; M151-F155 VanDerWaalsContact O-CE2 3.27Å; M151-F155 WeakPolarHBondContact O-CE2 3.29Å
152K72.1Confident79.4Confident22 Ų2266 Ų6610%0.09635%0.351CS..Hα-helixtrans-82.8-41.3-179.2-62.6-176.7-174.3-169.60113.2Y128 I147 D148 M149 P154 F155 L156Y128-K152 HydrophobicContact CE1-CD 4.41Å; Y128-K152 HydrophobicContact CE2-CD 4.01Å; Y128-K152 HydrophobicContact CE2-CG 4.08Å; Y128-K152 WeakPolarHBondContact OH-CE 3.49Å; Y128-K152 PolarHBondContact OH-NZ 2.92Å; I147-K152 VanDerWaalsContact CB-CE 3.5Å; I147-K152 HydrophobicContact CG2-CD 4.49Å; I147-K152 HydrophobicContact CG2-CG 3.96Å; I147-K152 VanDerWaalsContact O-CE 3.25Å; I147-K152 WeakPolarHBondContact O-CE 3.26Å; D148-K152 PolarHBondContact O-N 3.17Å; M149-K152 PolarHBondContact O-N 3.07Å; M149-K152 HydrophobicContact SD-CD 3.76Å; K152-P154 VanDerWaalsContact C-CD 3.44Å; K152-P154 VanDerWaalsContact C-N 3.34Å; K152-F155 PolarHBondContact O-N 3.07Å; K152-L156 WeakPolarHBondContact O-CG 3.29Å; K152-L156 PolarHBondContact O-N 2.76Å
153Q78.1Confident79.4Confident112 Ų11263 Ų6352%0.52334%0.336SS..Hα-helixtrans-51.4-44.3-173.7-71.2-61-44.800113.7M149 F155 L156 E157M149-Q153 WeakPolarHBondContact O-CG 3.45Å; M149-Q153 PolarHBondContact O-N 2.68Å; Q153-F155 VanDerWaalsContact C-N 3.34Å; Q153-F155 PolarHBondContact O-N 2.87Å; Q153-L156 PolarHBondContact O-N 3Å; Q153-E157 PolarHBondContact O-N 2.93Å
154P80.4Confident79.8Confident32 Ų3261.6 Ų61.621%0.20833%0.328CS..Hα-helixtrans-64.5-36.5179.3-22.134.5000113.4S150 K152 L158 L275S150-P154 VanDerWaalsContact O-CD 3.31Å; S150-P154 WeakPolarHBondContact O-CD 3.19Å; K152-P154 VanDerWaalsContact C-CD 3.44Å; K152-P154 VanDerWaalsContact C-N 3.34Å; P154-L158 VanDerWaalsContact O-CB 3.28Å; P154-L158 WeakPolarHBondContact O-CB 3.43Å; P154-L158 PolarHBondContact O-N 3.38Å; P154-L275 HydrophobicContact CB-CD1 3.56Å; P154-L275 HydrophobicContact CB-CD2 3.7Å; P154-L275 HydrophobicContact CB-CG 4.24Å; P154-L275 HydrophobicContact CG-CD2 4.14Å
155F79.4Confident80.2Confident9 Ų958.7 Ų58.74%0.03930%0.298CS..Hα-helixtrans-71.5-36.7176.6-62.7-65.6000111.8E125 R129 M151 K152 Q153 L158 N159 L277E125-F155 HydrophobicContact CG-CE2 4.49Å; E125-F155 HydrophobicContact CG-CZ 4.49Å; R129-F155 HydrophobicContact CG-CD1 3.68Å; R129-F155 HydrophobicContact CG-CE1 3.3Å; R129-F155 HydrophobicContact CG-CZ 3.92Å; M151-F155 WeakPolarHBondContact O-CD2 3.17Å; M151-F155 VanDerWaalsContact O-CE2 3.27Å; M151-F155 WeakPolarHBondContact O-CE2 3.29Å; K152-F155 PolarHBondContact O-N 3.07Å; Q153-F155 VanDerWaalsContact C-N 3.34Å; Q153-F155 PolarHBondContact O-N 2.87Å; F155-L158 PolarHBondContact O-N 3.06Å; F155-N159 WeakPolarHBondContact O-CB 3.37Å; F155-N159 VanDerWaalsContact O-CG 3.31Å; F155-N159 PolarHBondContact O-N 2.89Å; F155-N159 PolarHBondContact O-ND2 3.45Å; F155-L277 HydrophobicContact CE1-CD1 3.6Å; F155-L277 HydrophobicContact CE2-CD1 4.26Å; F155-L277 HydrophobicContact CZ-CD1 3.44Å; F155-L277 VanDerWaalsContact CZ-CD1 3.44Å; F155-L277 HydrophobicContact CZ-CD2 4.32Å; F155-L277 HydrophobicContact CZ-CG 4.47Å
156L81.2Confident80.5Confident51 Ų5166.9 Ų66.927%0.26733%0.328SS..Hα-helixtrans-61.6-46.1174.7-67.7173.9000111.2L133 K152 Q153 R160L133-L156 HydrophobicContact CD1-CD2 3.41Å; L133-L156 VanDerWaalsContact CD1-CD2 3.41Å; L133-L156 HydrophobicContact CD2-CD2 3.48Å; L133-L156 VanDerWaalsContact CD2-CD2 3.48Å; L133-L156 HydrophobicContact CG-CD2 4.05Å; K152-L156 WeakPolarHBondContact O-CG 3.29Å; K152-L156 PolarHBondContact O-N 2.76Å; Q153-L156 PolarHBondContact O-N 3Å; L156-R160 VanDerWaalsContact O-CB 3.31Å; L156-R160 WeakPolarHBondContact O-CB 3.28Å; L156-R160 PolarHBondContact O-N 3.33Å
157E85.5Confident81.1Confident101 Ų10168 Ų6847%0.47233%0.326SS..Hα-helixtrans-63.6-46.3176.2-171.9179.2-170.900111.5Q153 N159 R160 I161Q153-E157 PolarHBondContact O-N 2.93Å; E157-N159 PolarHBondContact O-N 3.18Å; E157-R160 PolarHBondContact O-N 3.4Å; E157-I161 HydrophobicContact CG-CD1 4.01Å; E157-I161 WeakPolarHBondContact O-CG1 3.33Å; E157-I161 PolarHBondContact O-N 3.45Å
158L86.3Confident81.7Confident13 Ų1372.7 Ų72.77%0.06835%0.347CS..Hα-helixtrans-57.1-50.8177.3-172.588.1000111.6P154 F155 I161 L162 F267 A271P154-L158 VanDerWaalsContact O-CB 3.28Å; P154-L158 WeakPolarHBondContact O-CB 3.43Å; P154-L158 PolarHBondContact O-N 3.38Å; F155-L158 PolarHBondContact O-N 3.06Å; L158-I161 PolarHBondContact O-N 3.44Å; L158-L162 HydrophobicContact CD2-CD1 4.12Å; L158-L162 HydrophobicContact CG-CD1 4Å; L158-L162 WeakPolarHBondContact O-CB 3.45Å; L158-L162 WeakPolarHBondContact O-CG 3.45Å; L158-L162 PolarHBondContact O-N 3.35Å; L158-F267 HydrophobicContact CD1-CD1 4.15Å; L158-F267 HydrophobicContact CD1-CE1 3.44Å; L158-F267 VanDerWaalsContact CD1-CE1 3.44Å; L158-F267 HydrophobicContact CD1-CZ 4.03Å; L158-F267 HydrophobicContact CG-CE1 4.09Å; L158-A271 HydrophobicContact CD1-CB 3.27Å
159N86Confident82.4Confident10 Ų1070.6 Ų70.65%0.05334%0.336CS..Hα-helixtrans-65.1-40.8-179-73.7-50.3000111.8Y128 G131 F155 E157 I161 L162 E163Y128-N159 PolarHBondContact O-ND2 3.31Å; G131-N159 VanDerWaalsContact CA-CG 3.47Å; G131-N159 WeakPolarHBondContact CA-ND2 3.3Å; G131-N159 WeakPolarHBondContact CA-OD1 3.25Å; G131-N159 PolarHBondContact N-OD1 3.49Å; F155-N159 WeakPolarHBondContact O-CB 3.37Å; F155-N159 VanDerWaalsContact O-CG 3.31Å; F155-N159 PolarHBondContact O-N 2.89Å; F155-N159 PolarHBondContact O-ND2 3.45Å; E157-N159 PolarHBondContact O-N 3.18Å; N159-I161 VanDerWaalsContact C-N 3.28Å; N159-I161 PolarHBondContact O-N 3.02Å; N159-L162 PolarHBondContact O-N 3.25Å; N159-E163 WeakPolarHBondContact O-CB 3.49Å; N159-E163 WeakPolarHBondContact O-CG 3.26Å; N159-E163 PolarHBondContact O-N 3.4Å
160R88.9Confident83.4Confident183 Ų18365.4 Ų65.469%0.69131%0.311SS*.Hα-helixtrans-57.1-43.6174.4180-176.6174.1-166.6-3.4111.4L156 E157 A164L156-R160 VanDerWaalsContact O-CB 3.31Å; L156-R160 WeakPolarHBondContact O-CB 3.28Å; L156-R160 PolarHBondContact O-N 3.33Å; E157-R160 PolarHBondContact O-N 3.4Å; R160-A164 WeakPolarHBondContact O-CB 3.3Å; R160-A164 PolarHBondContact O-N 2.85Å
161I89.6Confident84.3Confident5 Ų569.7 Ų69.73%0.02632%0.316CS..Hα-helixtrans-69.4-42178-64.8165.2000110.8E157 L158 N159 A164 L165 P172 A173 W176 F267E157-I161 HydrophobicContact CG-CD1 4.01Å; E157-I161 WeakPolarHBondContact O-CG1 3.33Å; E157-I161 PolarHBondContact O-N 3.45Å; L158-I161 PolarHBondContact O-N 3.44Å; N159-I161 VanDerWaalsContact C-N 3.28Å; N159-I161 PolarHBondContact O-N 3.02Å; I161-A164 PolarHBondContact O-N 3.19Å; I161-L165 HydrophobicContact CG2-CD1 4.18Å; I161-L165 HydrophobicContact CG2-CG 4.41Å; I161-L165 WeakPolarHBondContact O-CB 3.38Å; I161-L165 VanDerWaalsContact O-CG 3.32Å; I161-L165 WeakPolarHBondContact O-CG 3.31Å; I161-L165 PolarHBondContact O-N 3.49Å; I161-P172 HydrophobicContact CG1-CB 3.94Å; I161-A173 HydrophobicContact CG2-CB 3.66Å; I161-W176 HydrophobicContact CD1-CB 3.65Å; I161-W176 HydrophobicContact CD1-CG 3.67Å; I161-F267 HydrophobicContact CB-CE1 3.98Å; I161-F267 HydrophobicContact CB-CE2 4.46Å; I161-F267 HydrophobicContact CB-CZ 3.69Å; I161-F267 HydrophobicContact CD1-CE2 4.23Å; I161-F267 HydrophobicContact CD1-CZ 3.69Å; I161-F267 HydrophobicContact CG1-CZ 4.29Å; I161-F267 HydrophobicContact CG2-CD1 4.42Å; I161-F267 HydrophobicContact CG2-CD2 4.37Å; I161-F267 HydrophobicContact CG2-CE1 3.75Å; I161-F267 HydrophobicContact CG2-CE2 3.7Å; I161-F267 HydrophobicContact CG2-CZ 3.37Å
162L87.5Confident85.3Confident18 Ų1866 Ų669%0.09430%0.3CS..Hα-helixtrans-64-39.9177.4-74.8173.4000112.6L158 N159 L165 R166 C264 F267L158-L162 HydrophobicContact CD2-CD1 4.12Å; L158-L162 HydrophobicContact CG-CD1 4Å; L158-L162 WeakPolarHBondContact O-CB 3.45Å; L158-L162 WeakPolarHBondContact O-CG 3.45Å; L158-L162 PolarHBondContact O-N 3.35Å; N159-L162 PolarHBondContact O-N 3.25Å; L162-L165 HydrophobicContact CD2-CD1 4.49Å; L162-L165 PolarHBondContact O-N 2.91Å; L162-R166 WeakPolarHBondContact O-CG 3.44Å; L162-R166 PolarHBondContact O-N 3.22Å; L162-C264 HydrophobicContact CD2-CB 4.16Å; L162-F267 HydrophobicContact CD2-CD1 3.73Å; L162-F267 HydrophobicContact CD2-CE1 4.27Å; L162-F267 HydrophobicContact CG-CD1 4.09Å; L162-F267 HydrophobicContact CG-CE1 4.12Å
163E87.6Confident86.2Confident101 Ų10164.9 Ų64.947%0.47230%0.295SS..Hα-helixtrans-64.1-44.5173.3-75.8175.8-174.300111.4N159 L165 R166 M167N159-E163 WeakPolarHBondContact O-CB 3.49Å; N159-E163 WeakPolarHBondContact O-CG 3.26Å; N159-E163 PolarHBondContact O-N 3.4Å; E163-L165 VanDerWaalsContact C-N 3.33Å; E163-L165 PolarHBondContact O-N 3.47Å; E163-R166 WeakPolarHBondContact O-CB 3.31Å; E163-R166 PolarHBondContact O-N 3.31Å; E163-M167 WeakPolarHBondContact O-CG 3.06Å; E163-M167 PolarHBondContact O-N 3.2Å
164A88.7Confident86.7Confident16 Ų1660.4 Ų60.413%0.13227%0.274CS..Hα-helixtrans-59.1-44.3174.200000111.5R160 I161 R166 M167 Q168 D169 P172R160-A164 WeakPolarHBondContact O-CB 3.3Å; R160-A164 PolarHBondContact O-N 2.85Å; I161-A164 PolarHBondContact O-N 3.19Å; A164-R166 VanDerWaalsContact C-N 3.33Å; A164-R166 PolarHBondContact O-N 3.11Å; A164-M167 CarbonylContact O-C 3.36Å; A164-M167 WeakPolarHBondContact O-CA 3.4Å; A164-M167 PolarHBondContact O-N 2.84Å; A164-M167 VanDerWaalsContact O-N 3.1Å; A164-Q168 PolarHBondContact O-N 3.37Å; A164-Q168 VanDerWaalsContact O-N 3.14Å; A164-D169 CarbonylContact C-O 3.36Å; A164-D169 HydrophobicContact CB-CB 4.3Å; A164-D169 PolarHBondContact O-N 3.11Å; A164-P172 HydrophobicContact CB-CB 4.32Å; A164-P172 HydrophobicContact CB-CG 3.71Å
165L87.9Confident87.2Confident2 Ų265.1 Ų65.11%0.0129%0.294CS..Hα-helixtrans-61.6-38.7175.4-73.9173.7000112.5I161 L162 E163 M167 Q168 L170 A173 L195 W260 F267I161-L165 HydrophobicContact CG2-CD1 4.18Å; I161-L165 HydrophobicContact CG2-CG 4.41Å; I161-L165 WeakPolarHBondContact O-CB 3.38Å; I161-L165 VanDerWaalsContact O-CG 3.32Å; I161-L165 WeakPolarHBondContact O-CG 3.31Å; I161-L165 PolarHBondContact O-N 3.49Å; L162-L165 HydrophobicContact CD2-CD1 4.49Å; L162-L165 PolarHBondContact O-N 2.91Å; E163-L165 VanDerWaalsContact C-N 3.33Å; E163-L165 PolarHBondContact O-N 3.47Å; L165-M167 VanDerWaalsContact C-N 3.3Å; L165-M167 PolarHBondContact O-N 3.12Å; L165-Q168 PolarHBondContact O-N 2.88Å; L165-Q168 VanDerWaalsContact O-N 3.11Å; L165-L170 HydrophobicContact CD2-CD2 3.75Å; L165-A173 HydrophobicContact CD1-CB 4.13Å; L165-A173 HydrophobicContact CD2-CB 3.72Å; L165-A173 HydrophobicContact CG-CB 4.04Å; L165-L195 HydrophobicContact CD2-CD2 4.28Å; L165-W260 HydrophobicContact CD2-CZ3 4.49Å; L165-F267 HydrophobicContact CD1-CB 4.46Å; L165-F267 HydrophobicContact CD1-CD1 4.45Å; L165-F267 HydrophobicContact CD1-CG 4.34Å
166R85.4Confident87.7Confident177 Ų17765.8 Ų65.867%0.66830%0.296SS*.Hα-helixtrans-64.9-34.9173.8-73172.9-176.3171.73.1112.1L162 E163 A164 Q168L162-R166 WeakPolarHBondContact O-CG 3.44Å; L162-R166 PolarHBondContact O-N 3.22Å; E163-R166 WeakPolarHBondContact O-CB 3.31Å; E163-R166 PolarHBondContact O-N 3.31Å; A164-R166 VanDerWaalsContact C-N 3.33Å; A164-R166 PolarHBondContact O-N 3.11Å; R166-Q168 PolarHBondContact O-N 3.34Å
167M87.1Confident88.1Confident158 Ų15863.3 Ų63.378%0.77828%0.283SS*.THydrogen-bonded Turntrans-81.89.8173.7-64-56.7-69.900113.5E163 A164 L165 D169E163-M167 WeakPolarHBondContact O-CG 3.06Å; E163-M167 PolarHBondContact O-N 3.2Å; A164-M167 CarbonylContact O-C 3.36Å; A164-M167 WeakPolarHBondContact O-CA 3.4Å; A164-M167 PolarHBondContact O-N 2.84Å; A164-M167 VanDerWaalsContact O-N 3.1Å; L165-M167 VanDerWaalsContact C-N 3.3Å; L165-M167 PolarHBondContact O-N 3.12Å; M167-D169 PolarHBondContact O-N 3.21Å
168Q84.4Confident88.2Confident128 Ų12861.9 Ų61.960%0.59828%0.281SS*.THydrogen-bonded Turntrans62.220.6-178.2-56.9-178.7-10.800114.9A164 L165 R166 W260A164-Q168 PolarHBondContact O-N 3.37Å; A164-Q168 VanDerWaalsContact O-N 3.14Å; L165-Q168 PolarHBondContact O-N 2.88Å; L165-Q168 VanDerWaalsContact O-N 3.11Å; R166-Q168 PolarHBondContact O-N 3.34Å; Q168-W260 HydrophobicContact CB-CH2 3.75Å; Q168-W260 HydrophobicContact CB-CZ2 4.02Å; Q168-W260 HydrophobicContact CB-CZ3 4.2Å; Q168-W260 HydrophobicContact CG-CH2 4.15Å; Q168-W260 HydrophobicContact CG-CZ2 4.05Å; Q168-W260 HydrophobicContact CG-CZ3 4.44Å
169D87.4Confident88.3Confident56 Ų5666 Ų6630%0.29931%0.311SS..  trans-92.8109.9170.7-170.412.6000110.8A164 M167 R171A164-D169 CarbonylContact C-O 3.36Å; A164-D169 HydrophobicContact CB-CB 4.3Å; A164-D169 PolarHBondContact O-N 3.11Å; M167-D169 PolarHBondContact O-N 3.21Å; D169-R171 WeakPolarHBondContact OD1-CB 3.27Å; D169-R171 PolarHBondContact OD1-N 2.94Å; D169-R171 IonicContact OD1-NE 3.22Å; D169-R171 PolarHBondContact OD1-NE 2.96Å
170L88.5Confident88.4Confident4 Ų467 Ų672%0.02132%0.316CS..  trans-86.5-11.1-177.6-68.9162.3000113.2L165 A173 L174 L195 L198 Y199 W260L165-L170 HydrophobicContact CD2-CD2 3.75Å; L170-A173 PolarHBondContact O-N 2.95Å; L170-L174 HydrophobicContact CB-CD1 4.17Å; L170-L174 WeakPolarHBondContact O-CB 3.07Å; L170-L174 WeakPolarHBondContact O-CG 3.5Å; L170-L174 PolarHBondContact O-N 3.02Å; L170-L195 HydrophobicContact CD2-CD2 4.06Å; L170-L198 HydrophobicContact CD1-CB 3.9Å; L170-L198 HydrophobicContact CD2-CB 4.12Å; L170-L198 HydrophobicContact CD2-CD1 4.06Å; L170-Y199 HydrophobicContact CB-CD2 4.22Å; L170-Y199 VanDerWaalsContact CD1-CA 3.46Å; L170-Y199 HydrophobicContact CD1-CD2 4.14Å; L170-W260 HydrophobicContact CD1-CH2 3.79Å; L170-W260 HydrophobicContact CD1-CZ3 4.36Å; L170-W260 HydrophobicContact CD2-CE3 4.47Å; L170-W260 HydrophobicContact CD2-CH2 3.86Å; L170-W260 HydrophobicContact CD2-CZ3 3.55Å; L170-W260 HydrophobicContact CG-CH2 3.67Å; L170-W260 HydrophobicContact CG-CZ3 3.8Å
171R88.1Confident88.2Confident161 Ų16162.6 Ų62.661%0.60830%0.3SS*.Hα-helixtrans-59.2-50.6-173.6-74.7178.5-93.7-163.1-12112.9D169 A173 L174 E175D169-R171 WeakPolarHBondContact OD1-CB 3.27Å; D169-R171 PolarHBondContact OD1-N 2.94Å; D169-R171 IonicContact OD1-NE 3.22Å; D169-R171 PolarHBondContact OD1-NE 2.96Å; R171-A173 VanDerWaalsContact C-N 3.31Å; R171-A173 PolarHBondContact O-N 3.49Å; R171-L174 PolarHBondContact O-N 3.01Å; R171-E175 WeakPolarHBondContact O-CG 3.47Å; R171-E175 PolarHBondContact O-N 3.39Å
172P90.4Very high88Confident26 Ų2670 Ų7017%0.16933%0.334CS..Hα-helixtrans-63.1-37.9-178.9-23.837.2000112.6I161 A164 W176I161-P172 HydrophobicContact CG1-CB 3.94Å; A164-P172 HydrophobicContact CB-CB 4.32Å; A164-P172 HydrophobicContact CB-CG 3.71Å; P172-W176 WeakPolarHBondContact O-CB 3.49Å; P172-W176 PolarHBondContact O-N 3.04Å
173A91Very high87.9Confident0 Ų074.7 Ų74.70%035%0.351CS..Hα-helixtrans-68.4-39.4178.700000112.4I161 L165 L170 R171 A177 L195I161-A173 HydrophobicContact CG2-CB 3.66Å; L165-A173 HydrophobicContact CD1-CB 4.13Å; L165-A173 HydrophobicContact CD2-CB 3.72Å; L165-A173 HydrophobicContact CG-CB 4.04Å; L170-A173 PolarHBondContact O-N 2.95Å; R171-A173 VanDerWaalsContact C-N 3.31Å; R171-A173 PolarHBondContact O-N 3.49Å; A173-A177 WeakPolarHBondContact O-CB 3.49Å; A173-A177 PolarHBondContact O-N 3.26Å; A173-L195 HydrophobicContact CB-CD1 4.1Å; A173-L195 HydrophobicContact CB-CD2 3.77Å
174L89.4Confident87.8Confident17 Ų1770.1 Ų70.19%0.08933%0.329CS..Hα-helixtrans-66.7-45.8176.2-78.7167.7000111.9L170 R171 W176 A177 V178 L195 Y199 Y217L170-L174 HydrophobicContact CB-CD1 4.17Å; L170-L174 WeakPolarHBondContact O-CB 3.07Å; L170-L174 WeakPolarHBondContact O-CG 3.5Å; L170-L174 PolarHBondContact O-N 3.02Å; R171-L174 PolarHBondContact O-N 3.01Å; L174-W176 VanDerWaalsContact C-N 3.3Å; L174-W176 PolarHBondContact O-N 3.02Å; L174-A177 PolarHBondContact O-N 3.49Å; L174-V178 WeakPolarHBondContact O-CG2 3.2Å; L174-V178 PolarHBondContact O-N 3.2Å; L174-L195 HydrophobicContact CD2-CB 3.58Å; L174-L195 HydrophobicContact CG-CB 4.19Å; L174-Y199 HydrophobicContact CD1-CD2 4.06Å; L174-Y199 HydrophobicContact CD1-CG 4.18Å; L174-Y217 WeakPolarHBondContact CD1-OH 3.45Å
175E90.8Very high87.5Confident131 Ų13174 Ų7461%0.61235%0.347SS*.Hα-helixtrans-59.9-42.7176.9-73.8174.4-173.200111.5R171 S179R171-E175 WeakPolarHBondContact O-CG 3.47Å; R171-E175 PolarHBondContact O-N 3.39Å; E175-S179 WeakPolarHBondContact O-CB 3.36Å; E175-S179 PolarHBondContact O-N 3.44Å; E175-S179 PolarHBondContact O-OG 2.89Å
176W91Very high87.4Confident23 Ų2381.4 Ų81.49%0.08738%0.382CS..Hα-helixtrans-63.6-44.2175.2-176.392.9000112.2I161 P172 L174 S179 N180 L184 L191 F267 A271 L274I161-W176 HydrophobicContact CD1-CB 3.65Å; I161-W176 HydrophobicContact CD1-CG 3.67Å; P172-W176 WeakPolarHBondContact O-CB 3.49Å; P172-W176 PolarHBondContact O-N 3.04Å; L174-W176 VanDerWaalsContact C-N 3.3Å; L174-W176 PolarHBondContact O-N 3.02Å; W176-S179 PolarHBondContact O-N 3.4Å; W176-N180 PolarHBondContact NE1-ND2 2.98Å; W176-N180 WeakPolarHBondContact O-CB 3.38Å; W176-N180 PolarHBondContact O-N 3.16Å; W176-N180 PolarHBondContact O-ND2 3.01Å; W176-L184 HydrophobicContact CH2-CD2 4.46Å; W176-L184 HydrophobicContact CZ3-CD1 4.19Å; W176-L184 HydrophobicContact CZ3-CD2 4.31Å; W176-L191 HydrophobicContact CE3-CD2 4.46Å; W176-L191 HydrophobicContact CZ3-CD2 3.75Å; W176-F267 AromaticContact CD2-CE2 3.68Å; W176-F267 HydrophobicContact CD2-CE2 3.68Å; W176-F267 HydrophobicContact CD2-CZ 4.27Å; W176-F267 HydrophobicContact CE3-CD2 4.07Å; W176-F267 AromaticContact CE3-CE2 3.45Å; W176-F267 HydrophobicContact CE3-CE2 3.45Å; W176-F267 VanDerWaalsContact CE3-CE2 3.45Å; W176-F267 HydrophobicContact CE3-CZ 4.43Å; W176-F267 HydrophobicContact CG-CE2 4.22Å; W176-F267 HydrophobicContact CH2-CE2 4.29Å; W176-F267 HydrophobicContact CZ3-CD2 4.09Å; W176-F267 AromaticContact CZ3-CE2 3.79Å; W176-F267 HydrophobicContact CZ3-CE2 3.79Å; W176-A271 HydrophobicContact CH2-CB 3.7Å; W176-A271 HydrophobicContact CZ2-CB 3.64Å; W176-L274 HydrophobicContact CH2-CD1 3.61Å; W176-L274 HydrophobicContact CZ2-CD1 3.9Å
177A88.8Confident87.2Confident0 Ų076.8 Ų76.80%037%0.37CS..Hα-helixtrans-64.6-41.1179.700000112.1A173 L174 N180 R181 L184 E192 L195A173-A177 WeakPolarHBondContact O-CB 3.49Å; A173-A177 PolarHBondContact O-N 3.26Å; L174-A177 PolarHBondContact O-N 3.49Å; A177-N180 CarbonylContact O-C 3.5Å; A177-N180 PolarHBondContact O-N 2.69Å; A177-R181 WeakPolarHBondContact O-CA 3.24Å; A177-R181 PolarHBondContact O-N 3.17Å; A177-L184 HydrophobicContact CB-CD1 4.24Å; A177-E192 HydrophobicContact CB-CB 4.36Å; A177-E192 HydrophobicContact CB-CG 4.38Å; A177-L195 HydrophobicContact CB-CD1 3.78Å
178V87.6Confident86.9Confident70 Ų7076.5 Ų76.542%0.42437%0.372SS..Hα-helixtrans-65.7-43.2176.5172.20000111L174 N180 R181L174-V178 WeakPolarHBondContact O-CG2 3.2Å; L174-V178 PolarHBondContact O-N 3.2Å; V178-N180 VanDerWaalsContact C-N 3.26Å; V178-N180 PolarHBondContact O-N 3.3Å; V178-R181 WeakPolarHBondContact O-CB 3.27Å; V178-R181 PolarHBondContact O-N 3.07Å
179S88.9Confident86.8Confident100 Ų10071.3 Ų71.370%0.69935%0.35SS*.Hα-helixtrans-64.4-31.9178.8-57.90000112.3E175 W176E175-S179 WeakPolarHBondContact O-CB 3.36Å; E175-S179 PolarHBondContact O-N 3.44Å; E175-S179 PolarHBondContact O-OG 2.89Å; W176-S179 PolarHBondContact O-N 3.4Å
180N86.8Confident86.8Confident30 Ų3070.6 Ų70.616%0.1635%0.349CS..THydrogen-bonded Turntrans-101.212.4180-68.5-79.4000113.9W176 A177 V178 Q182 R183 L184 L274W176-N180 PolarHBondContact NE1-ND2 2.98Å; W176-N180 WeakPolarHBondContact O-CB 3.38Å; W176-N180 PolarHBondContact O-N 3.16Å; W176-N180 PolarHBondContact O-ND2 3.01Å; A177-N180 CarbonylContact O-C 3.5Å; A177-N180 PolarHBondContact O-N 2.69Å; V178-N180 VanDerWaalsContact C-N 3.26Å; V178-N180 PolarHBondContact O-N 3.3Å; N180-Q182 PolarHBondContact O-N 3.17Å; N180-R183 PolarHBondContact O-N 2.94Å; N180-L184 HydrophobicContact CB-CD1 4.38Å; N180-L184 HydrophobicContact CB-CG 4.39Å; N180-L184 PolarHBondContact O-N 3.32Å; N180-L274 HydrophobicContact CB-CD1 3.97Å
181R85.3Confident86.7Confident91 Ų9170.4 Ų70.434%0.34335%0.348SS..Hα-helixtrans-52.4-47-170.9179.3-178.8-74.4166.2-3113.7A177 V178 R183 L184 L185 E192A177-R181 WeakPolarHBondContact O-CA 3.24Å; A177-R181 PolarHBondContact O-N 3.17Å; V178-R181 WeakPolarHBondContact O-CB 3.27Å; V178-R181 PolarHBondContact O-N 3.07Å; R181-R183 VanDerWaalsContact C-N 3.33Å; R181-R183 PolarHBondContact O-N 3.43Å; R181-L184 PolarHBondContact O-N 3.01Å; R181-L185 HydrophobicContact CG-CD1 4.08Å; R181-L185 HydrophobicContact CG-CG 4.46Å; R181-L185 VanDerWaalsContact O-CG 3.3Å; R181-L185 WeakPolarHBondContact O-CG 3.45Å; R181-L185 PolarHBondContact O-N 3.39Å; R181-E192 WeakPolarHBondContact CG-OE2 3.2Å; R181-E192 IonicContact CZ-OE1 2.81Å; R181-E192 IonicContact CZ-OE2 3.79Å; R181-E192 VanDerWaalsContact NE-CD 3.3Å; R181-E192 IonicContact NE-OE1 3.94Å; R181-E192 PolarHBondContact NE-OE1 3.25Å; R181-E192 IonicContact NE-OE2 3.93Å; R181-E192 PolarHBondContact NE-OE2 3.2Å; R181-E192 IonicContact NH2-OE1 3.87Å; R181-E192 PolarHBondContact NH2-OE1 3.08Å
182Q85.1Confident86.7Confident162 Ų16263.1 Ų63.176%0.75732%0.321SS*.Hα-helixtrans-60.1-44-179.2-71.9-179.1-10.700111.9N180 L185 E186N180-Q182 PolarHBondContact O-N 3.17Å; Q182-L185 WeakPolarHBondContact O-CB 3.35Å; Q182-L185 PolarHBondContact O-N 3.19Å; Q182-E186 PolarHBondContact O-N 3.41Å
183R85.9Confident86.6Confident116 Ų11662 Ų6244%0.43831%0.314SS..Hα-helixtrans-71.6-34.6-179.5-51.4176.368-167-0.6111.7N180 R181 L185 E186 L187 L274N180-R183 PolarHBondContact O-N 2.94Å; R181-R183 VanDerWaalsContact C-N 3.33Å; R181-R183 PolarHBondContact O-N 3.43Å; R183-L185 VanDerWaalsContact C-N 3.34Å; R183-E186 PolarHBondContact O-N 3.33Å; R183-L187 WeakPolarHBondContact O-CG 3.32Å; R183-L187 PolarHBondContact O-N 2.88Å; R183-L274 HydrophobicContact CB-CD2 3.34Å; R183-L274 HydrophobicContact CG-CD2 4.43Å; R183-L274 PolarHBondContact NH2-O 2.99Å
184L84.7Confident86.5Confident4 Ų464.3 Ų64.32%0.02132%0.323CS..Hα-helixtrans-66.6-34.9173.6-71.6173000112.3W176 A177 N180 R181 L187 N188 S189 L191 D270 L274W176-L184 HydrophobicContact CH2-CD2 4.46Å; W176-L184 HydrophobicContact CZ3-CD1 4.19Å; W176-L184 HydrophobicContact CZ3-CD2 4.31Å; A177-L184 HydrophobicContact CB-CD1 4.24Å; N180-L184 HydrophobicContact CB-CD1 4.38Å; N180-L184 HydrophobicContact CB-CG 4.39Å; N180-L184 PolarHBondContact O-N 3.32Å; R181-L184 PolarHBondContact O-N 3.01Å; L184-L187 CarbonylContact O-C 3.53Å; L184-L187 PolarHBondContact O-N 3.45Å; L184-N188 PolarHBondContact O-N 2.65Å; L184-S189 PolarHBondContact O-N 3.27Å; L184-L191 HydrophobicContact CD1-CD2 4.45Å; L184-L191 HydrophobicContact CD2-CD2 4.4Å; L184-D270 HydrophobicContact CD2-CB 4.01Å; L184-L274 HydrophobicContact CD2-CD1 3.88Å; L184-L274 HydrophobicContact CG-CD1 4.19Å
185L83.5Confident86.5Confident98 Ų9863.5 Ų63.551%0.51332%0.319SS..Hα-helixtrans-66.4-39.9174.3-72.5168.9000111.8R181 Q182 R183 L187 N188R181-L185 HydrophobicContact CG-CD1 4.08Å; R181-L185 HydrophobicContact CG-CG 4.46Å; R181-L185 VanDerWaalsContact O-CG 3.3Å; R181-L185 WeakPolarHBondContact O-CG 3.45Å; R181-L185 PolarHBondContact O-N 3.39Å; Q182-L185 WeakPolarHBondContact O-CB 3.35Å; Q182-L185 PolarHBondContact O-N 3.19Å; R183-L185 VanDerWaalsContact C-N 3.34Å; L185-L187 PolarHBondContact O-N 2.83Å; L185-N188 PolarHBondContact O-N 3.12Å
186E85.2Confident86.5Confident157 Ų15757.5 Ų57.573%0.73429%0.291SS*.Hα-helixtrans-61.2-35.4173.1-69.7172.6178.900112.1Q182 R183 N188Q182-E186 PolarHBondContact O-N 3.41Å; R183-E186 PolarHBondContact O-N 3.33Å; E186-N188 PolarHBondContact O-N 2.9Å
187L80.6Confident86.4Confident80 Ų8059.1 Ų59.142%0.41930%0.297SS..THydrogen-bonded Turntrans-78.7-0.3173.9-67.6178.5000114R183 L184 L185 S189 A273 L274R183-L187 WeakPolarHBondContact O-CG 3.32Å; R183-L187 PolarHBondContact O-N 2.88Å; L184-L187 CarbonylContact O-C 3.53Å; L184-L187 PolarHBondContact O-N 3.45Å; L185-L187 PolarHBondContact O-N 2.83Å; L187-S189 PolarHBondContact O-N 3.37Å; L187-A273 HydrophobicContact CD1-CB 3.98Å; L187-L274 HydrophobicContact CD1-CD2 3.47Å; L187-L274 VanDerWaalsContact CD1-CD2 3.47Å; L187-L274 HydrophobicContact CD1-CG 3.74Å; L187-L274 HydrophobicContact CG-CD2 4.32Å
188N80.9Confident86.4Confident152 Ų15259.3 Ų59.381%0.81330%0.298SS*.THydrogen-bonded Turntrans50.136.1-172.1-67.3-64.3000113.2L184 L185 E186L184-N188 PolarHBondContact O-N 2.65Å; L185-N188 PolarHBondContact O-N 3.12Å; E186-N188 PolarHBondContact O-N 2.9Å
189S83.8Confident86.4Confident20 Ų2059.2 Ų59.214%0.1429%0.291CS..  trans-78.7135.4-179.5171.60000111.9L184 L187 L191 D270L184-S189 PolarHBondContact O-N 3.27Å; L187-S189 PolarHBondContact O-N 3.37Å; S189-L191 VanDerWaalsContact C-N 3.33Å; S189-L191 WeakPolarHBondContact OG-CB 3.39Å; S189-L191 PolarHBondContact OG-N 3.39Å; S189-D270 VanDerWaalsContact CB-OD2 3.3Å; S189-D270 WeakPolarHBondContact CB-OD2 3.31Å; S189-D270 PolarHBondContact OG-OD2 2.89Å
190S85.6Confident86.4Confident40 Ų4054.5 Ų54.528%0.2826%0.258SS..  trans-91.512.3171.275.50000113.2E192 F193 K194S190-E192 PolarHBondContact O-N 3.43Å; S190-F193 PolarHBondContact O-N 3.41Å; S190-K194 WeakPolarHBondContact O-CG 3.42Å; S190-K194 PolarHBondContact O-N 3.46Å; S190-K194 VanDerWaalsContact O-N 3.13Å
191L88Confident86.4Confident0 Ų053.5 Ų53.50%025%0.252CS..Hα-helixtrans-59.5-46.4-173173.664.1000112W176 L184 S189 F193 K194 L195 I266 F267 D270W176-L191 HydrophobicContact CE3-CD2 4.46Å; W176-L191 HydrophobicContact CZ3-CD2 3.75Å; L184-L191 HydrophobicContact CD1-CD2 4.45Å; L184-L191 HydrophobicContact CD2-CD2 4.4Å; S189-L191 VanDerWaalsContact C-N 3.33Å; S189-L191 WeakPolarHBondContact OG-CB 3.39Å; S189-L191 PolarHBondContact OG-N 3.39Å; L191-F193 VanDerWaalsContact C-N 3.35Å; L191-F193 PolarHBondContact O-N 3.47Å; L191-K194 PolarHBondContact O-N 2.94Å; L191-K194 VanDerWaalsContact O-N 3.15Å; L191-L195 HydrophobicContact CD1-CD1 3.99Å; L191-L195 HydrophobicContact CD1-CG 4.08Å; L191-L195 HydrophobicContact CG-CD1 3.93Å; L191-L195 HydrophobicContact CG-CG 4.43Å; L191-L195 WeakPolarHBondContact O-CG 3.21Å; L191-L195 PolarHBondContact O-N 3.44Å; L191-I266 HydrophobicContact CB-CG2 4.09Å; L191-I266 HydrophobicContact CD1-CB 4.48Å; L191-I266 HydrophobicContact CD1-CG2 3.96Å; L191-F267 HydrophobicContact CD1-CB 4.04Å; L191-F267 HydrophobicContact CD2-CB 4.5Å; L191-F267 HydrophobicContact CD2-CD2 4.05Å; L191-D270 HydrophobicContact CD2-CB 4.29Å
192E88.1Confident86.4Confident8 Ų851.6 Ų51.64%0.03725%0.253CS..Hα-helixtrans-60.4-44.2-177.7-173.3174.6-169.900112A177 R181 S190 K194 L195 H196 F224A177-E192 HydrophobicContact CB-CB 4.36Å; A177-E192 HydrophobicContact CB-CG 4.38Å; R181-E192 WeakPolarHBondContact CG-OE2 3.2Å; R181-E192 IonicContact CZ-OE1 2.81Å; R181-E192 IonicContact CZ-OE2 3.79Å; R181-E192 VanDerWaalsContact NE-CD 3.3Å; R181-E192 IonicContact NE-OE1 3.94Å; R181-E192 PolarHBondContact NE-OE1 3.25Å; R181-E192 IonicContact NE-OE2 3.93Å; R181-E192 PolarHBondContact NE-OE2 3.2Å; R181-E192 IonicContact NH2-OE1 3.87Å; R181-E192 PolarHBondContact NH2-OE1 3.08Å; S190-E192 PolarHBondContact O-N 3.43Å; E192-K194 PolarHBondContact O-N 2.89Å; E192-L195 PolarHBondContact O-N 3.31Å; E192-H196 PolarHBondContact O-CD2 2.74Å; E192-H196 VanDerWaalsContact O-CD2 3.23Å; E192-H196 PolarHBondContact O-N 3.43Å; E192-H196 IonicContact OE1-NE2 3Å; E192-F224 HydrophobicContact CB-CE1 4.47Å; E192-F224 HydrophobicContact CB-CZ 4.09Å; E192-F224 HydrophobicContact CG-CE2 4.37Å; E192-F224 HydrophobicContact CG-CZ 3.7Å
193F88.2Confident86.4Confident4 Ų444.9 Ų44.92%0.01822%0.222CC..Hα-helixtrans-61.9-44.5174.9174.8-106.4000111.9S190 L191 L195 H196 R197 F221 F224 H228 D231 I232S190-F193 PolarHBondContact O-N 3.41Å; L191-F193 VanDerWaalsContact C-N 3.35Å; L191-F193 PolarHBondContact O-N 3.47Å; F193-L195 VanDerWaalsContact C-N 3.33Å; F193-L195 PolarHBondContact O-N 2.91Å; F193-H196 PolarHBondContact O-N 3.43Å; F193-R197 WeakPolarHBondContact O-CB 3.42Å; F193-R197 PolarHBondContact O-N 2.94Å; F193-F221 HydrophobicContact CD2-CD1 4.08Å; F193-F221 HydrophobicContact CD2-CE1 4.36Å; F193-F221 AromaticContact CE2-CD1 3.82Å; F193-F221 HydrophobicContact CE2-CD1 3.82Å; F193-F221 HydrophobicContact CE2-CE1 4.07Å; F193-F224 HydrophobicContact CB-CD1 4Å; F193-F224 HydrophobicContact CB-CE1 4.36Å; F193-F224 HydrophobicContact CB-CG 4.15Å; F193-F224 HydrophobicContact CD2-CB 3.71Å; F193-F224 HydrophobicContact CD2-CD2 4.3Å; F193-F224 AromaticContact CD2-CG 3.95Å; F193-F224 HydrophobicContact CD2-CG 3.95Å; F193-F224 HydrophobicContact CE2-CB 4.36Å; F193-F224 HydrophobicContact CG-CB 4.45Å; F193-F224 HydrophobicContact CG-CG 4.47Å; F193-H228 HydrophobicContact CD1-CB 4.13Å; F193-H228 AromaticContact CD1-CD2 3.66Å; F193-H228 AromaticContact CD1-CE1 3.85Å; F193-H228 AromaticContact CD1-CG 3.57Å; F193-H228 AromaticContact CD1-ND1 3.68Å; F193-H228 AromaticContact CD1-NE2 3.84Å; F193-H228 HydrophobicContact CD2-CB 4.11Å; F193-H228 HydrophobicContact CE1-CB 3.7Å; F193-H228 AromaticContact CE1-CG 3.54Å; F193-H228 AromaticContact CE1-ND1 3.61Å; F193-H228 HydrophobicContact CE2-CB 3.68Å; F193-H228 HydrophobicContact CG-CB 4.33Å; F193-H228 AromaticContact CG-CD2 3.64Å; F193-H228 AromaticContact CG-CG 3.89Å; F193-H228 HydrophobicContact CZ-CB 3.47Å; F193-H228 VanDerWaalsContact CZ-CB 3.47Å; F193-H228 AromaticContact CZ-CG 3.86Å; F193-D231 HydrophobicContact CE1-CB 4.02Å; F193-D231 HydrophobicContact CZ-CB 3.69Å; F193-I232 HydrophobicContact CE2-CD1 4.33Å; F193-I232 HydrophobicContact CE2-CG1 3.97Å; F193-I232 HydrophobicContact CZ-CG1 4.35Å
194K88.5Confident86.2Confident47 Ų4739.6 Ų39.620%0.20420%0.202CC..Hα-helixtrans-63.1-37.9179.2-75.1-172.2177.9-169.10112.4S190 L191 E192 R197 L198 E262 I263 I266S190-K194 WeakPolarHBondContact O-CG 3.42Å; S190-K194 PolarHBondContact O-N 3.46Å; S190-K194 VanDerWaalsContact O-N 3.13Å; L191-K194 PolarHBondContact O-N 2.94Å; L191-K194 VanDerWaalsContact O-N 3.15Å; E192-K194 PolarHBondContact O-N 2.89Å; K194-R197 PolarHBondContact O-N 3.16Å; K194-L198 PolarHBondContact O-N 3.26Å; K194-E262 IonicContact NZ-OE1 2.6Å; K194-E262 PolarHBondContact NZ-OE1 3.38Å; K194-I263 HydrophobicContact CB-CD1 3.98Å; K194-I263 HydrophobicContact CB-CG1 4.08Å; K194-I266 HydrophobicContact CD-CD1 3.61Å
195L90.3Very high86Confident0 Ų043.1 Ų43.10%023%0.227CC..Hα-helixtrans-66.6-46.9174.9-71.6169.2000112L165 L170 A173 L174 A177 L191 E192 F193 R197 L198 Y199 I263L165-L195 HydrophobicContact CD2-CD2 4.28Å; L170-L195 HydrophobicContact CD2-CD2 4.06Å; A173-L195 HydrophobicContact CB-CD1 4.1Å; A173-L195 HydrophobicContact CB-CD2 3.77Å; L174-L195 HydrophobicContact CD2-CB 3.58Å; L174-L195 HydrophobicContact CG-CB 4.19Å; A177-L195 HydrophobicContact CB-CD1 3.78Å; L191-L195 HydrophobicContact CD1-CD1 3.99Å; L191-L195 HydrophobicContact CD1-CG 4.08Å; L191-L195 HydrophobicContact CG-CD1 3.93Å; L191-L195 HydrophobicContact CG-CG 4.43Å; L191-L195 WeakPolarHBondContact O-CG 3.21Å; L191-L195 PolarHBondContact O-N 3.44Å; E192-L195 PolarHBondContact O-N 3.31Å; F193-L195 VanDerWaalsContact C-N 3.33Å; F193-L195 PolarHBondContact O-N 2.91Å; L195-R197 VanDerWaalsContact C-N 3.28Å; L195-R197 PolarHBondContact O-N 3.27Å; L195-L198 PolarHBondContact O-N 3.31Å; L195-Y199 PolarHBondContact O-N 2.95Å; L195-I263 HydrophobicContact CD2-CG2 3.65Å; L195-I263 HydrophobicContact CG-CG2 4.47Å
196H89.8Confident85.7Confident6 Ų640.4 Ų40.43%0.02822%0.223CC..Hα-helixtrans-61.2-38.1174.9-77.4-56.2000112.1E192 F193 Y199 F200 Y217 F221E192-H196 PolarHBondContact O-CD2 2.74Å; E192-H196 VanDerWaalsContact O-CD2 3.23Å; E192-H196 PolarHBondContact O-N 3.43Å; E192-H196 IonicContact OE1-NE2 3Å; F193-H196 PolarHBondContact O-N 3.43Å; H196-Y199 PolarHBondContact O-N 2.91Å; H196-F200 WeakPolarHBondContact O-CB 3.47Å; H196-F200 PolarHBondContact O-N 2.94Å; H196-Y217 HydrophobicContact CB-CE1 4.36Å; H196-Y217 AromaticContact ND1-CE1 3.68Å; H196-Y217 AromaticContact ND1-CZ 3.51Å; H196-Y217 PolarHBondContact ND1-OH 2.85Å; H196-F221 HydrophobicContact CB-CD1 4.27Å; H196-F221 HydrophobicContact CB-CE1 3.63Å; H196-F221 HydrophobicContact CB-CZ 4.29Å
197R89.2Confident85.4Confident56 Ų5634 Ų3421%0.21120%0.199CC..Hα-helixtrans-61.2-49.6174.1168.5177.5157.4-163.1-9111.5F193 K194 L195 Y199 F200 I201 L235 Q259F193-R197 WeakPolarHBondContact O-CB 3.42Å; F193-R197 PolarHBondContact O-N 2.94Å; K194-R197 PolarHBondContact O-N 3.16Å; L195-R197 VanDerWaalsContact C-N 3.28Å; L195-R197 PolarHBondContact O-N 3.27Å; R197-Y199 VanDerWaalsContact C-N 3.3Å; R197-Y199 PolarHBondContact O-N 2.71Å; R197-F200 PolarHBondContact O-N 3.45Å; R197-I201 HydrophobicContact CG-CD1 3.79Å; R197-I201 VanDerWaalsContact O-CG1 3.29Å; R197-I201 WeakPolarHBondContact O-CG1 3.21Å; R197-I201 PolarHBondContact O-N 3.45Å; R197-L235 HydrophobicContact CB-CD1 4.31Å; R197-L235 HydrophobicContact CG-CD1 4.06Å; R197-L235 HydrophobicContact CG-CD2 4.22Å; R197-Q259 VanDerWaalsContact NH2-CD 3.3Å
198L88.3Confident85.2Confident5 Ų534.6 Ų34.63%0.02620%0.202CC..Hα-helixtrans-61-40.7177.1-91-165.6000112L170 K194 L195 F200 I201 S202 Q259 W260 I263L170-L198 HydrophobicContact CD1-CB 3.9Å; L170-L198 HydrophobicContact CD2-CB 4.12Å; L170-L198 HydrophobicContact CD2-CD1 4.06Å; K194-L198 PolarHBondContact O-N 3.26Å; L195-L198 PolarHBondContact O-N 3.31Å; L198-F200 VanDerWaalsContact C-N 3.34Å; L198-F200 PolarHBondContact O-N 3.29Å; L198-I201 PolarHBondContact O-N 3.42Å; L198-S202 PolarHBondContact O-N 2.91Å; L198-Q259 HydrophobicContact CD2-CB 3.94Å; L198-W260 HydrophobicContact CD1-CD2 3.88Å; L198-W260 HydrophobicContact CD1-CE3 3.88Å; L198-W260 HydrophobicContact CD1-CG 4.43Å; L198-W260 HydrophobicContact CD1-CH2 4.38Å; L198-W260 HydrophobicContact CD1-CZ2 4.37Å; L198-W260 HydrophobicContact CD1-CZ3 4.13Å; L198-I263 HydrophobicContact CB-CD1 4.3Å; L198-I263 HydrophobicContact CD1-CB 4.38Å; L198-I263 HydrophobicContact CD1-CD1 3.16Å; L198-I263 HydrophobicContact CD1-CG1 4.32Å; L198-I263 HydrophobicContact CD1-CG2 4.5Å; L198-I263 HydrophobicContact CD2-CD1 4.36Å; L198-I263 HydrophobicContact CG-CD1 3.32Å
199Y88.7Confident85Confident68 Ų6830.5 Ų30.527%0.26720%0.196SC..Hα-helixtrans-63.2-44.3178.4-172.6-93.3000111L170 L174 L195 H196 R197 I201 S202 L203 Y217L170-Y199 HydrophobicContact CB-CD2 4.22Å; L170-Y199 VanDerWaalsContact CD1-CA 3.46Å; L170-Y199 HydrophobicContact CD1-CD2 4.14Å; L174-Y199 HydrophobicContact CD1-CD2 4.06Å; L174-Y199 HydrophobicContact CD1-CG 4.18Å; L195-Y199 PolarHBondContact O-N 2.95Å; H196-Y199 PolarHBondContact O-N 2.91Å; R197-Y199 VanDerWaalsContact C-N 3.3Å; R197-Y199 PolarHBondContact O-N 2.71Å; Y199-I201 VanDerWaalsContact C-N 3.33Å; Y199-I201 PolarHBondContact O-N 2.94Å; Y199-S202 WeakPolarHBondContact O-CB 3.35Å; Y199-S202 PolarHBondContact O-N 3.02Å; Y199-S202 VanDerWaalsContact O-N 3.14Å; Y199-S202 PolarHBondContact O-OG 3.26Å; Y199-L203 HydrophobicContact CD1-CD1 3.98Å; Y199-L203 HydrophobicContact CD1-CG 4.24Å; Y199-L203 HydrophobicContact CE1-CD1 3.68Å; Y199-L203 HydrophobicContact CE1-CD2 4.29Å; Y199-L203 HydrophobicContact CE1-CG 3.99Å; Y199-L203 PolarHBondContact O-N 2.99Å; Y199-Y217 AromaticContact CD1-CD1 3.74Å; Y199-Y217 HydrophobicContact CD1-CD1 3.74Å; Y199-Y217 AromaticContact CD1-CD2 3.7Å; Y199-Y217 HydrophobicContact CD1-CD2 3.7Å; Y199-Y217 AromaticContact CD1-CE1 3.37Å; Y199-Y217 HydrophobicContact CD1-CE1 3.37Å; Y199-Y217 AromaticContact CD1-CE2 3.31Å; Y199-Y217 HydrophobicContact CD1-CE2 3.31Å; Y199-Y217 AromaticContact CD1-CG 3.88Å; Y199-Y217 HydrophobicContact CD1-CG 3.88Å; Y199-Y217 AromaticContact CD1-CZ 3.1Å; Y199-Y217 WeakPolarHBondContact CD1-OH 3.37Å; Y199-Y217 HydrophobicContact CE1-CD1 4.29Å; Y199-Y217 AromaticContact CE1-CD2 3.43Å; Y199-Y217 HydrophobicContact CE1-CD2 3.43Å; Y199-Y217 VanDerWaalsContact CE1-CD2 3.43Å; Y199-Y217 HydrophobicContact CE1-CE1 4.16Å; Y199-Y217 AromaticContact CE1-CE2 3.25Å; Y199-Y217 HydrophobicContact CE1-CE2 3.25Å; Y199-Y217 AromaticContact CE1-CG 3.94Å; Y199-Y217 HydrophobicContact CE1-CG 3.94Å; Y199-Y217 AromaticContact CE1-CZ 3.63Å; Y199-Y217 HydrophobicContact CG-CE1 4.11Å; Y199-Y217 HydrophobicContact CG-CE2 4.25Å; Y199-Y217 AromaticContact CG-CZ 3.77Å
200F87.9Confident85Confident0 Ų032.1 Ų32.10%020%0.203CC..Hα-helixtrans-59.6-44.3174-172.7-92.2000111.7H196 R197 L198 S202 L203 L204 A214 A218 F221 L235 M236 L239H196-F200 WeakPolarHBondContact O-CB 3.47Å; H196-F200 PolarHBondContact O-N 2.94Å; R197-F200 PolarHBondContact O-N 3.45Å; L198-F200 VanDerWaalsContact C-N 3.34Å; L198-F200 PolarHBondContact O-N 3.29Å; F200-S202 VanDerWaalsContact C-N 3.29Å; F200-S202 PolarHBondContact O-N 2.95Å; F200-L203 WeakPolarHBondContact O-CB 3.31Å; F200-L203 PolarHBondContact O-N 3.01Å; F200-L203 VanDerWaalsContact O-N 3.14Å; F200-L204 HydrophobicContact CD1-CD1 3.71Å; F200-L204 HydrophobicContact CD1-CD2 4.4Å; F200-L204 HydrophobicContact CD1-CG 3.86Å; F200-L204 HydrophobicContact CE1-CD1 3.58Å; F200-L204 HydrophobicContact CE1-CD2 3.81Å; F200-L204 HydrophobicContact CE1-CG 3.75Å; F200-L204 HydrophobicContact CZ-CD2 4.17Å; F200-L204 HydrophobicContact CZ-CG 4.5Å; F200-L204 VanDerWaalsContact O-CG 3.31Å; F200-L204 WeakPolarHBondContact O-CG 3.24Å; F200-L204 PolarHBondContact O-N 3.2Å; F200-A214 HydrophobicContact CD2-CB 4.32Å; F200-A214 HydrophobicContact CE2-CB 3.87Å; F200-A214 WeakPolarHBondContact CE2-O 3.39Å; F200-A214 HydrophobicContact CZ-CB 4.29Å; F200-A218 HydrophobicContact CE2-CB 4.12Å; F200-F221 HydrophobicContact CB-CE2 4.04Å; F200-F221 HydrophobicContact CB-CZ 3.79Å; F200-F221 AromaticContact CD2-CE2 3.8Å; F200-F221 HydrophobicContact CD2-CE2 3.8Å; F200-F221 HydrophobicContact CD2-CZ 4.42Å; F200-F221 HydrophobicContact CE2-CE2 4.39Å; F200-F221 AromaticContact CG-CE2 3.94Å; F200-F221 HydrophobicContact CG-CE2 3.94Å; F200-F221 HydrophobicContact CG-CZ 4.17Å; F200-L235 HydrophobicContact CD1-CB 4.09Å; F200-L235 HydrophobicContact CD1-CD2 4.03Å; F200-L235 HydrophobicContact CD1-CG 4.44Å; F200-L235 HydrophobicContact CE1-CB 3.84Å; F200-L235 HydrophobicContact CE1-CD2 4.47Å; F200-M236 HydrophobicContact CZ-SD 4.45Å; F200-L239 HydrophobicContact CZ-CD1 4.38Å; F200-L239 HydrophobicContact CZ-CD2 4.15Å; F200-L239 HydrophobicContact CZ-CG 4.35Å
201I86.3Confident84.9Confident10 Ų1033.7 Ų33.75%0.05121%0.206CC..Hα-helixtrans-60.1-40175.3-67.4163.4000111.2R197 L198 Y199 L203 L204 S205 L235 L254 L255R197-I201 HydrophobicContact CG-CD1 3.79Å; R197-I201 VanDerWaalsContact O-CG1 3.29Å; R197-I201 WeakPolarHBondContact O-CG1 3.21Å; R197-I201 PolarHBondContact O-N 3.45Å; L198-I201 PolarHBondContact O-N 3.42Å; Y199-I201 VanDerWaalsContact C-N 3.33Å; Y199-I201 PolarHBondContact O-N 2.94Å; I201-L203 VanDerWaalsContact C-N 3.33Å; I201-L203 PolarHBondContact O-N 2.84Å; I201-L204 WeakPolarHBondContact O-CB 3.28Å; I201-L204 PolarHBondContact O-N 2.88Å; I201-S205 PolarHBondContact O-N 3.48Å; I201-S205 PolarHBondContact O-OG 3.36Å; I201-L235 HydrophobicContact CD1-CD2 4.34Å; I201-L235 HydrophobicContact CG1-CD2 4.01Å; I201-L254 HydrophobicContact CD1-CB 4.32Å; I201-L255 HydrophobicContact CG2-CD2 3.87Å
202S85.1Confident84.7Confident51 Ų5140.2 Ų40.236%0.35724%0.238SC..Hα-helixtrans-63-3817678.60000112.5L198 Y199 F200 S205 G206L198-S202 PolarHBondContact O-N 2.91Å; Y199-S202 WeakPolarHBondContact O-CB 3.35Å; Y199-S202 PolarHBondContact O-N 3.02Å; Y199-S202 VanDerWaalsContact O-N 3.14Å; Y199-S202 PolarHBondContact O-OG 3.26Å; F200-S202 VanDerWaalsContact C-N 3.29Å; F200-S202 PolarHBondContact O-N 2.95Å; S202-S205 PolarHBondContact O-N 2.84Å; S202-G206 PolarHBondContact O-N 3.48Å
203L85.2Confident84.7Confident20 Ų2043.8 Ų43.811%0.10526%0.257CS..Hα-helixtrans-65.8-41173.7-67.6177.2000111.5Y199 F200 I201 S205 G206 N210 A214 Y217Y199-L203 HydrophobicContact CD1-CD1 3.98Å; Y199-L203 HydrophobicContact CD1-CG 4.24Å; Y199-L203 HydrophobicContact CE1-CD1 3.68Å; Y199-L203 HydrophobicContact CE1-CD2 4.29Å; Y199-L203 HydrophobicContact CE1-CG 3.99Å; Y199-L203 PolarHBondContact O-N 2.99Å; F200-L203 WeakPolarHBondContact O-CB 3.31Å; F200-L203 PolarHBondContact O-N 3.01Å; F200-L203 VanDerWaalsContact O-N 3.14Å; I201-L203 VanDerWaalsContact C-N 3.33Å; I201-L203 PolarHBondContact O-N 2.84Å; L203-S205 VanDerWaalsContact C-N 3.31Å; L203-S205 PolarHBondContact O-N 3.48Å; L203-G206 PolarHBondContact O-N 2.92Å; L203-N210 WeakPolarHBondContact O-CB 3.16Å; L203-A214 HydrophobicContact CB-CB 4.18Å; L203-A214 HydrophobicContact CD1-CB 4.42Å; L203-Y217 HydrophobicContact CD1-CG 4.19Å
204L83.1Confident84.6Confident5 Ų543.6 Ų43.63%0.02626%0.257CS..Hα-helixtrans-62.4-36.7177.1-69.7-178.5000112.9F200 I201 G206 G207 A214 S238 L239 L242 I246F200-L204 HydrophobicContact CD1-CD1 3.71Å; F200-L204 HydrophobicContact CD1-CD2 4.4Å; F200-L204 HydrophobicContact CD1-CG 3.86Å; F200-L204 HydrophobicContact CE1-CD1 3.58Å; F200-L204 HydrophobicContact CE1-CD2 3.81Å; F200-L204 HydrophobicContact CE1-CG 3.75Å; F200-L204 HydrophobicContact CZ-CD2 4.17Å; F200-L204 HydrophobicContact CZ-CG 4.5Å; F200-L204 VanDerWaalsContact O-CG 3.31Å; F200-L204 WeakPolarHBondContact O-CG 3.24Å; F200-L204 PolarHBondContact O-N 3.2Å; I201-L204 WeakPolarHBondContact O-CB 3.28Å; I201-L204 PolarHBondContact O-N 2.88Å; L204-G206 PolarHBondContact O-N 2.91Å; L204-G207 PolarHBondContact O-N 2.72Å; L204-A214 HydrophobicContact CD2-CB 4.42Å; L204-S238 WeakPolarHBondContact CD1-OG 3.3Å; L204-L239 HydrophobicContact CD2-CD2 3.38Å; L204-L239 HydrophobicContact CD2-CG 4.33Å; L204-L242 HydrophobicContact CB-CD2 4.47Å; L204-L242 HydrophobicContact CD2-CD1 4.31Å; L204-L242 HydrophobicContact CD2-CD2 4.04Å; L204-L242 HydrophobicContact CD2-CG 4.41Å; L204-L242 WeakPolarHBondContact O-CD2 3.31Å; L204-I246 HydrophobicContact CB-CD1 3.46Å; L204-I246 VanDerWaalsContact CB-CD1 3.46Å; L204-I246 HydrophobicContact CD1-CD1 3.91Å; L204-I246 HydrophobicContact CD2-CD1 4.36Å; L204-I246 HydrophobicContact CG-CD1 4.14Å
205S79.8Confident84.5Confident78 Ų7844.6 Ų44.655%0.54526%0.264SS..Hα-helixtrans-63.9-22.3174-61.40000113I201 S202 L203 G207 L255I201-S205 PolarHBondContact O-N 3.48Å; I201-S205 PolarHBondContact O-OG 3.36Å; S202-S205 PolarHBondContact O-N 2.84Å; L203-S205 VanDerWaalsContact C-N 3.31Å; L203-S205 PolarHBondContact O-N 3.48Å; S205-G207 PolarHBondContact O-N 3.33Å; S205-L255 VanDerWaalsContact OG-CD2 3.27Å; S205-L255 WeakPolarHBondContact OG-CD2 3.38Å
206G77.4Confident84.4Confident42 Ų4250.6 Ų50.643%0.43329%0.292SS..THydrogen-bonded Turntrans-71.7-2.2171.100000114.6S202 L203 L204S202-G206 PolarHBondContact O-N 3.48Å; L203-G206 PolarHBondContact O-N 2.92Å; L204-G206 PolarHBondContact O-N 2.91Å
207G78.4Confident84.3Confident22 Ų2251.8 Ų51.823%0.22730%0.296CS..G310 helixtrans73.5-156.4174.300000114L204 S205 G209 N210L204-G207 PolarHBondContact O-N 2.72Å; S205-G207 PolarHBondContact O-N 3.33Å; G207-G209 PolarHBondContact O-N 3.28Å; G207-N210 PolarHBondContact O-N 2.98Å
208I76.9Confident84.3Confident92 Ų9249.9 Ų49.947%0.47229%0.293SS..G310 helixtrans-62.1-31.6-173.1-55.3163.9000111.9N210 Q211 R243I208-N210 PolarHBondContact O-N 3.44Å; I208-Q211 VanDerWaalsContact O-CB 3.28Å; I208-Q211 WeakPolarHBondContact O-CB 3.41Å; I208-Q211 PolarHBondContact O-N 3.37Å; I208-Q211 VanDerWaalsContact O-N 3.13Å; I208-R243 HydrophobicContact CD1-CB 4.39Å; I208-R243 HydrophobicContact CD1-CG 3.83Å; I208-R243 HydrophobicContact CG1-CG 4.2Å
209G77.1Confident84.2Confident67 Ų6758.1 Ų58.169%0.69132%0.323SS*.G310 helixtrans-58.5-32.6-179.600000113.4G207G207-G209 PolarHBondContact O-N 3.28Å
210N83Confident84Confident54 Ų5459.4 Ų59.429%0.28933%0.332SS..G310 helixtrans-999.7-178-67.53000112.9L203 G207 I208 M212 D213 A214L203-N210 WeakPolarHBondContact O-CB 3.16Å; G207-N210 PolarHBondContact O-N 2.98Å; I208-N210 PolarHBondContact O-N 3.44Å; N210-M212 VanDerWaalsContact C-N 3.31Å; N210-M212 PolarHBondContact O-N 2.83Å; N210-D213 PolarHBondContact O-N 2.87Å; N210-A214 WeakPolarHBondContact O-CB 3.37Å; N210-A214 PolarHBondContact O-N 2.91Å
211Q83.7Confident83.9Confident73 Ų7359.7 Ų59.734%0.34133%0.333SS..Hα-helixtrans-59.9-41.6-177.3-176.7179.912.900112.1I208 A214 L215 L242I208-Q211 VanDerWaalsContact O-CB 3.28Å; I208-Q211 WeakPolarHBondContact O-CB 3.41Å; I208-Q211 PolarHBondContact O-N 3.37Å; I208-Q211 VanDerWaalsContact O-N 3.13Å; Q211-A214 PolarHBondContact O-N 3.38Å; Q211-L215 HydrophobicContact CG-CD1 4.33Å; Q211-L215 WeakPolarHBondContact O-CB 3.43Å; Q211-L215 WeakPolarHBondContact O-CG 3.46Å; Q211-L215 PolarHBondContact O-N 3.4Å; Q211-L242 HydrophobicContact CB-CD1 4.08Å; Q211-L242 HydrophobicContact CG-CD1 3.87Å
212M84.6Confident83.7Confident136 Ų13666.4 Ų66.467%0.6736%0.364SS*.Hα-helixtrans-67.2-40.8179.3-70.1-58.4-62.400111.7N210 L215 Q216N210-M212 VanDerWaalsContact C-N 3.31Å; N210-M212 PolarHBondContact O-N 2.83Å; M212-L215 PolarHBondContact O-N 3.26Å; M212-L215 HydrophobicContact SD-CD1 4.49Å; M212-Q216 WeakPolarHBondContact O-CB 3.29Å; M212-Q216 PolarHBondContact O-N 2.94Å
213D86.7Confident83.6Confident83 Ų8367.9 Ų67.944%0.44437%0.373SS..Hα-helixtrans-66.2-41.4177.3-62.4-27.2000111.2N210 Q216 Y217N210-D213 PolarHBondContact O-N 2.87Å; D213-Q216 PolarHBondContact O-N 3.46Å; D213-Y217 VanDerWaalsContact O-CB 3.29Å; D213-Y217 WeakPolarHBondContact O-CB 3.31Å; D213-Y217 PolarHBondContact O-N 2.97Å
214A86.3Confident83.6Confident0 Ų067.9 Ų67.90%037%0.372CS..Hα-helixtrans-60.1-47.3173.700000111.2F200 L203 L204 N210 Q211 Q216 Y217 A218 L239F200-A214 HydrophobicContact CD2-CB 4.32Å; F200-A214 HydrophobicContact CE2-CB 3.87Å; F200-A214 WeakPolarHBondContact CE2-O 3.39Å; F200-A214 HydrophobicContact CZ-CB 4.29Å; L203-A214 HydrophobicContact CB-CB 4.18Å; L203-A214 HydrophobicContact CD1-CB 4.42Å; L204-A214 HydrophobicContact CD2-CB 4.42Å; N210-A214 WeakPolarHBondContact O-CB 3.37Å; N210-A214 PolarHBondContact O-N 2.91Å; Q211-A214 PolarHBondContact O-N 3.38Å; A214-Q216 VanDerWaalsContact C-N 3.33Å; A214-Q216 PolarHBondContact O-N 3.09Å; A214-Y217 PolarHBondContact O-N 3.43Å; A214-A218 PolarHBondContact O-N 3.25Å; A214-L239 HydrophobicContact CB-CD2 4.39Å
215L86Confident83.6Confident69 Ų6969.8 Ų69.836%0.36139%0.388SS..Hα-helixtrans-62.4-38.4177.3-76.5172.6000112.8Q211 M212 A218 M236 L239Q211-L215 HydrophobicContact CG-CD1 4.33Å; Q211-L215 WeakPolarHBondContact O-CB 3.43Å; Q211-L215 WeakPolarHBondContact O-CG 3.46Å; Q211-L215 PolarHBondContact O-N 3.4Å; M212-L215 PolarHBondContact O-N 3.26Å; M212-L215 HydrophobicContact SD-CD1 4.49Å; L215-A218 WeakPolarHBondContact O-CB 3.39Å; L215-A218 PolarHBondContact O-N 2.98Å; L215-M236 HydrophobicContact CD2-CE 4.28Å; L215-L239 HydrophobicContact CD2-CD1 3.61Å; L215-L239 HydrophobicContact CG-CD1 4.32Å
216Q89.3Confident83.7Confident125 Ų12571 Ų7158%0.58440%0.397SS*.Hα-helixtrans-66.4-43.2174.7-174.2170.68.800110.9M212 D213 A214 A218 R219M212-Q216 WeakPolarHBondContact O-CB 3.29Å; M212-Q216 PolarHBondContact O-N 2.94Å; D213-Q216 PolarHBondContact O-N 3.46Å; A214-Q216 VanDerWaalsContact C-N 3.33Å; A214-Q216 PolarHBondContact O-N 3.09Å; Q216-A218 VanDerWaalsContact C-N 3.27Å; Q216-A218 PolarHBondContact O-N 3.15Å; Q216-R219 WeakPolarHBondContact O-CG 3.35Å; Q216-R219 PolarHBondContact O-N 3.05Å
217Y87.8Confident84Confident31 Ų3175.8 Ų75.812%0.12241%0.408CS..Hα-helixtrans-66.8-27.7179.2-162.5-93000112.8L174 H196 Y199 L203 D213 A214 R219 H220L174-Y217 WeakPolarHBondContact CD1-OH 3.45Å; H196-Y217 HydrophobicContact CB-CE1 4.36Å; H196-Y217 AromaticContact ND1-CE1 3.68Å; H196-Y217 AromaticContact ND1-CZ 3.51Å; H196-Y217 PolarHBondContact ND1-OH 2.85Å; Y199-Y217 AromaticContact CD1-CD1 3.74Å; Y199-Y217 HydrophobicContact CD1-CD1 3.74Å; Y199-Y217 AromaticContact CD1-CD2 3.7Å; Y199-Y217 HydrophobicContact CD1-CD2 3.7Å; Y199-Y217 AromaticContact CD1-CE1 3.37Å; Y199-Y217 HydrophobicContact CD1-CE1 3.37Å; Y199-Y217 AromaticContact CD1-CE2 3.31Å; Y199-Y217 HydrophobicContact CD1-CE2 3.31Å; Y199-Y217 AromaticContact CD1-CG 3.88Å; Y199-Y217 HydrophobicContact CD1-CG 3.88Å; Y199-Y217 AromaticContact CD1-CZ 3.1Å; Y199-Y217 WeakPolarHBondContact CD1-OH 3.37Å; Y199-Y217 HydrophobicContact CE1-CD1 4.29Å; Y199-Y217 AromaticContact CE1-CD2 3.43Å; Y199-Y217 HydrophobicContact CE1-CD2 3.43Å; Y199-Y217 VanDerWaalsContact CE1-CD2 3.43Å; Y199-Y217 HydrophobicContact CE1-CE1 4.16Å; Y199-Y217 AromaticContact CE1-CE2 3.25Å; Y199-Y217 HydrophobicContact CE1-CE2 3.25Å; Y199-Y217 AromaticContact CE1-CG 3.94Å; Y199-Y217 HydrophobicContact CE1-CG 3.94Å; Y199-Y217 AromaticContact CE1-CZ 3.63Å; Y199-Y217 HydrophobicContact CG-CE1 4.11Å; Y199-Y217 HydrophobicContact CG-CE2 4.25Å; Y199-Y217 AromaticContact CG-CZ 3.77Å; L203-Y217 HydrophobicContact CD1-CG 4.19Å; D213-Y217 VanDerWaalsContact O-CB 3.29Å; D213-Y217 WeakPolarHBondContact O-CB 3.31Å; D213-Y217 PolarHBondContact O-N 2.97Å; A214-Y217 PolarHBondContact O-N 3.43Å; Y217-R219 PolarHBondContact O-N 3.44Å; Y217-H220 AromaticContact CD2-CD2 3.75Å; Y217-H220 AromaticContact CE2-CD2 3.88Å; Y217-H220 WeakPolarHBondContact O-CB 3.44Å; Y217-H220 PolarHBondContact O-CD2 3.49Å; Y217-H220 VanDerWaalsContact O-CD2 3.3Å; Y217-H220 PolarHBondContact O-N 2.94Å
218A87.8Confident84.3Confident17 Ų1776.5 Ų76.514%0.1441%0.405CS..G310 helixtrans-57.1-20.6177.900000113.7F200 A214 L215 Q216 H220 F221 M236F200-A218 HydrophobicContact CE2-CB 4.12Å; A214-A218 PolarHBondContact O-N 3.25Å; L215-A218 WeakPolarHBondContact O-CB 3.39Å; L215-A218 PolarHBondContact O-N 2.98Å; Q216-A218 VanDerWaalsContact C-N 3.27Å; Q216-A218 PolarHBondContact O-N 3.15Å; A218-H220 PolarHBondContact O-N 2.91Å; A218-F221 HydrophobicContact CB-CD2 4.29Å; A218-F221 WeakPolarHBondContact O-CB 3.38Å; A218-F221 WeakPolarHBondContact O-CD2 3.37Å; A218-F221 PolarHBondContact O-N 3.44Å; A218-F221 VanDerWaalsContact O-N 3.07Å; A218-M236 HydrophobicContact CB-CE 4.4Å; A218-M236 HydrophobicContact CB-SD 3.99Å
219R86.8Confident84.8Confident177 Ų17777.9 Ų77.967%0.66841%0.41SS*.G310 helixtrans-60.9-28.3174.2-63.9179.7-177.6-176.51.7112.7Q216 Y217 F221 Q222Q216-R219 WeakPolarHBondContact O-CG 3.35Å; Q216-R219 PolarHBondContact O-N 3.05Å; Y217-R219 PolarHBondContact O-N 3.44Å; R219-F221 PolarHBondContact O-N 3.28Å; R219-Q222 WeakPolarHBondContact O-CB 3.39Å; R219-Q222 WeakPolarHBondContact O-CG 3.49Å; R219-Q222 PolarHBondContact O-N 2.97Å
220H84.9Confident85.2Confident96 Ų9684.4 Ų84.444%0.44441%0.413SS..G310 helixtrans-66.4-15.6176-67.8-78000113.2Y217 A218 Q222 P223Y217-H220 AromaticContact CD2-CD2 3.75Å; Y217-H220 AromaticContact CE2-CD2 3.88Å; Y217-H220 WeakPolarHBondContact O-CB 3.44Å; Y217-H220 PolarHBondContact O-CD2 3.49Å; Y217-H220 VanDerWaalsContact O-CD2 3.3Å; Y217-H220 PolarHBondContact O-N 2.94Å; A218-H220 PolarHBondContact O-N 2.91Å; H220-Q222 VanDerWaalsContact C-N 3.34Å; H220-P223 WeakPolarHBondContact O-CD 3.44Å
221F85.8Confident85.3Confident5 Ų584.6 Ų84.62%0.02241%0.414CS..G310 helixtrans-80.1-9.7174.9-63-58000114.3F193 H196 F200 A218 R219 P223 F224 A225 I232 L235F193-F221 HydrophobicContact CD2-CD1 4.08Å; F193-F221 HydrophobicContact CD2-CE1 4.36Å; F193-F221 AromaticContact CE2-CD1 3.82Å; F193-F221 HydrophobicContact CE2-CD1 3.82Å; F193-F221 HydrophobicContact CE2-CE1 4.07Å; H196-F221 HydrophobicContact CB-CD1 4.27Å; H196-F221 HydrophobicContact CB-CE1 3.63Å; H196-F221 HydrophobicContact CB-CZ 4.29Å; F200-F221 HydrophobicContact CB-CE2 4.04Å; F200-F221 HydrophobicContact CB-CZ 3.79Å; F200-F221 AromaticContact CD2-CE2 3.8Å; F200-F221 HydrophobicContact CD2-CE2 3.8Å; F200-F221 HydrophobicContact CD2-CZ 4.42Å; F200-F221 HydrophobicContact CE2-CE2 4.39Å; F200-F221 AromaticContact CG-CE2 3.94Å; F200-F221 HydrophobicContact CG-CE2 3.94Å; F200-F221 HydrophobicContact CG-CZ 4.17Å; A218-F221 HydrophobicContact CB-CD2 4.29Å; A218-F221 WeakPolarHBondContact O-CB 3.38Å; A218-F221 WeakPolarHBondContact O-CD2 3.37Å; A218-F221 PolarHBondContact O-N 3.44Å; A218-F221 VanDerWaalsContact O-N 3.07Å; R219-F221 PolarHBondContact O-N 3.28Å; F221-P223 VanDerWaalsContact C-CD 3.48Å; F221-F224 PolarHBondContact O-N 3.46Å; F221-A225 PolarHBondContact O-N 3.49Å; F221-I232 HydrophobicContact CB-CD1 3.97Å; F221-I232 HydrophobicContact CB-CG1 4.16Å; F221-I232 HydrophobicContact CG-CG1 4.35Å; F221-L235 HydrophobicContact CE1-CD1 4.38Å; F221-L235 HydrophobicContact CE2-CD1 4.28Å; F221-L235 HydrophobicContact CZ-CD1 3.94Å
222Q82.9Confident85.5Confident151 Ų15182.4 Ų82.471%0.70641%0.405SS*.G310 helixtrans-53.4-44.5-177.3-75.4-174.6-27.700114.4R219 H220 F224 A225R219-Q222 WeakPolarHBondContact O-CB 3.39Å; R219-Q222 WeakPolarHBondContact O-CG 3.49Å; R219-Q222 PolarHBondContact O-N 2.97Å; H220-Q222 VanDerWaalsContact C-N 3.34Å; Q222-F224 PolarHBondContact O-N 3.4Å; Q222-A225 WeakPolarHBondContact O-CB 3.48Å; Q222-A225 PolarHBondContact O-N 3.43Å
223P83.3Confident85.6Confident83 Ų8381.4 Ų81.454%0.53940%0.399SS..G310 helixtrans-64.8-24178.6-2134.6000113.6H220 F221H220-P223 WeakPolarHBondContact O-CD 3.44Å; F221-P223 VanDerWaalsContact C-CD 3.48Å
224F84.9Confident85.7Confident20 Ų2080.8 Ų80.89%0.08839%0.394CS..G310 helixtrans-98.2-1.7-175.2-53.8-73.1000113.1E192 F193 F221 Q222 S226 Q227 H228E192-F224 HydrophobicContact CB-CE1 4.47Å; E192-F224 HydrophobicContact CB-CZ 4.09Å; E192-F224 HydrophobicContact CG-CE2 4.37Å; E192-F224 HydrophobicContact CG-CZ 3.7Å; F193-F224 HydrophobicContact CB-CD1 4Å; F193-F224 HydrophobicContact CB-CE1 4.36Å; F193-F224 HydrophobicContact CB-CG 4.15Å; F193-F224 HydrophobicContact CD2-CB 3.71Å; F193-F224 HydrophobicContact CD2-CD2 4.3Å; F193-F224 AromaticContact CD2-CG 3.95Å; F193-F224 HydrophobicContact CD2-CG 3.95Å; F193-F224 HydrophobicContact CE2-CB 4.36Å; F193-F224 HydrophobicContact CG-CB 4.45Å; F193-F224 HydrophobicContact CG-CG 4.47Å; F221-F224 PolarHBondContact O-N 3.46Å; Q222-F224 PolarHBondContact O-N 3.4Å; F224-S226 VanDerWaalsContact C-N 3.29Å; F224-S226 PolarHBondContact O-N 3.31Å; F224-Q227 PolarHBondContact O-N 3.02Å; F224-H228 PolarHBondContact O-N 3.45Å
225A81.7Confident85.6Confident44 Ų4480.9 Ų80.936%0.36440%0.395SS..THydrogen-bonded Turntrans-61.2-33.8-172.200000113.7F221 Q222 Q229 I232F221-A225 PolarHBondContact O-N 3.49Å; Q222-A225 WeakPolarHBondContact O-CB 3.48Å; Q222-A225 PolarHBondContact O-N 3.43Å; A225-Q229 WeakPolarHBondContact O-CB 3.33Å; A225-Q229 PolarHBondContact O-N 2.93Å; A225-I232 HydrophobicContact CB-CD1 4.38Å
226S82.3Confident85.7Confident104 Ų10481.3 Ų81.373%0.72740%0.396SS*.THydrogen-bonded Turntrans-72.8-33.7179.456.20000113.1F224F224-S226 VanDerWaalsContact C-N 3.29Å; F224-S226 PolarHBondContact O-N 3.31Å
227Q83.2Confident85.4Confident143 Ų14376.3 Ų76.367%0.66838%0.378SS*.THydrogen-bonded Turntrans-91.8-35.1-176.5-67.9-179.9-7.500112.6F224F224-Q227 PolarHBondContact O-N 3.02Å
228H85.4Confident85.3Confident36 Ų3674.9 Ų74.917%0.16737%0.373CS..SBendtrans-120.432.9-170.7-66.5-72.5000113.8F193 F224 R230 D231 I232F193-H228 HydrophobicContact CD1-CB 4.13Å; F193-H228 AromaticContact CD1-CD2 3.66Å; F193-H228 AromaticContact CD1-CE1 3.85Å; F193-H228 AromaticContact CD1-CG 3.57Å; F193-H228 AromaticContact CD1-ND1 3.68Å; F193-H228 AromaticContact CD1-NE2 3.84Å; F193-H228 HydrophobicContact CD2-CB 4.11Å; F193-H228 HydrophobicContact CE1-CB 3.7Å; F193-H228 AromaticContact CE1-CG 3.54Å; F193-H228 AromaticContact CE1-ND1 3.61Å; F193-H228 HydrophobicContact CE2-CB 3.68Å; F193-H228 HydrophobicContact CG-CB 4.33Å; F193-H228 AromaticContact CG-CD2 3.64Å; F193-H228 AromaticContact CG-CG 3.89Å; F193-H228 HydrophobicContact CZ-CB 3.47Å; F193-H228 VanDerWaalsContact CZ-CB 3.47Å; F193-H228 AromaticContact CZ-CG 3.86Å; F224-H228 PolarHBondContact O-N 3.45Å; H228-R230 PolarHBondContact O-N 3.42Å; H228-D231 IonicContact ND1-OD2 3.5Å; H228-D231 PolarHBondContact O-N 3.47Å; H228-I232 HydrophobicContact CB-CD1 4.5Å; H228-I232 WeakPolarHBondContact O-CG1 3.39Å; H228-I232 PolarHBondContact O-N 3.07Å; H228-I232 VanDerWaalsContact O-N 3.09Å
229Q86.9Confident85.1Confident122 Ų12275 Ų7557%0.5737%0.371SS*.Hα-helixtrans-54.8-44.5-174.1-168.3-179.90.400113.9A225 I232 Q233A225-Q229 WeakPolarHBondContact O-CB 3.33Å; A225-Q229 PolarHBondContact O-N 2.93Å; Q229-I232 PolarHBondContact O-N 3.31Å; Q229-Q233 WeakPolarHBondContact O-CG 3.35Å; Q229-Q233 PolarHBondContact O-N 3.36Å
230R86.4Confident85Confident203 Ų20371.7 Ų71.777%0.76637%0.37SS*.Hα-helixtrans-65.4-42.9-178.7-67.4-175.3-162.3147.64.5112H228 I232 Q233 I234H228-R230 PolarHBondContact O-N 3.42Å; R230-I232 VanDerWaalsContact C-N 3.32Å; R230-I232 PolarHBondContact O-N 3.17Å; R230-Q233 PolarHBondContact O-N 3.24Å; R230-I234 WeakPolarHBondContact O-CG1 3.41Å; R230-I234 PolarHBondContact O-N 2.9Å
231D85.3Confident84.9Confident58 Ų5871.5 Ų71.531%0.3137%0.366SS..Hα-helixtrans-62.9-42.6178.7-64.7-47.3000110.5F193 H228 Q233 I234 L235F193-D231 HydrophobicContact CE1-CB 4.02Å; F193-D231 HydrophobicContact CZ-CB 3.69Å; H228-D231 IonicContact ND1-OD2 3.5Å; H228-D231 PolarHBondContact O-N 3.47Å; D231-Q233 PolarHBondContact O-N 3.17Å; D231-I234 PolarHBondContact O-N 3.39Å; D231-L235 WeakPolarHBondContact O-CG 3.47Å; D231-L235 PolarHBondContact O-N 3.41Å
232I87.1Confident84.6Confident27 Ų2771.8 Ų71.814%0.13837%0.368CS..Hα-helixtrans-64.1-40.5176.7-64.3162.5000111.2F193 F221 A225 H228 Q229 R230 I234 L235 M236F193-I232 HydrophobicContact CE2-CD1 4.33Å; F193-I232 HydrophobicContact CE2-CG1 3.97Å; F193-I232 HydrophobicContact CZ-CG1 4.35Å; F221-I232 HydrophobicContact CB-CD1 3.97Å; F221-I232 HydrophobicContact CB-CG1 4.16Å; F221-I232 HydrophobicContact CG-CG1 4.35Å; A225-I232 HydrophobicContact CB-CD1 4.38Å; H228-I232 HydrophobicContact CB-CD1 4.5Å; H228-I232 WeakPolarHBondContact O-CG1 3.39Å; H228-I232 PolarHBondContact O-N 3.07Å; H228-I232 VanDerWaalsContact O-N 3.09Å; Q229-I232 PolarHBondContact O-N 3.31Å; R230-I232 VanDerWaalsContact C-N 3.32Å; R230-I232 PolarHBondContact O-N 3.17Å; I232-I234 VanDerWaalsContact C-N 3.33Å; I232-I234 PolarHBondContact O-N 2.95Å; I232-L235 PolarHBondContact O-N 3.3Å; I232-M236 HydrophobicContact CG2-CG 4.25Å; I232-M236 VanDerWaalsContact O-CG 3.28Å; I232-M236 WeakPolarHBondContact O-CG 3.35Å; I232-M236 PolarHBondContact O-N 3.22Å
233Q87.4Confident84.2Confident116 Ų11674.1 Ų74.154%0.54237%0.37SS..Hα-helixtrans-61.5-40.8175.9-75.5172.4-7.700112.2Q229 R230 D231 M236 G237Q229-Q233 WeakPolarHBondContact O-CG 3.35Å; Q229-Q233 PolarHBondContact O-N 3.36Å; R230-Q233 PolarHBondContact O-N 3.24Å; D231-Q233 PolarHBondContact O-N 3.17Å; Q233-M236 PolarHBondContact O-N 3.02Å; Q233-G237 PolarHBondContact O-N 3.05Å
234I87.3Confident83.7Confident69 Ų6976.8 Ų76.835%0.35438%0.375SS..Hα-helixtrans-63.3-46.1175.7-70.5167000110.4R230 D231 I232 M236 G237 S238 Y251 L254R230-I234 WeakPolarHBondContact O-CG1 3.41Å; R230-I234 PolarHBondContact O-N 2.9Å; D231-I234 PolarHBondContact O-N 3.39Å; I232-I234 VanDerWaalsContact C-N 3.33Å; I232-I234 PolarHBondContact O-N 2.95Å; I234-M236 PolarHBondContact O-N 3.4Å; I234-G237 PolarHBondContact O-N 3.39Å; I234-S238 PolarHBondContact O-N 3.35Å; I234-Y251 HydrophobicContact CG2-CD1 3.78Å; I234-Y251 HydrophobicContact CG2-CE1 3.8Å; I234-L254 HydrophobicContact CG2-CD1 4.13Å; I234-L254 HydrophobicContact CG2-CD2 4.19Å
235L85.8Confident83.1Confident2 Ų277.3 Ų77.31%0.0139%0.386CS..Hα-helixtrans-60.7-46.2177.4-67.5172.7000111.5R197 F200 I201 F221 D231 I232 G237 S238 L254R197-L235 HydrophobicContact CB-CD1 4.31Å; R197-L235 HydrophobicContact CG-CD1 4.06Å; R197-L235 HydrophobicContact CG-CD2 4.22Å; F200-L235 HydrophobicContact CD1-CB 4.09Å; F200-L235 HydrophobicContact CD1-CD2 4.03Å; F200-L235 HydrophobicContact CD1-CG 4.44Å; F200-L235 HydrophobicContact CE1-CB 3.84Å; F200-L235 HydrophobicContact CE1-CD2 4.47Å; I201-L235 HydrophobicContact CD1-CD2 4.34Å; I201-L235 HydrophobicContact CG1-CD2 4.01Å; F221-L235 HydrophobicContact CE1-CD1 4.38Å; F221-L235 HydrophobicContact CE2-CD1 4.28Å; F221-L235 HydrophobicContact CZ-CD1 3.94Å; D231-L235 WeakPolarHBondContact O-CG 3.47Å; D231-L235 PolarHBondContact O-N 3.41Å; I232-L235 PolarHBondContact O-N 3.3Å; L235-G237 PolarHBondContact O-N 3.2Å; L235-S238 PolarHBondContact O-N 2.8Å; L235-S238 PolarHBondContact O-OG 2.87Å; L235-L254 HydrophobicContact CD2-CD1 4.32Å
236M86.7Confident82.9Confident78 Ų7875.8 Ų75.838%0.38437%0.371SS..Hα-helixtrans-67.9-35.8177.7-63.8-61.2-83.700112.1F200 L215 A218 I232 Q233 I234 S238 L239F200-M236 HydrophobicContact CZ-SD 4.45Å; L215-M236 HydrophobicContact CD2-CE 4.28Å; A218-M236 HydrophobicContact CB-CE 4.4Å; A218-M236 HydrophobicContact CB-SD 3.99Å; I232-M236 HydrophobicContact CG2-CG 4.25Å; I232-M236 VanDerWaalsContact O-CG 3.28Å; I232-M236 WeakPolarHBondContact O-CG 3.35Å; I232-M236 PolarHBondContact O-N 3.22Å; Q233-M236 PolarHBondContact O-N 3.02Å; I234-M236 PolarHBondContact O-N 3.4Å; M236-S238 VanDerWaalsContact C-N 3.3Å; M236-S238 PolarHBondContact O-N 2.99Å; M236-L239 HydrophobicContact CE-CD1 4.46Å; M236-L239 WeakPolarHBondContact O-CB 3.17Å; M236-L239 PolarHBondContact O-N 3.19Å; M236-L239 HydrophobicContact SD-CD1 4.16Å
237G84.4Confident82.6Confident21 Ų2177.5 Ų77.522%0.21637%0.368CS..Hα-helixtrans-65.7-30.7175.600000113.5Q233 I234 L235 L239 V240Q233-G237 PolarHBondContact O-N 3.05Å; I234-G237 PolarHBondContact O-N 3.39Å; L235-G237 PolarHBondContact O-N 3.2Å; G237-L239 PolarHBondContact O-N 2.95Å; G237-V240 PolarHBondContact O-N 2.49Å
238S84.6Confident82.3Confident0 Ų077.4 Ų77.40%037%0.372CS..Hα-helixtrans-64-26177.476.90000113.4L204 I234 L235 M236 V240 Y241L204-S238 WeakPolarHBondContact CD1-OG 3.3Å; I234-S238 PolarHBondContact O-N 3.35Å; L235-S238 PolarHBondContact O-N 2.8Å; L235-S238 PolarHBondContact O-OG 2.87Å; M236-S238 VanDerWaalsContact C-N 3.3Å; M236-S238 PolarHBondContact O-N 2.99Å; S238-V240 PolarHBondContact O-N 3.41Å; S238-V240 VanDerWaalsContact O-N 3.16Å; S238-Y241 PolarHBondContact O-N 3.29Å
239L83.4Confident81.9Confident20 Ų2076.2 Ų76.211%0.10537%0.368CS..G310 helixtrans-59.3-28.8178.4-66.3171.4000112.9F200 L204 A214 L215 M236 G237 Y241 L242F200-L239 HydrophobicContact CZ-CD1 4.38Å; F200-L239 HydrophobicContact CZ-CD2 4.15Å; F200-L239 HydrophobicContact CZ-CG 4.35Å; L204-L239 HydrophobicContact CD2-CD2 3.38Å; L204-L239 HydrophobicContact CD2-CG 4.33Å; A214-L239 HydrophobicContact CB-CD2 4.39Å; L215-L239 HydrophobicContact CD2-CD1 3.61Å; L215-L239 HydrophobicContact CG-CD1 4.32Å; M236-L239 HydrophobicContact CE-CD1 4.46Å; M236-L239 WeakPolarHBondContact O-CB 3.17Å; M236-L239 PolarHBondContact O-N 3.19Å; M236-L239 HydrophobicContact SD-CD1 4.16Å; G237-L239 PolarHBondContact O-N 2.95Å; L239-Y241 PolarHBondContact O-N 3Å; L239-L242 HydrophobicContact CB-CD1 4.24Å; L239-L242 HydrophobicContact CD2-CD1 3.53Å; L239-L242 HydrophobicContact CD2-CG 4.48Å; L239-L242 WeakPolarHBondContact O-CB 3.42Å; L239-L242 PolarHBondContact O-N 3.47Å
240V84.6Confident81.5Confident107 Ų10775 Ų7565%0.64837%0.37SS*.G310 helixtrans-64-29.6178.4-178.70000111.5G237 S238G237-V240 PolarHBondContact O-N 2.49Å; S238-V240 PolarHBondContact O-N 3.41Å; S238-V240 VanDerWaalsContact O-N 3.16Å
241Y82.6Confident81.2Confident92 Ų9267.9 Ų67.936%0.36134%0.344SS..G310 helixtrans-94.2-1.9-175.6-64.6-90.6000113.6S238 L239 R243 H244 G245 Y251S238-Y241 PolarHBondContact O-N 3.29Å; L239-Y241 PolarHBondContact O-N 3Å; Y241-R243 PolarHBondContact O-N 2.88Å; Y241-H244 PolarHBondContact O-N 2.94Å; Y241-G245 PolarHBondContact O-N 3.44Å; Y241-Y251 AromaticContact CD2-CD2 3.9Å; Y241-Y251 HydrophobicContact CD2-CD2 3.9Å; Y241-Y251 AromaticContact CD2-CE2 3.59Å; Y241-Y251 HydrophobicContact CD2-CE2 3.59Å; Y241-Y251 HydrophobicContact CE2-CD2 4.26Å; Y241-Y251 AromaticContact CE2-CE2 3.59Å; Y241-Y251 HydrophobicContact CE2-CE2 3.59Å
242L79.6Confident81Confident11 Ų1173.8 Ų73.86%0.05836%0.362CS..G310 helixtrans-52.7-33.4179.1-81.7169.4000113.4L204 Q211 L239 H244 G245 I246L204-L242 HydrophobicContact CB-CD2 4.47Å; L204-L242 HydrophobicContact CD2-CD1 4.31Å; L204-L242 HydrophobicContact CD2-CD2 4.04Å; L204-L242 HydrophobicContact CD2-CG 4.41Å; L204-L242 WeakPolarHBondContact O-CD2 3.31Å; Q211-L242 HydrophobicContact CB-CD1 4.08Å; Q211-L242 HydrophobicContact CG-CD1 3.87Å; L239-L242 HydrophobicContact CB-CD1 4.24Å; L239-L242 HydrophobicContact CD2-CD1 3.53Å; L239-L242 HydrophobicContact CD2-CG 4.48Å; L239-L242 WeakPolarHBondContact O-CB 3.42Å; L239-L242 PolarHBondContact O-N 3.47Å; L242-H244 VanDerWaalsContact C-N 3.29Å; L242-H244 PolarHBondContact O-N 3.39Å; L242-G245 PolarHBondContact O-N 2.95Å; L242-I246 HydrophobicContact CD2-CD1 4.01Å
243R74.9Confident80.6Confident201 Ų20175.4 Ų75.476%0.75838%0.376SS*.G310 helixtrans-66.8-26.5178.9-76.9-166.5-83.9-149.5-3.5114.6I208 Y241I208-R243 HydrophobicContact CD1-CB 4.39Å; I208-R243 HydrophobicContact CD1-CG 3.83Å; I208-R243 HydrophobicContact CG1-CG 4.2Å; Y241-R243 PolarHBondContact O-N 2.88Å
244H72.7Confident80.2Confident139 Ų13970.7 Ų70.764%0.64435%0.354SS*.G310 helixtrans-108.1-0.4-177-57.885.8000112.3Y241 L242 N248Y241-H244 PolarHBondContact O-N 2.94Å; L242-H244 VanDerWaalsContact C-N 3.29Å; L242-H244 PolarHBondContact O-N 3.39Å; H244-N248 PolarHBondContact O-ND2 3.21Å; H244-N248 VanDerWaalsContact O-ND2 3.07Å
245G73.5Confident79.6Confident30 Ų3069.7 Ų69.731%0.30935%0.349SS..  trans80.8137.3-171.500000112.4Y241 L242 E247 N248Y241-G245 PolarHBondContact O-N 3.44Å; L242-G245 PolarHBondContact O-N 2.95Å; G245-E247 PolarHBondContact O-N 3.39Å; G245-N248 PolarHBondContact O-N 2.82Å
246I77.6Confident79.2Confident12 Ų1274.8 Ų74.86%0.06237%0.373CS..G310 helixtrans-69.6-24.1-179.6-70.4159.7000111.8L204 L242 N248 S249 L255L204-I246 HydrophobicContact CB-CD1 3.46Å; L204-I246 VanDerWaalsContact CB-CD1 3.46Å; L204-I246 HydrophobicContact CD1-CD1 3.91Å; L204-I246 HydrophobicContact CD2-CD1 4.36Å; L204-I246 HydrophobicContact CG-CD1 4.14Å; L242-I246 HydrophobicContact CD2-CD1 4.01Å; I246-N248 PolarHBondContact O-N 3.33Å; I246-S249 WeakPolarHBondContact O-CB 3.2Å; I246-S249 PolarHBondContact O-N 2.93Å; I246-S249 VanDerWaalsContact O-N 3.14Å; I246-S249 PolarHBondContact O-OG 3.23Å; I246-L255 HydrophobicContact CB-CD1 4.1Å; I246-L255 HydrophobicContact CG2-CD1 3.81Å; I246-L255 HydrophobicContact CG2-CG 4Å
247E75.1Confident78.4Confident141 Ų14176.1 Ų76.166%0.65939%0.386SS*.G310 helixtrans-60.5-31.7174.4-60.7-173.7176.500113G245 S249 L255G245-E247 PolarHBondContact O-N 3.39Å; E247-S249 VanDerWaalsContact C-N 3.32Å; E247-L255 HydrophobicContact CB-CD1 4.49Å; E247-L255 HydrophobicContact CG-CD1 3.56Å
248N76.8Confident78.1Confident141 Ų14180.8 Ų80.875%0.75441%0.406SS*.G310 helixtrans-93.511.7-179.9-63.1-43.4000113H244 G245 I246H244-N248 PolarHBondContact O-ND2 3.21Å; H244-N248 VanDerWaalsContact O-ND2 3.07Å; G245-N248 PolarHBondContact O-N 2.82Å; I246-N248 PolarHBondContact O-N 3.33Å
249S77.3Confident77.9Confident11 Ų1181.6 Ų81.68%0.07741%0.41CS..SBendtrans-112.6164.1-173.284.40000111.3I246 E247 Y251 R252I246-S249 WeakPolarHBondContact O-CB 3.2Å; I246-S249 PolarHBondContact O-N 2.93Å; I246-S249 VanDerWaalsContact O-N 3.14Å; I246-S249 PolarHBondContact O-OG 3.23Å; E247-S249 VanDerWaalsContact C-N 3.32Å; S249-Y251 PolarHBondContact O-N 2.96Å; S249-Y251 WeakPolarHBondContact OG-CB 3.32Å; S249-Y251 PolarHBondContact OG-N 3.08Å; S249-Y251 VanDerWaalsContact OG-N 3.13Å; S249-R252 PolarHBondContact O-N 3.31Å; S249-R252 VanDerWaalsContact O-N 3.17Å
250P78.8Confident77.9Confident96 Ų9682.7 Ų82.762%0.62341%0.412SS*.THydrogen-bonded Turntrans-60.9-10.3171.727.1-36000113.2
251Y80.6Confident77.9Confident53 Ų5380 Ų8021%0.20840%0.402CS..THydrogen-bonded Turntrans-9314.2178.8-54.7-68.2000114I234 Y241 S249 S253 L254I234-Y251 HydrophobicContact CG2-CD1 3.78Å; I234-Y251 HydrophobicContact CG2-CE1 3.8Å; Y241-Y251 AromaticContact CD2-CD2 3.9Å; Y241-Y251 HydrophobicContact CD2-CD2 3.9Å; Y241-Y251 AromaticContact CD2-CE2 3.59Å; Y241-Y251 HydrophobicContact CD2-CE2 3.59Å; Y241-Y251 HydrophobicContact CE2-CD2 4.26Å; Y241-Y251 AromaticContact CE2-CE2 3.59Å; Y241-Y251 HydrophobicContact CE2-CE2 3.59Å; S249-Y251 PolarHBondContact O-N 2.96Å; S249-Y251 WeakPolarHBondContact OG-CB 3.32Å; S249-Y251 PolarHBondContact OG-N 3.08Å; S249-Y251 VanDerWaalsContact OG-N 3.13Å; Y251-S253 PolarHBondContact O-N 3.44Å; Y251-S253 VanDerWaalsContact O-N 3.12Å; Y251-L254 HydrophobicContact CD1-CD1 4.3Å; Y251-L254 HydrophobicContact CG-CD1 4.34Å; Y251-L254 VanDerWaalsContact O-CB 3.26Å; Y251-L254 WeakPolarHBondContact O-CB 3.4Å; Y251-L254 WeakPolarHBondContact O-CG 3.3Å; Y251-L254 PolarHBondContact O-N 3.37Å
252R79.6Confident78.1Confident182 Ų18280 Ų8069%0.68740%0.404SS*.G310 helixtrans-51.6-34.9176.1-179.1179.5176.6-169.30.9113.1S249 L254 L255S249-R252 PolarHBondContact O-N 3.31Å; S249-R252 VanDerWaalsContact O-N 3.17Å; R252-L254 PolarHBondContact O-N 3.2Å; R252-L254 VanDerWaalsContact O-N 3.17Å; R252-L255 PolarHBondContact O-N 3.36Å
253S79.9Confident78.5Confident62 Ų6279.7 Ų79.743%0.43440%0.403SS..G310 helixtrans-61.4-20.9177.755.30000113.7Y251 L255 E256 Q259Y251-S253 PolarHBondContact O-N 3.44Å; Y251-S253 VanDerWaalsContact O-N 3.12Å; S253-L255 PolarHBondContact O-N 3.3Å; S253-E256 WeakPolarHBondContact CA-OE1 3.32Å; S253-E256 WeakPolarHBondContact CB-OE1 3.34Å; S253-E256 WeakPolarHBondContact O-CB 3.49Å; S253-E256 WeakPolarHBondContact O-CG 3.47Å; S253-E256 PolarHBondContact O-N 3.04Å; S253-Q259 PolarHBondContact O-NE2 3.14Å; S253-Q259 VanDerWaalsContact O-NE2 3.16Å
254L78.1Confident79.1Confident16 Ų1671.1 Ų71.18%0.08437%0.374CS..G310 helixtrans-67.2-26.3173.6-62.3-178.8000112.4I201 I234 L235 Y251 R252 E256 Q259I201-L254 HydrophobicContact CD1-CB 4.32Å; I234-L254 HydrophobicContact CG2-CD1 4.13Å; I234-L254 HydrophobicContact CG2-CD2 4.19Å; L235-L254 HydrophobicContact CD2-CD1 4.32Å; Y251-L254 HydrophobicContact CD1-CD1 4.3Å; Y251-L254 HydrophobicContact CG-CD1 4.34Å; Y251-L254 VanDerWaalsContact O-CB 3.26Å; Y251-L254 WeakPolarHBondContact O-CB 3.4Å; Y251-L254 WeakPolarHBondContact O-CG 3.3Å; Y251-L254 PolarHBondContact O-N 3.37Å; R252-L254 PolarHBondContact O-N 3.2Å; R252-L254 VanDerWaalsContact O-N 3.17Å; L254-E256 VanDerWaalsContact C-N 3.32Å; L254-Q259 PolarHBondContact O-NE2 2.93Å
255L75.2Confident79.7Confident49 Ų4969.9 Ų69.926%0.25737%0.372SS..G310 helixtrans-88.74.4-179-62.8174.4000113.4I201 S205 I246 E247 R252 S253 T257I201-L255 HydrophobicContact CG2-CD2 3.87Å; S205-L255 VanDerWaalsContact OG-CD2 3.27Å; S205-L255 WeakPolarHBondContact OG-CD2 3.38Å; I246-L255 HydrophobicContact CB-CD1 4.1Å; I246-L255 HydrophobicContact CG2-CD1 3.81Å; I246-L255 HydrophobicContact CG2-CG 4Å; E247-L255 HydrophobicContact CB-CD1 4.49Å; E247-L255 HydrophobicContact CG-CD1 3.56Å; R252-L255 PolarHBondContact O-N 3.36Å; S253-L255 PolarHBondContact O-N 3.3Å; L255-T257 PolarHBondContact O-N 3.14Å
256E76.6Confident80.4Confident108 Ų10869.2 Ų69.251%0.50536%0.361SS..  trans-63.8126.3-179-73.2175.6-164.700112.5S253 L254 N258 Q259S253-E256 WeakPolarHBondContact CA-OE1 3.32Å; S253-E256 WeakPolarHBondContact CB-OE1 3.34Å; S253-E256 WeakPolarHBondContact O-CB 3.49Å; S253-E256 WeakPolarHBondContact O-CG 3.47Å; S253-E256 PolarHBondContact O-N 3.04Å; L254-E256 VanDerWaalsContact C-N 3.32Å; E256-N258 PolarHBondContact O-N 3.27Å; E256-N258 VanDerWaalsContact O-N 3.11Å; E256-Q259 PolarHBondContact O-N 3.36Å
257T70.1Confident80.9Confident107 Ų10768.6 Ų68.666%0.65636%0.358SS*.THydrogen-bonded Turntrans-61.4-20.6179.6-42.10000113.5L255 Q259 W260L255-T257 PolarHBondContact O-N 3.14Å; T257-Q259 PolarHBondContact O-N 2.87Å; T257-Q259 VanDerWaalsContact O-N 3.16Å; T257-W260 PolarHBondContact O-N 2.88Å; T257-W260 VanDerWaalsContact O-N 3.17Å
258N78.7Confident81.5Confident118 Ų11863.5 Ų63.563%0.63134%0.336SS*.Hα-helixtrans-61.3-24.4179.8-163.525000113E256 W260 A261 E262E256-N258 PolarHBondContact O-N 3.27Å; E256-N258 VanDerWaalsContact O-N 3.11Å; N258-W260 VanDerWaalsContact C-N 3.25Å; N258-W260 PolarHBondContact O-N 3.41Å; N258-A261 PolarHBondContact O-N 2.86Å; N258-E262 PolarHBondContact O-N 3.42Å; N258-E262 VanDerWaalsContact O-N 3.14Å
259Q80.2Confident81.9Confident18 Ų1862.5 Ų62.58%0.08432%0.322CS..Hα-helixtrans-63.5-30.4178.4-63.5179.443.400112.6R197 L198 S253 L254 E256 T257 I263R197-Q259 VanDerWaalsContact NH2-CD 3.3Å; L198-Q259 HydrophobicContact CD2-CB 3.94Å; S253-Q259 PolarHBondContact O-NE2 3.14Å; S253-Q259 VanDerWaalsContact O-NE2 3.16Å; L254-Q259 PolarHBondContact O-NE2 2.93Å; E256-Q259 PolarHBondContact O-N 3.36Å; T257-Q259 PolarHBondContact O-N 2.87Å; T257-Q259 VanDerWaalsContact O-N 3.16Å; Q259-I263 WeakPolarHBondContact O-CB 3.43Å; Q259-I263 WeakPolarHBondContact O-CG1 3.38Å; Q259-I263 PolarHBondContact O-N 3.04Å
260W83.6Confident82.3Confident43 Ų4362.3 Ų62.316%0.16332%0.32CS..Hα-helixtrans-68.3-45.4177.4-69.294.2000111.9L165 Q168 L170 L198 T257 N258 E262 I263 C264L165-W260 HydrophobicContact CD2-CZ3 4.49Å; Q168-W260 HydrophobicContact CB-CH2 3.75Å; Q168-W260 HydrophobicContact CB-CZ2 4.02Å; Q168-W260 HydrophobicContact CB-CZ3 4.2Å; Q168-W260 HydrophobicContact CG-CH2 4.15Å; Q168-W260 HydrophobicContact CG-CZ2 4.05Å; Q168-W260 HydrophobicContact CG-CZ3 4.44Å; L170-W260 HydrophobicContact CD1-CH2 3.79Å; L170-W260 HydrophobicContact CD1-CZ3 4.36Å; L170-W260 HydrophobicContact CD2-CE3 4.47Å; L170-W260 HydrophobicContact CD2-CH2 3.86Å; L170-W260 HydrophobicContact CD2-CZ3 3.55Å; L170-W260 HydrophobicContact CG-CH2 3.67Å; L170-W260 HydrophobicContact CG-CZ3 3.8Å; L198-W260 HydrophobicContact CD1-CD2 3.88Å; L198-W260 HydrophobicContact CD1-CE3 3.88Å; L198-W260 HydrophobicContact CD1-CG 4.43Å; L198-W260 HydrophobicContact CD1-CH2 4.38Å; L198-W260 HydrophobicContact CD1-CZ2 4.37Å; L198-W260 HydrophobicContact CD1-CZ3 4.13Å; T257-W260 PolarHBondContact O-N 2.88Å; T257-W260 VanDerWaalsContact O-N 3.17Å; N258-W260 VanDerWaalsContact C-N 3.25Å; N258-W260 PolarHBondContact O-N 3.41Å; W260-E262 VanDerWaalsContact C-N 3.34Å; W260-E262 PolarHBondContact O-N 3.19Å; W260-I263 PolarHBondContact O-N 2.89Å; W260-C264 PolarHBondContact O-N 2.94Å; W260-C264 PolarHBondContact O-SG 3.05Å
261A85.3Confident82.6Confident51 Ų5157.8 Ų57.842%0.42129%0.291SS..Hα-helixtrans-63.4-41.5177.200000111.4N258 I263 C264 N265N258-A261 PolarHBondContact O-N 2.86Å; A261-I263 PolarHBondContact O-N 3.4Å; A261-C264 PolarHBondContact O-N 3.38Å; A261-N265 VanDerWaalsContact O-CG 3.28Å; A261-N265 PolarHBondContact O-N 3.06Å; A261-N265 VanDerWaalsContact O-N 3.08Å; A261-N265 PolarHBondContact O-ND2 3.36Å
262E86.4Confident82.7Confident90 Ų9055.6 Ų55.642%0.42128%0.283SS..Hα-helixtrans-60.9-44.2175.5-165.5-167.6151.300111.7K194 N258 W260 N265 I266K194-E262 IonicContact NZ-OE1 2.6Å; K194-E262 PolarHBondContact NZ-OE1 3.38Å; N258-E262 PolarHBondContact O-N 3.42Å; N258-E262 VanDerWaalsContact O-N 3.14Å; W260-E262 VanDerWaalsContact C-N 3.34Å; W260-E262 PolarHBondContact O-N 3.19Å; E262-N265 PolarHBondContact O-N 3.07Å; E262-I266 HydrophobicContact CG-CD1 3.97Å; E262-I266 VanDerWaalsContact O-CG1 3.3Å; E262-I266 WeakPolarHBondContact O-CG1 3.38Å; E262-I266 PolarHBondContact O-N 3.38Å
263I88.1Confident82.9Confident6 Ų649.2 Ų49.23%0.03127%0.27CS..Hα-helixtrans-68.7-38.7-179.9-78.8164.6000112.1K194 L195 L198 Q259 W260 A261 N265 I266 F267K194-I263 HydrophobicContact CB-CD1 3.98Å; K194-I263 HydrophobicContact CB-CG1 4.08Å; L195-I263 HydrophobicContact CD2-CG2 3.65Å; L195-I263 HydrophobicContact CG-CG2 4.47Å; L198-I263 HydrophobicContact CB-CD1 4.3Å; L198-I263 HydrophobicContact CD1-CB 4.38Å; L198-I263 HydrophobicContact CD1-CD1 3.16Å; L198-I263 HydrophobicContact CD1-CG1 4.32Å; L198-I263 HydrophobicContact CD1-CG2 4.5Å; L198-I263 HydrophobicContact CD2-CD1 4.36Å; L198-I263 HydrophobicContact CG-CD1 3.32Å; Q259-I263 WeakPolarHBondContact O-CB 3.43Å; Q259-I263 WeakPolarHBondContact O-CG1 3.38Å; Q259-I263 PolarHBondContact O-N 3.04Å; W260-I263 PolarHBondContact O-N 2.89Å; A261-I263 PolarHBondContact O-N 3.4Å; I263-N265 VanDerWaalsContact C-N 3.28Å; I263-N265 PolarHBondContact O-N 3.35Å; I263-I266 PolarHBondContact O-N 3Å; I263-F267 WeakPolarHBondContact O-CB 3.47Å; I263-F267 PolarHBondContact O-N 3.3Å
264C86.6Confident83.1Confident21 Ų2147 Ų4714%0.14225%0.253CS..Hα-helixtrans-58-42171.2-70.70000111.7L162 W260 A261 T268L162-C264 HydrophobicContact CD2-CB 4.16Å; W260-C264 PolarHBondContact O-N 2.94Å; W260-C264 PolarHBondContact O-SG 3.05Å; A261-C264 PolarHBondContact O-N 3.38Å; C264-T268 WeakPolarHBondContact O-CB 3.33Å; C264-T268 PolarHBondContact O-N 3Å; C264-T268 PolarHBondContact O-OG1 3Å
265N85.6Confident83.2Confident112 Ų11249.9 Ų49.960%0.59927%0.268SS*.Hα-helixtrans-67.4-43.6178.2-69.8-24.5000112.3A261 E262 I263 T268 R269A261-N265 VanDerWaalsContact O-CG 3.28Å; A261-N265 PolarHBondContact O-N 3.06Å; A261-N265 VanDerWaalsContact O-N 3.08Å; A261-N265 PolarHBondContact O-ND2 3.36Å; E262-N265 PolarHBondContact O-N 3.07Å; I263-N265 VanDerWaalsContact C-N 3.28Å; I263-N265 PolarHBondContact O-N 3.35Å; N265-T268 PolarHBondContact O-N 3.36Å; N265-R269 WeakPolarHBondContact O-CB 3.4Å; N265-R269 PolarHBondContact O-N 2.93Å
266I87.6Confident83.2Confident16 Ų1650.9 Ų50.98%0.08229%0.29CS..Hα-helixtrans-65.1-45.6177.7-66.4167.5000110.3L191 K194 E262 I263 T268 R269 D270L191-I266 HydrophobicContact CB-CG2 4.09Å; L191-I266 HydrophobicContact CD1-CB 4.48Å; L191-I266 HydrophobicContact CD1-CG2 3.96Å; K194-I266 HydrophobicContact CD-CD1 3.61Å; E262-I266 HydrophobicContact CG-CD1 3.97Å; E262-I266 VanDerWaalsContact O-CG1 3.3Å; E262-I266 WeakPolarHBondContact O-CG1 3.38Å; E262-I266 PolarHBondContact O-N 3.38Å; I263-I266 PolarHBondContact O-N 3Å; I266-T268 PolarHBondContact O-N 2.95Å; I266-R269 PolarHBondContact O-N 3.23Å; I266-D270 WeakPolarHBondContact CG2-OD2 3.4Å; I266-D270 WeakPolarHBondContact O-CB 3.33Å; I266-D270 PolarHBondContact O-N 2.94Å
267F89.6Confident83.1Confident0 Ų047.5 Ų47.50%028%0.275CS..Hα-helixtrans-56.5-49.9175.7174.9-96.3000111L158 I161 L162 L165 W176 L191 I263 R269 D270 A271L158-F267 HydrophobicContact CD1-CD1 4.15Å; L158-F267 HydrophobicContact CD1-CE1 3.44Å; L158-F267 VanDerWaalsContact CD1-CE1 3.44Å; L158-F267 HydrophobicContact CD1-CZ 4.03Å; L158-F267 HydrophobicContact CG-CE1 4.09Å; I161-F267 HydrophobicContact CB-CE1 3.98Å; I161-F267 HydrophobicContact CB-CE2 4.46Å; I161-F267 HydrophobicContact CB-CZ 3.69Å; I161-F267 HydrophobicContact CD1-CE2 4.23Å; I161-F267 HydrophobicContact CD1-CZ 3.69Å; I161-F267 HydrophobicContact CG1-CZ 4.29Å; I161-F267 HydrophobicContact CG2-CD1 4.42Å; I161-F267 HydrophobicContact CG2-CD2 4.37Å; I161-F267 HydrophobicContact CG2-CE1 3.75Å; I161-F267 HydrophobicContact CG2-CE2 3.7Å; I161-F267 HydrophobicContact CG2-CZ 3.37Å; L162-F267 HydrophobicContact CD2-CD1 3.73Å; L162-F267 HydrophobicContact CD2-CE1 4.27Å; L162-F267 HydrophobicContact CG-CD1 4.09Å; L162-F267 HydrophobicContact CG-CE1 4.12Å; L165-F267 HydrophobicContact CD1-CB 4.46Å; L165-F267 HydrophobicContact CD1-CD1 4.45Å; L165-F267 HydrophobicContact CD1-CG 4.34Å; W176-F267 AromaticContact CD2-CE2 3.68Å; W176-F267 HydrophobicContact CD2-CE2 3.68Å; W176-F267 HydrophobicContact CD2-CZ 4.27Å; W176-F267 HydrophobicContact CE3-CD2 4.07Å; W176-F267 AromaticContact CE3-CE2 3.45Å; W176-F267 HydrophobicContact CE3-CE2 3.45Å; W176-F267 VanDerWaalsContact CE3-CE2 3.45Å; W176-F267 HydrophobicContact CE3-CZ 4.43Å; W176-F267 HydrophobicContact CG-CE2 4.22Å; W176-F267 HydrophobicContact CH2-CE2 4.29Å; W176-F267 HydrophobicContact CZ3-CD2 4.09Å; W176-F267 AromaticContact CZ3-CE2 3.79Å; W176-F267 HydrophobicContact CZ3-CE2 3.79Å; L191-F267 HydrophobicContact CD1-CB 4.04Å; L191-F267 HydrophobicContact CD2-CB 4.5Å; L191-F267 HydrophobicContact CD2-CD2 4.05Å; I263-F267 WeakPolarHBondContact O-CB 3.47Å; I263-F267 PolarHBondContact O-N 3.3Å; F267-R269 VanDerWaalsContact C-N 3.35Å; F267-R269 PolarHBondContact O-N 2.77Å; F267-D270 PolarHBondContact O-N 3.05Å; F267-A271 HydrophobicContact CZ-CB 4.44Å; F267-A271 WeakPolarHBondContact O-CB 3.3Å; F267-A271 PolarHBondContact O-N 3.34Å
268T86.3Confident83.2Confident33 Ų3345 Ų4520%0.20226%0.262CS..Hα-helixtrans-58.1-47.8178.4-55.60000111C264 N265 I266 D270 C272C264-T268 WeakPolarHBondContact O-CB 3.33Å; C264-T268 PolarHBondContact O-N 3Å; C264-T268 PolarHBondContact O-OG1 3Å; N265-T268 PolarHBondContact O-N 3.36Å; I266-T268 PolarHBondContact O-N 2.95Å; T268-D270 PolarHBondContact O-N 3.43Å; T268-C272 VanDerWaalsContact O-CB 3.27Å; T268-C272 WeakPolarHBondContact O-CB 3.38Å; T268-C272 PolarHBondContact O-N 3.3Å; T268-C272 PolarHBondContact O-SG 2.92Å
269R85.3Confident82.9Confident120 Ų12043 Ų4345%0.45325%0.254SS..Hα-helixtrans-60-49.2179.5-176.3-16667-168.3-1.3111.9N265 I266 F267 C272 A273 V279N265-R269 WeakPolarHBondContact O-CB 3.4Å; N265-R269 PolarHBondContact O-N 2.93Å; I266-R269 PolarHBondContact O-N 3.23Å; F267-R269 VanDerWaalsContact C-N 3.35Å; F267-R269 PolarHBondContact O-N 2.77Å; R269-C272 PolarHBondContact O-N 3.46Å; R269-A273 WeakPolarHBondContact O-CB 3.19Å; R269-A273 PolarHBondContact O-N 3.15Å; R269-V279 HydrophobicContact CB-CG1 4.45Å; R269-V279 HydrophobicContact CB-CG2 4.45Å; R269-V279 HydrophobicContact CG-CG2 4.05Å
270D86.5Confident82.7Confident8 Ų847.3 Ų47.34%0.04327%0.274CS..Hα-helixtrans-73.2-37.6-173.8-62.5-9.8000111.1L184 S189 L191 I266 F267 T268 A273 L274L184-D270 HydrophobicContact CD2-CB 4.01Å; S189-D270 VanDerWaalsContact CB-OD2 3.3Å; S189-D270 WeakPolarHBondContact CB-OD2 3.31Å; S189-D270 PolarHBondContact OG-OD2 2.89Å; L191-D270 HydrophobicContact CD2-CB 4.29Å; I266-D270 WeakPolarHBondContact CG2-OD2 3.4Å; I266-D270 WeakPolarHBondContact O-CB 3.33Å; I266-D270 PolarHBondContact O-N 2.94Å; F267-D270 PolarHBondContact O-N 3.05Å; T268-D270 PolarHBondContact O-N 3.43Å; D270-A273 PolarHBondContact O-N 3.4Å; D270-L274 VanDerWaalsContact O-CG 3.31Å; D270-L274 WeakPolarHBondContact O-CG 3.45Å; D270-L274 PolarHBondContact O-N 3.11Å
271A85.3Confident82.6Confident1 Ų145.7 Ų45.71%0.00827%0.269CS..Hα-helixtrans-64.7-44.5173.100000111.9L158 W176 F267 A273 L274 L275L158-A271 HydrophobicContact CD1-CB 3.27Å; W176-A271 HydrophobicContact CH2-CB 3.7Å; W176-A271 HydrophobicContact CZ2-CB 3.64Å; F267-A271 HydrophobicContact CZ-CB 4.44Å; F267-A271 WeakPolarHBondContact O-CB 3.3Å; F267-A271 PolarHBondContact O-N 3.34Å; A271-A273 VanDerWaalsContact C-N 3.34Å; A271-A273 PolarHBondContact O-N 3.36Å; A271-L274 PolarHBondContact O-N 3.14Å; A271-L275 WeakPolarHBondContact O-CB 3.47Å; A271-L275 VanDerWaalsContact O-CG 3.24Å; A271-L275 WeakPolarHBondContact O-CG 3.35Å; A271-L275 PolarHBondContact O-N 3.49Å
272C83.3Confident82.4Confident6 Ų646.2 Ų46.24%0.04127%0.268CS..Hα-helixtrans-59.6-44173.4-73.20000111.6T268 R269 L274 L275 G276 L277 V279T268-C272 VanDerWaalsContact O-CB 3.27Å; T268-C272 WeakPolarHBondContact O-CB 3.38Å; T268-C272 PolarHBondContact O-N 3.3Å; T268-C272 PolarHBondContact O-SG 2.92Å; R269-C272 PolarHBondContact O-N 3.46Å; C272-L274 PolarHBondContact O-N 3.37Å; C272-L275 CarbonylContact O-C 3.52Å; C272-L275 PolarHBondContact O-N 3.1Å; C272-G276 PolarHBondContact O-N 2.96Å; C272-G276 VanDerWaalsContact O-N 3.07Å; C272-L277 CarbonylContact C-O 3.6Å; C272-L277 PolarHBondContact O-N 3.17Å; C272-V279 HydrophobicContact CB-CB 4.5Å; C272-V279 HydrophobicContact CB-CG2 4.02Å
273A83.9Confident82.3Confident49 Ų4944.3 Ų44.341%0.40526%0.261SS..Hα-helixtrans-61.2-42.317700000112.4L187 R269 D270 A271 L275 G276L187-A273 HydrophobicContact CD1-CB 3.98Å; R269-A273 WeakPolarHBondContact O-CB 3.19Å; R269-A273 PolarHBondContact O-N 3.15Å; D270-A273 PolarHBondContact O-N 3.4Å; A271-A273 VanDerWaalsContact C-N 3.34Å; A271-A273 PolarHBondContact O-N 3.36Å; A273-L275 VanDerWaalsContact C-N 3.3Å; A273-L275 PolarHBondContact O-N 3.43Å; A273-G276 PolarHBondContact O-N 3.42Å
274L83.8Confident82.2Confident16 Ų1646.9 Ų46.98%0.08428%0.279CS..Hα-helixtrans-65.8-32.1176.2-73.5-178.7000113.3W176 N180 R183 L184 L187 D270 A271 C272 G276W176-L274 HydrophobicContact CH2-CD1 3.61Å; W176-L274 HydrophobicContact CZ2-CD1 3.9Å; N180-L274 HydrophobicContact CB-CD1 3.97Å; R183-L274 HydrophobicContact CB-CD2 3.34Å; R183-L274 HydrophobicContact CG-CD2 4.43Å; R183-L274 PolarHBondContact NH2-O 2.99Å; L184-L274 HydrophobicContact CD2-CD1 3.88Å; L184-L274 HydrophobicContact CG-CD1 4.19Å; L187-L274 HydrophobicContact CD1-CD2 3.47Å; L187-L274 VanDerWaalsContact CD1-CD2 3.47Å; L187-L274 HydrophobicContact CD1-CG 3.74Å; L187-L274 HydrophobicContact CG-CD2 4.32Å; D270-L274 VanDerWaalsContact O-CG 3.31Å; D270-L274 WeakPolarHBondContact O-CG 3.45Å; D270-L274 PolarHBondContact O-N 3.11Å; A271-L274 PolarHBondContact O-N 3.14Å; C272-L274 PolarHBondContact O-N 3.37Å; L274-G276 VanDerWaalsContact C-N 3.28Å
275L78.9Confident82.1Confident75 Ų7547.1 Ų47.139%0.39328%0.28SS..Hα-helixtrans-83.9-5.5177.9-65.3169.9000112.7P154 A271 C272 A273 L277P154-L275 HydrophobicContact CB-CD1 3.56Å; P154-L275 HydrophobicContact CB-CD2 3.7Å; P154-L275 HydrophobicContact CB-CG 4.24Å; P154-L275 HydrophobicContact CG-CD2 4.14Å; A271-L275 WeakPolarHBondContact O-CB 3.47Å; A271-L275 VanDerWaalsContact O-CG 3.24Å; A271-L275 WeakPolarHBondContact O-CG 3.35Å; A271-L275 PolarHBondContact O-N 3.49Å; C272-L275 CarbonylContact O-C 3.52Å; C272-L275 PolarHBondContact O-N 3.1Å; A273-L275 VanDerWaalsContact C-N 3.3Å; A273-L275 PolarHBondContact O-N 3.43Å; L275-L277 HydrophobicContact CB-CB 4.39Å; L275-L277 HydrophobicContact CB-CD1 3.69Å; L275-L277 HydrophobicContact CB-CG 3.82Å; L275-L277 HydrophobicContact CD1-CD1 3.99Å; L275-L277 HydrophobicContact CG-CD1 4.48Å; L275-L277 PolarHBondContact O-N 2.82Å
276G75.2Confident82.1Confident70 Ų7045.5 Ų45.572%0.72228%0.278SS*.THydrogen-bonded Turntrans67.821.6-173.500000113C272 A273 L274C272-G276 PolarHBondContact O-N 2.96Å; C272-G276 VanDerWaalsContact O-N 3.07Å; A273-G276 PolarHBondContact O-N 3.42Å; L274-G276 VanDerWaalsContact C-N 3.28Å
277L75.1Confident82Confident38 Ų3851.9 Ų51.920%0.19931%0.305CS..  trans-98.5149.9-178.3-63.8172000110.4F155 C272 L275F155-L277 HydrophobicContact CE1-CD1 3.6Å; F155-L277 HydrophobicContact CE2-CD1 4.26Å; F155-L277 HydrophobicContact CZ-CD1 3.44Å; F155-L277 VanDerWaalsContact CZ-CD1 3.44Å; F155-L277 HydrophobicContact CZ-CD2 4.32Å; F155-L277 HydrophobicContact CZ-CG 4.47Å; C272-L277 CarbonylContact C-O 3.6Å; C272-L277 PolarHBondContact O-N 3.17Å; L275-L277 HydrophobicContact CB-CB 4.39Å; L275-L277 HydrophobicContact CB-CD1 3.69Å; L275-L277 HydrophobicContact CB-CG 3.82Å; L275-L277 HydrophobicContact CD1-CD1 3.99Å; L275-L277 HydrophobicContact CG-CD1 4.48Å; L275-L277 PolarHBondContact O-N 2.82Å
278S73.1Confident81.8Confident54 Ų5454.1 Ų54.138%0.37832%0.324SS..  trans-64.4135.5169.963.10000110.3R129 E280R129-S278 PolarHBondContact NH1-O 3.22Å; R129-S278 PolarHBondContact NH1-OG 3.13Å; R129-S278 PolarHBondContact NH2-OG 3.02Å; S278-E280 VanDerWaalsContact C-N 3.34Å; S278-E280 VanDerWaalsContact CB-O 3.3Å; S278-E280 WeakPolarHBondContact CB-O 3.36Å; S278-E280 PolarHBondContact OG-O 3.49Å
279V72.2Confident81.6Confident76 Ų7653.5 Ų53.546%0.46132%0.321SS..SBendtrans-62.5-44.2176.9-176.60000110.6R269 C272R269-V279 HydrophobicContact CB-CG1 4.45Å; R269-V279 HydrophobicContact CB-CG2 4.45Å; R269-V279 HydrophobicContact CG-CG2 4.05Å; C272-V279 HydrophobicContact CB-CB 4.5Å; C272-V279 HydrophobicContact CB-CG2 4.02Å
280E75.1Confident81.5Confident109 Ų10949.5 Ų49.551%0.50932%0.316SS..SBendtrans-89.8141.2173.4-63.4-179.5154.600110.2R129 S278 V285 Y334R129-E280 PolarHBondContact NH1-O 3.02Å; S278-E280 VanDerWaalsContact C-N 3.34Å; S278-E280 VanDerWaalsContact CB-O 3.3Å; S278-E280 WeakPolarHBondContact CB-O 3.36Å; S278-E280 PolarHBondContact OG-O 3.49Å; E280-V285 HydrophobicContact CB-CG2 3.64Å; E280-V285 WeakPolarHBondContact OE2-CG2 3.34Å; E280-Y334 PolarHBondContact OE2-OH 3.12Å
281S81.1Confident81.2Confident9 Ų952.2 Ų52.26%0.06334%0.335CS..  trans-65.6131.9174.7168.90000110H126 L283 S284 V285H126-S281 VanDerWaalsContact ND1-CB 3.25Å; H126-S281 WeakPolarHBondContact ND1-CB 3.3Å; H126-S281 PolarHBondContact ND1-OG 3.29Å; S281-L283 PolarHBondContact O-N 3.48Å; S281-L283 VanDerWaalsContact O-N 3.15Å; S281-L283 PolarHBondContact OG-N 2.97Å; S281-S284 WeakPolarHBondContact O-CB 3.36Å; S281-S284 PolarHBondContact O-N 3.02Å; S281-V285 PolarHBondContact O-N 2.83Å
282P80.7Confident81Confident61 Ų6156.2 Ų56.240%0.39636%0.355SS..Hα-helixtrans-53.6-36.2176.6-26.934.9000112.8S286P282-S286 WeakPolarHBondContact O-CB 3.41Å; P282-S286 PolarHBondContact O-N 2.65Å; P282-S286 PolarHBondContact O-OG 3.31Å
283L86.4Confident80.9Confident50 Ų5056.6 Ų56.626%0.26236%0.358SS..Hα-helixtrans-63.8-43.7175.3-177.764.2000111.9I123 H126 S281 S286 F287I123-L283 HydrophobicContact CB-CD2 4.36Å; I123-L283 HydrophobicContact CG1-CD2 3.85Å; H126-L283 HydrophobicContact CB-CB 4.26Å; H126-L283 HydrophobicContact CB-CD2 3.76Å; S281-L283 PolarHBondContact O-N 3.48Å; S281-L283 VanDerWaalsContact O-N 3.15Å; S281-L283 PolarHBondContact OG-N 2.97Å; L283-S286 PolarHBondContact O-N 3.32Å; L283-F287 WeakPolarHBondContact O-CB 3.46Å; L283-F287 PolarHBondContact O-N 3.17Å
284S85.6Confident80.7Confident60 Ų6056.4 Ų56.442%0.4235%0.351SS..Hα-helixtrans-64.6-44.8179.3-176.10000111.5S281 F287 A288S281-S284 WeakPolarHBondContact O-CB 3.36Å; S281-S284 PolarHBondContact O-N 3.02Å; S284-F287 PolarHBondContact O-N 3.16Å; S284-A288 WeakPolarHBondContact O-CB 3.43Å; S284-A288 PolarHBondContact O-N 2.6Å
285V84.5Confident80.5Confident27 Ų2758.9 Ų58.916%0.16437%0.367CS..Hα-helixtrans-63.6-44.7176.5177.80000110.9E280 S281 A288 S289 Y334E280-V285 HydrophobicContact CB-CG2 3.64Å; E280-V285 WeakPolarHBondContact OE2-CG2 3.34Å; S281-V285 PolarHBondContact O-N 2.83Å; V285-A288 PolarHBondContact O-N 3.02Å; V285-S289 VanDerWaalsContact O-CB 3.26Å; V285-S289 WeakPolarHBondContact O-CB 3.47Å; V285-S289 PolarHBondContact O-N 2.81Å; V285-S289 PolarHBondContact O-OG 3.25Å; V285-Y334 HydrophobicContact CG1-CE2 3.88Å; V285-Y334 VanDerWaalsContact CG1-OH 3.32Å; V285-Y334 WeakPolarHBondContact CG1-OH 3.42Å; V285-Y334 WeakPolarHBondContact CG2-OH 3.33Å
286S84.6Confident80.5Confident78 Ų7858 Ų5855%0.54537%0.365SS..Hα-helixtrans-64.2-42178.8-59.50000111.5P282 L283 G290P282-S286 WeakPolarHBondContact O-CB 3.41Å; P282-S286 PolarHBondContact O-N 2.65Å; P282-S286 PolarHBondContact O-OG 3.31Å; L283-S286 PolarHBondContact O-N 3.32Å; S286-G290 PolarHBondContact O-N 2.97Å
287F85.8Confident80.6Confident149 Ų14957.6 Ų57.665%0.65435%0.346SS*.Hα-helixtrans-66.2-44.7177-176.1-95.1000112L283 S284 G290 C291L283-F287 WeakPolarHBondContact O-CB 3.46Å; L283-F287 PolarHBondContact O-N 3.17Å; S284-F287 PolarHBondContact O-N 3.16Å; F287-G290 PolarHBondContact O-N 3.22Å; F287-C291 VanDerWaalsContact CE1-SG 3.55Å; F287-C291 PolarHBondContact O-N 3.22Å; F287-C291 PolarHBondContact O-SG 3.28Å
288A84.6Confident80.7Confident48 Ų4858.6 Ų58.640%0.39735%0.35SS..Hα-helixtrans-63.3-43.8176.600000111.6S284 V285 G290 C291 M292S284-A288 WeakPolarHBondContact O-CB 3.43Å; S284-A288 PolarHBondContact O-N 2.6Å; V285-A288 PolarHBondContact O-N 3.02Å; A288-G290 VanDerWaalsContact C-N 3.34Å; A288-C291 WeakPolarHBondContact O-CB 3.43Å; A288-C291 PolarHBondContact O-N 3.44Å; A288-M292 PolarHBondContact O-N 3.23Å; A288-M292 VanDerWaalsContact O-N 3.15Å
289S83.3Confident80.8Confident20 Ų2060.6 Ų60.614%0.1436%0.357CS..Hα-helixtrans-63.2-42175.4-57.10000111.4V285 M292 A293V285-S289 VanDerWaalsContact O-CB 3.26Å; V285-S289 WeakPolarHBondContact O-CB 3.47Å; V285-S289 PolarHBondContact O-N 2.81Å; V285-S289 PolarHBondContact O-OG 3.25Å; S289-M292 PolarHBondContact O-N 3Å; S289-A293 WeakPolarHBondContact O-CB 3.43Å; S289-A293 PolarHBondContact O-N 2.98Å
290G82.1Confident81Confident35 Ų3558.9 Ų58.936%0.36135%0.345SS..Hα-helixtrans-60.4-43.4173.800000112.4S286 F287 A288 M292 A293 L294S286-G290 PolarHBondContact O-N 2.97Å; F287-G290 PolarHBondContact O-N 3.22Å; A288-G290 VanDerWaalsContact C-N 3.34Å; G290-M292 VanDerWaalsContact C-N 3.26Å; G290-M292 PolarHBondContact O-N 3.03Å; G290-A293 PolarHBondContact O-N 3.36Å; G290-L294 WeakPolarHBondContact O-CB 3.44Å; G290-L294 PolarHBondContact O-N 3.49Å
291C80.7Confident80.8Confident66 Ų6655.6 Ų55.645%0.44633%0.329SS..Hα-helixtrans-60.1-34.4174.8-70.70000112.9F287 A288 P295F287-C291 VanDerWaalsContact CE1-SG 3.55Å; F287-C291 PolarHBondContact O-N 3.22Å; F287-C291 PolarHBondContact O-SG 3.28Å; A288-C291 WeakPolarHBondContact O-CB 3.43Å; A288-C291 PolarHBondContact O-N 3.44Å; C291-P295 WeakPolarHBondContact O-CD 3.33Å
292M81.5Confident80.5Confident84 Ų8460.3 Ų60.341%0.41435%0.35SS..Hα-helixtrans-76.1-37.8175.8-67.6-172.6-69.700112.3A288 S289 G290 L328A288-M292 PolarHBondContact O-N 3.23Å; A288-M292 VanDerWaalsContact O-N 3.15Å; S289-M292 PolarHBondContact O-N 3Å; G290-M292 VanDerWaalsContact C-N 3.26Å; G290-M292 PolarHBondContact O-N 3.03Å; M292-L328 HydrophobicContact CB-CD2 4.19Å; M292-L328 HydrophobicContact CE-CB 4.01Å; M292-L328 HydrophobicContact CE-CD2 3.9Å
293A81.6Confident80.1Confident14 Ų1460.3 Ų60.312%0.11635%0.349CS..Hα-helixtrans-76-37.1-178.200000113.3S289 G290 V296 L297 I326S289-A293 WeakPolarHBondContact O-CB 3.43Å; S289-A293 PolarHBondContact O-N 2.98Å; G290-A293 PolarHBondContact O-N 3.36Å; A293-V296 WeakPolarHBondContact O-CB 3.33Å; A293-V296 PolarHBondContact O-N 3.38Å; A293-V296 VanDerWaalsContact O-N 3.09Å; A293-L297 HydrophobicContact CB-CD1 4.41Å; A293-L297 WeakPolarHBondContact O-CG 3.46Å; A293-L297 PolarHBondContact O-N 3.39Å; A293-I326 HydrophobicContact CB-CD1 3.53Å; A293-I326 HydrophobicContact CB-CG2 4.37Å
294L79.4Confident79.2Confident46 Ų4660.2 Ų60.224%0.24135%0.348CS..Hα-helixtrans-56.6-46-170.6179.366.1000113.9I101 V104 G290 V296 L297 M298I101-L294 HydrophobicContact CD1-CD2 4.42Å; I101-L294 HydrophobicContact CG1-CD2 4.23Å; I101-L294 HydrophobicContact CG2-CD1 4.06Å; I101-L294 HydrophobicContact CG2-CD2 3.72Å; V104-L294 HydrophobicContact CB-CD1 4.42Å; V104-L294 HydrophobicContact CG1-CD1 4.44Å; V104-L294 HydrophobicContact CG2-CD1 4.29Å; G290-L294 WeakPolarHBondContact O-CB 3.44Å; G290-L294 PolarHBondContact O-N 3.49Å; L294-V296 VanDerWaalsContact C-N 3.28Å; L294-V296 PolarHBondContact O-N 2.95Å; L294-L297 PolarHBondContact O-N 3.29Å; L294-M298 HydrophobicContact CD1-CG 4.18Å; L294-M298 HydrophobicContact CD1-SD 4.49Å; L294-M298 HydrophobicContact CG-CG 4.41Å; L294-M298 HydrophobicContact CG-SD 4.3Å; L294-M298 WeakPolarHBondContact O-CG 3.39Å; L294-M298 PolarHBondContact O-N 2.98Å
295P78.8Confident78.4Confident67 Ų6762.9 Ų62.944%0.43535%0.354SS..Hα-helixtrans-60.7-36.9177.6-23.634.2000113.1C291 N299C291-P295 WeakPolarHBondContact O-CD 3.33Å; P295-N299 VanDerWaalsContact O-CG 3.28Å; P295-N299 PolarHBondContact O-N 3.16Å; P295-N299 VanDerWaalsContact O-N 3.07Å; P295-N299 PolarHBondContact O-ND2 3.26Å; P295-N299 VanDerWaalsContact O-ND2 3.17Å
296V78.6Confident77.7Confident58 Ų5868.2 Ų68.235%0.35238%0.377SS..Hα-helixtrans-66.9-45.9177.5-179.30000110A293 L294 M298 N299 I300A293-V296 WeakPolarHBondContact O-CB 3.33Å; A293-V296 PolarHBondContact O-N 3.38Å; A293-V296 VanDerWaalsContact O-N 3.09Å; L294-V296 VanDerWaalsContact C-N 3.28Å; L294-V296 PolarHBondContact O-N 2.95Å; V296-M298 PolarHBondContact O-N 3.44Å; V296-N299 PolarHBondContact O-N 2.86Å; V296-I300 HydrophobicContact CG1-CD1 3.86Å; V296-I300 VanDerWaalsContact O-CG1 3.28Å; V296-I300 WeakPolarHBondContact O-CG1 3.49Å; V296-I300 PolarHBondContact O-N 3.11Å
297L77.4Confident76.7Confident60 Ų6073.5 Ų73.531%0.31439%0.385SS..Hα-helixtrans-63.4-41178.4-64.9174.1000112.1V104 A293 L294 I300 K301 I324 I326V104-L297 HydrophobicContact CG1-CB 3.68Å; V104-L297 HydrophobicContact CG1-CD1 4.14Å; A293-L297 HydrophobicContact CB-CD1 4.41Å; A293-L297 WeakPolarHBondContact O-CG 3.46Å; A293-L297 PolarHBondContact O-N 3.39Å; L294-L297 PolarHBondContact O-N 3.29Å; L297-I300 PolarHBondContact O-N 3.45Å; L297-K301 WeakPolarHBondContact O-CB 3.33Å; L297-K301 PolarHBondContact O-N 2.87Å; L297-I324 HydrophobicContact CD2-CD1 3.93Å; L297-I326 HydrophobicContact CD2-CD1 4.49Å
298M76.9Confident75.3Confident59 Ų5974.4 Ų74.429%0.29139%0.391SS..Hα-helixtrans-61.7-46.8175.3-75.1-173.975.500112.2A99 I101 V104 L294 V296 I300 K301 Q302A99-M298 HydrophobicContact CB-CE 3.69Å; I101-M298 HydrophobicContact CG1-SD 4.46Å; V104-M298 HydrophobicContact CG2-CG 3.72Å; L294-M298 HydrophobicContact CD1-CG 4.18Å; L294-M298 HydrophobicContact CD1-SD 4.49Å; L294-M298 HydrophobicContact CG-CG 4.41Å; L294-M298 HydrophobicContact CG-SD 4.3Å; L294-M298 WeakPolarHBondContact O-CG 3.39Å; L294-M298 PolarHBondContact O-N 2.98Å; V296-M298 PolarHBondContact O-N 3.44Å; M298-I300 VanDerWaalsContact C-N 3.3Å; M298-I300 PolarHBondContact O-N 3.4Å; M298-K301 PolarHBondContact O-N 3.33Å; M298-Q302 PolarHBondContact O-N 3.24Å
299N76.8Confident73.9Confident97 Ų9774.9 Ų74.952%0.51939%0.391SS..Hα-helixtrans-60.4-42177.1-74.7-29.9000111.6P295 V296 Q302 V303P295-N299 VanDerWaalsContact O-CG 3.28Å; P295-N299 PolarHBondContact O-N 3.16Å; P295-N299 VanDerWaalsContact O-N 3.07Å; P295-N299 PolarHBondContact O-ND2 3.26Å; P295-N299 VanDerWaalsContact O-ND2 3.17Å; V296-N299 PolarHBondContact O-N 2.86Å; N299-Q302 PolarHBondContact O-N 3Å; N299-V303 WeakPolarHBondContact O-CG2 3.44Å; N299-V303 PolarHBondContact O-N 3.34Å
300I75.3Confident72.4Confident40 Ų4078.7 Ų78.721%0.20542%0.418CS..Hα-helixtrans-64-47178.4-72167.9000110.8V296 L297 M298 Q302 V303 I304 M322 I324V296-I300 HydrophobicContact CG1-CD1 3.86Å; V296-I300 VanDerWaalsContact O-CG1 3.28Å; V296-I300 WeakPolarHBondContact O-CG1 3.49Å; V296-I300 PolarHBondContact O-N 3.11Å; L297-I300 PolarHBondContact O-N 3.45Å; M298-I300 VanDerWaalsContact C-N 3.3Å; M298-I300 PolarHBondContact O-N 3.4Å; I300-Q302 VanDerWaalsContact C-N 3.3Å; I300-Q302 PolarHBondContact O-N 3.39Å; I300-V303 PolarHBondContact O-N 3.2Å; I300-I304 HydrophobicContact CG2-CD1 3.65Å; I300-I304 HydrophobicContact CG2-CG1 4.38Å; I300-I304 VanDerWaalsContact O-CG1 3.3Å; I300-I304 WeakPolarHBondContact O-CG1 3.48Å; I300-I304 PolarHBondContact O-N 3.07Å; I300-M322 HydrophobicContact CD1-CE 4.02Å; I300-M322 HydrophobicContact CG1-CE 4.49Å; I300-M322 HydrophobicContact CG2-CE 3.66Å; I300-M322 HydrophobicContact CG2-SD 4.08Å; I300-I324 HydrophobicContact CD1-CD1 3.49Å; I300-I324 VanDerWaalsContact CD1-CD1 3.49Å; I300-I324 HydrophobicContact CD1-CG1 4.24Å; I300-I324 HydrophobicContact CD1-CG2 4.25Å
301K71.8Confident70.8Confident39 Ų3979.7 Ų79.717%0.1743%0.427CS..Hα-helixtrans-54-49.9175.4-180-174.7167.3-175.30110.7E100 A103 V104 L297 M298 V303 I304 E305E100-K301 IonicContact OE2-NZ 3.4Å; A103-K301 PolarHBondContact O-NZ 3.42Å; V104-K301 HydrophobicContact CG2-CD 4.39Å; L297-K301 WeakPolarHBondContact O-CB 3.33Å; L297-K301 PolarHBondContact O-N 2.87Å; M298-K301 PolarHBondContact O-N 3.33Å; K301-V303 VanDerWaalsContact C-N 3.31Å; K301-V303 PolarHBondContact O-N 3.21Å; K301-I304 PolarHBondContact O-N 2.85Å; K301-I304 VanDerWaalsContact O-N 3.09Å; K301-E305 WeakPolarHBondContact CE-OE1 3.42Å; K301-E305 HydrophobicContact CG-CG 4.48Å; K301-E305 IonicContact NZ-OE1 3.16Å; K301-E305 WeakPolarHBondContact O-CG 3.33Å; K301-E305 PolarHBondContact O-N 3.03Å
302Q73.7Confident69.2Low108 Ų10881.3 Ų81.351%0.50544%0.435SS..Hα-helixtrans-60.3-40.2-178.6-154.5178.819.800112.2M298 N299 I300 Q306M298-Q302 PolarHBondContact O-N 3.24Å; N299-Q302 PolarHBondContact O-N 3Å; I300-Q302 VanDerWaalsContact C-N 3.3Å; I300-Q302 PolarHBondContact O-N 3.39Å; Q302-Q306 WeakPolarHBondContact O-CB 3.4Å; Q302-Q306 WeakPolarHBondContact O-CG 3.49Å; Q302-Q306 PolarHBondContact O-N 2.64Å
303V73.2Confident67.6Low62 Ų6284.1 Ų84.138%0.37644%0.441SS..Hα-helixtrans-66.9-38.5175.6171.60000112N299 I300 K301 R307N299-V303 WeakPolarHBondContact O-CG2 3.44Å; N299-V303 PolarHBondContact O-N 3.34Å; I300-V303 PolarHBondContact O-N 3.2Å; K301-V303 VanDerWaalsContact C-N 3.31Å; K301-V303 PolarHBondContact O-N 3.21Å; V303-R307 HydrophobicContact CG1-CG 4.46Å; V303-R307 WeakPolarHBondContact O-CB 3.41Å; V303-R307 VanDerWaalsContact O-CG 3.26Å; V303-R307 WeakPolarHBondContact O-CG 3.48Å; V303-R307 PolarHBondContact O-N 3.2Å
304I67.3Low65.6Low47 Ų4788 Ų8824%0.24146%0.464CS..Hα-helixtrans-67.5-44.7179.2-69.5168.6000110.8I300 K301 R307 Q308 C309I300-I304 HydrophobicContact CG2-CD1 3.65Å; I300-I304 HydrophobicContact CG2-CG1 4.38Å; I300-I304 VanDerWaalsContact O-CG1 3.3Å; I300-I304 WeakPolarHBondContact O-CG1 3.48Å; I300-I304 PolarHBondContact O-N 3.07Å; K301-I304 PolarHBondContact O-N 2.85Å; K301-I304 VanDerWaalsContact O-N 3.09Å; I304-R307 PolarHBondContact O-N 3.43Å; I304-Q308 PolarHBondContact O-N 3.25Å; I304-C309 HydrophobicContact CG2-CB 4.42Å; I304-C309 PolarHBondContact O-N 2.9Å
305E68.4Low63.8Low116 Ų11693.5 Ų93.554%0.54249%0.488SS..Hα-helixtrans-63-43.3177.2-72.4176.3160.800111.6K301 R307 Q308K301-E305 WeakPolarHBondContact CE-OE1 3.42Å; K301-E305 HydrophobicContact CG-CG 4.48Å; K301-E305 IonicContact NZ-OE1 3.16Å; K301-E305 WeakPolarHBondContact O-CG 3.33Å; K301-E305 PolarHBondContact O-N 3.03Å; E305-R307 VanDerWaalsContact C-N 3.31Å; E305-R307 PolarHBondContact O-N 3.14Å; E305-Q308 PolarHBondContact O-N 3.42Å
306Q69.3Low62.1Low140 Ų140100.4 Ų100.465%0.65451%0.511SS*.Hα-helixtrans-65-32.5176.3-74.5173.56.400113.2Q302Q302-Q306 WeakPolarHBondContact O-CB 3.4Å; Q302-Q306 WeakPolarHBondContact O-CG 3.49Å; Q302-Q306 PolarHBondContact O-N 2.64Å
307R65Low60.4Low188 Ų188105.1 Ų105.171%0.70953%0.534SS*.THydrogen-bonded Turntrans-87.70.6-178.7-71.2-177.5-177.4-163.23.2114.2V303 I304 E305 C309V303-R307 HydrophobicContact CG1-CG 4.46Å; V303-R307 WeakPolarHBondContact O-CB 3.41Å; V303-R307 VanDerWaalsContact O-CG 3.26Å; V303-R307 WeakPolarHBondContact O-CG 3.48Å; V303-R307 PolarHBondContact O-N 3.2Å; I304-R307 PolarHBondContact O-N 3.43Å; E305-R307 VanDerWaalsContact C-N 3.31Å; E305-R307 PolarHBondContact O-N 3.14Å; R307-C309 PolarHBondContact O-N 3.22Å; R307-C309 VanDerWaalsContact O-N 3.16Å
308Q56.6Low58.6Low169 Ų169108.5 Ų108.579%0.7955%0.548SS*.THydrogen-bonded Turntrans51.534-177.9-62.3-175-11.700113.7I304 E305 S310I304-Q308 PolarHBondContact O-N 3.25Å; E305-Q308 PolarHBondContact O-N 3.42Å; Q308-S310 PolarHBondContact O-N 2.94Å; Q308-S310 PolarHBondContact O-OG 3.48Å
309C54.1Low57Low58 Ų58111.1 Ų111.139%0.39256%0.563SS.*  trans-80.649.8175.3-68.10000111.4I304 R307 G311 V312I304-C309 HydrophobicContact CG2-CB 4.42Å; I304-C309 PolarHBondContact O-N 2.9Å; R307-C309 PolarHBondContact O-N 3.22Å; R307-C309 VanDerWaalsContact O-N 3.16Å; C309-G311 PolarHBondContact O-N 3.31Å; C309-G311 VanDerWaalsContact O-N 3.16Å; C309-V312 HydrophobicContact CB-CG2 4.44Å; C309-V312 PolarHBondContact O-N 3.44Å
310S51.7Low55.4Low100 Ų100108.7 Ų108.770%0.69955%0.553SS**G310 helixtrans-66.1-14-176.738.20000113.9Q308Q308-S310 PolarHBondContact O-N 2.94Å; Q308-S310 PolarHBondContact O-OG 3.48Å
311G48Very low53.7Low55 Ų55113.5 Ų113.557%0.56757%0.574SS**G310 helixtrans-77-16.917700000115.7C309 W313 T314C309-G311 PolarHBondContact O-N 3.31Å; C309-G311 VanDerWaalsContact O-N 3.16Å; G311-W313 VanDerWaalsContact C-N 3.31Å; G311-W313 PolarHBondContact O-N 2.95Å; G311-T314 PolarHBondContact O-OG1 3.41Å
312V47.5Very low52.4Low101 Ų101116.7 Ų116.761%0.61259%0.591SS**G310 helixtrans-81.9-11.6-177.2-175.40000112.5C309C309-V312 HydrophobicContact CB-CG2 4.44Å; C309-V312 PolarHBondContact O-N 3.44Å
313W47.6Very low51.3Low142 Ų142120.4 Ų120.454%0.53861%0.605SS.*G310 helixtrans-109.423-175.3-92.559.8000113.5G311 H315G311-W313 VanDerWaalsContact C-N 3.31Å; G311-W313 PolarHBondContact O-N 2.95Å; W313-H315 PolarHBondContact O-N 2.85Å
314T39.9Very low50.7Low97 Ų97119.9 Ų119.960%0.59560%0.6SS**  trans-96.427.3-168.945.90000116.1G311G311-T314 PolarHBondContact O-OG1 3.41Å
315H41.4Very low50.4Low160 Ų160126.9 Ų126.974%0.74163%0.631SS**  trans-129.7111.5161.7-75.9-73.5000110.7W313 D317 E318W313-H315 PolarHBondContact O-N 2.85Å; H315-D317 PolarHBondContact O-N 3.38Å; H315-E318 PolarHBondContact O-N 2.99Å
316K44Very low50.5Low212 Ų212123.6 Ų123.692%0.92262%0.617SS**THydrogen-bonded Turntrans-64.3-4.4-169.4-82.5-177.3169.8-175.80116.1
317D42.7Very low50.8Low157 Ų157123.3 Ų123.384%0.8462%0.62SS**THydrogen-bonded Turntrans-118.6-1.8-174.1-66.8-45.5000114.2H315H315-D317 PolarHBondContact O-N 3.38Å
318E39.6Very low51Low131 Ų131117.2 Ų117.261%0.61260%0.601SS**SBendtrans-141.6112.2177.2-63.5-176.6-176.400108H315 P320 H321H315-E318 PolarHBondContact O-N 2.99Å; E318-P320 VanDerWaalsContact O-N 3.14Å; E318-H321 IonicContact OE2-CE1 2.68Å; E318-H321 PolarHBondContact OE2-CE1 3.19Å
319L43Very low51.8Low114 Ų114110.4 Ų110.460%0.59758%0.576SS**  trans-42.9127.5157.7-83.8143.6000106.3H321L319-H321 PolarHBondContact O-N 3.2Å; L319-H321 VanDerWaalsContact O-N 3.08Å
320P42.8Very low52.6Low46 Ų46115.5 Ų115.530%0.29959%0.592SS.*  trans-51.2131178.119-28.3000106.1E318 M322E318-P320 VanDerWaalsContact O-N 3.14Å; P320-M322 PolarHBondContact O-N 3.44Å
321H41.4Very low53.3Low141 Ų141120 Ų12065%0.65360%0.599SS**  trans-63.156.3176.8-71.242.8000110.2E318 L319 K323E318-H321 IonicContact OE2-CE1 2.68Å; E318-H321 PolarHBondContact OE2-CE1 3.19Å; L319-H321 PolarHBondContact O-N 3.2Å; L319-H321 VanDerWaalsContact O-N 3.08Å; H321-K323 PolarHBondContact O-N 3.26Å
322M44.3Very low54.1Low106 Ų106119 Ų11952%0.52258%0.583SS.*  trans-7284.1166.7-146.8176.1151.100103.2I300 P320 I324I300-M322 HydrophobicContact CD1-CE 4.02Å; I300-M322 HydrophobicContact CG1-CE 4.49Å; I300-M322 HydrophobicContact CG2-CE 3.66Å; I300-M322 HydrophobicContact CG2-SD 4.08Å; P320-M322 PolarHBondContact O-N 3.44Å; M322-I324 HydrophobicContact CB-CD1 4.14Å; M322-I324 HydrophobicContact CB-CG1 3.97Å; M322-I324 HydrophobicContact CE-CD1 3.7Å; M322-I324 HydrophobicContact CE-CG1 3.71Å; M322-I324 HydrophobicContact CG-CD1 3.89Å; M322-I324 HydrophobicContact CG-CG1 3.56Å; M322-I324 PolarHBondContact O-N 3.41Å; M322-I324 HydrophobicContact SD-CD1 3.78Å; M322-I324 HydrophobicContact SD-CG1 4.03Å
323K49.4Very low55.2Low187 Ų187122.9 Ų122.981%0.81359%0.587SS**  trans-64.275163.7-65.8-178.3-179.9-177.10106.2H321 E325H321-K323 PolarHBondContact O-N 3.26Å; K323-E325 PolarHBondContact O-N 3.09Å
324I60Low56.2Low50 Ų50121.7 Ų121.726%0.25658%0.583SS.*  trans-79109.2171-56.7160.5000103.7L297 I300 M322 I326L297-I324 HydrophobicContact CD2-CD1 3.93Å; I300-I324 HydrophobicContact CD1-CD1 3.49Å; I300-I324 VanDerWaalsContact CD1-CD1 3.49Å; I300-I324 HydrophobicContact CD1-CG1 4.24Å; I300-I324 HydrophobicContact CD1-CG2 4.25Å; M322-I324 HydrophobicContact CB-CD1 4.14Å; M322-I324 HydrophobicContact CB-CG1 3.97Å; M322-I324 HydrophobicContact CE-CD1 3.7Å; M322-I324 HydrophobicContact CE-CG1 3.71Å; M322-I324 HydrophobicContact CG-CD1 3.89Å; M322-I324 HydrophobicContact CG-CG1 3.56Å; M322-I324 PolarHBondContact O-N 3.41Å; M322-I324 HydrophobicContact SD-CD1 3.78Å; M322-I324 HydrophobicContact SD-CG1 4.03Å; I324-I326 VanDerWaalsContact C-N 3.35Å; I324-I326 HydrophobicContact CB-CG1 4.36Å; I324-I326 HydrophobicContact CG2-CG1 3.83Å; I324-I326 PolarHBondContact O-N 3.47Å
325E62.7Low57.5Low194 Ų194124.7 Ų124.791%0.90759%0.59SS**  trans-68.6100.4169.8-68.3-176.5174.600107.3K323K323-E325 PolarHBondContact O-N 3.09Å
326I70.7Confident58.7Low47 Ų47120.8 Ų120.824%0.24158%0.581CS.*  trans-92.8113.8171.4-57.3177.4000105.8A293 L297 I324 L328A293-I326 HydrophobicContact CB-CD1 3.53Å; A293-I326 HydrophobicContact CB-CG2 4.37Å; L297-I326 HydrophobicContact CD2-CD1 4.49Å; I324-I326 VanDerWaalsContact C-N 3.35Å; I324-I326 HydrophobicContact CB-CG1 4.36Å; I324-I326 HydrophobicContact CG2-CG1 3.83Å; I324-I326 PolarHBondContact O-N 3.47Å; I326-L328 HydrophobicContact CG2-CD2 3.91Å; I326-L328 PolarHBondContact O-N 3.23Å
327D74.1Confident60.1Low135 Ų135114.9 Ų114.972%0.72256%0.562SS**  trans-71.498.9174.9-172.95.5000109.3G329D327-G329 PolarHBondContact O-N 3Å; D327-G329 WeakPolarHBondContact OD1-CA 3.49Å; D327-G329 PolarHBondContact OD1-N 3.47Å
328L70.5Confident61.9Low59 Ų59109.1 Ų109.131%0.30953%0.53SS..  trans-78.7-0.3175.6-57.8174000112.1M292 I326 C332M292-L328 HydrophobicContact CB-CD2 4.19Å; M292-L328 HydrophobicContact CE-CB 4.01Å; M292-L328 HydrophobicContact CE-CD2 3.9Å; I326-L328 HydrophobicContact CG2-CD2 3.91Å; I326-L328 PolarHBondContact O-N 3.23Å; L328-C332 HydrophobicContact CB-CB 4.14Å
329G72.6Confident63.9Low26 Ų26105.8 Ų105.827%0.26852%0.524SS..  trans77.4167.2-178.500000114D327 K331 C332D327-G329 PolarHBondContact O-N 3Å; D327-G329 WeakPolarHBondContact OD1-CA 3.49Å; D327-G329 PolarHBondContact OD1-N 3.47Å; G329-K331 PolarHBondContact O-N 3.27Å; G329-K331 VanDerWaalsContact O-N 3.09Å; G329-C332 PolarHBondContact O-N 3.05Å
330K69.9Low65.8Low166 Ų166100.4 Ų100.472%0.72250%0.496SS*.G310 helixtrans-64.6-15.3-174.3-62-176.7-179.9-179.20114.8C332 W333K330-C332 VanDerWaalsContact C-N 3.29Å; K330-W333 HydrophobicContact CB-CD2 4.41Å; K330-W333 HydrophobicContact CG-CD2 4.4Å; K330-W333 HydrophobicContact CG-CE3 4.37Å; K330-W333 HydrophobicContact CG-CH2 4.18Å; K330-W333 HydrophobicContact CG-CZ2 4.18Å; K330-W333 HydrophobicContact CG-CZ3 4.27Å; K330-W333 WeakPolarHBondContact O-CB 3.38Å; K330-W333 PolarHBondContact O-N 2.92Å
331K67.1Low67.5Low195 Ų195100.8 Ų100.885%0.84850%0.499SS*.G310 helixtrans-72-24.8-179.8-67.1-175.7178.9-177.90112.5G329 W333G329-K331 PolarHBondContact O-N 3.27Å; G329-K331 VanDerWaalsContact O-N 3.09Å; K331-W333 VanDerWaalsContact C-N 3.32Å
332C65.8Low69.5Low34 Ų3497 Ų9723%0.2348%0.483CS..G310 helixtrans-94.213.7177.9-60.40000112.7L328 G329 K330 Y334L328-C332 HydrophobicContact CB-CB 4.14Å; G329-C332 PolarHBondContact O-N 3.05Å; K330-C332 VanDerWaalsContact C-N 3.29Å; C332-Y334 HydrophobicContact CB-CE2 4.11Å; C332-Y334 WeakPolarHBondContact O-CD2 3.39Å; C332-Y334 WeakPolarHBondContact O-CE2 3.45Å; C332-Y334 PolarHBondContact O-N 3.17Å
333W69.5Low71.2Confident182 Ų18293.8 Ų93.869%0.68947%0.468SS*.  trans-88.586.7177.5-68.19000109.8K330 K331K330-W333 HydrophobicContact CB-CD2 4.41Å; K330-W333 HydrophobicContact CG-CD2 4.4Å; K330-W333 HydrophobicContact CG-CE3 4.37Å; K330-W333 HydrophobicContact CG-CH2 4.18Å; K330-W333 HydrophobicContact CG-CZ2 4.18Å; K330-W333 HydrophobicContact CG-CZ3 4.27Å; K330-W333 WeakPolarHBondContact O-CB 3.38Å; K330-W333 PolarHBondContact O-N 2.92Å; K331-W333 VanDerWaalsContact C-N 3.32Å
334Y67.9Low72.7Confident116 Ų11695.5 Ų95.546%0.45547%0.469SS..  trans-90-27.1-178.7-56.9-76.6000113.1E280 V285 C332E280-Y334 PolarHBondContact OE2-OH 3.12Å; V285-Y334 HydrophobicContact CG1-CE2 3.88Å; V285-Y334 VanDerWaalsContact CG1-OH 3.32Å; V285-Y334 WeakPolarHBondContact CG1-OH 3.42Å; V285-Y334 WeakPolarHBondContact CG2-OH 3.33Å; C332-Y334 HydrophobicContact CB-CE2 4.11Å; C332-Y334 WeakPolarHBondContact O-CD2 3.39Å; C332-Y334 WeakPolarHBondContact O-CE2 3.45Å; C332-Y334 PolarHBondContact O-N 3.17Å
335H67.6Low73.6Confident160 Ų16098.7 Ų98.774%0.74148%0.483SS*.SBendtrans-137.4132.1-177.4-56.294.2000110.4V337H335-V337 HydrophobicContact CB-CG2 4.29Å; H335-V337 PolarHBondContact O-N 3.01Å; H335-V337 VanDerWaalsContact O-N 3.16Å
336S68.1Low74.5Confident79 Ų7995.6 Ų95.655%0.55247%0.468SS*.  trans-75.4101.4168.8-65.40000109
337V71.7Confident75Confident87 Ų8794.3 Ų94.353%0.52746%0.463SS..  trans-99.1123.1177.3178.20000109.4H335 Q346H335-V337 HydrophobicContact CB-CG2 4.29Å; H335-V337 PolarHBondContact O-N 3.01Å; H335-V337 VanDerWaalsContact O-N 3.16Å; V337-Q346 VanDerWaalsContact CG1-CD 3.4Å; V337-Q346 HydrophobicContact CG1-CG 3.65Å; V337-Q346 VanDerWaalsContact CG1-NE2 3.27Å
338F80.4Confident75.4Confident37 Ų3790.5 Ų90.516%0.16245%0.447CS..  trans-105.5123.6170.1178.9-97000110.2C340 T347 P353 V361 F395F338-C340 HydrophobicContact CE1-CB 4.34Å; F338-T347 HydrophobicContact CD1-CG2 3.57Å; F338-T347 HydrophobicContact CE1-CG2 4.12Å; F338-T347 PolarHBondContact O-N 3.36Å; F338-T347 PolarHBondContact O-OG1 2.98Å; F338-P353 HydrophobicContact CB-CB 4.38Å; F338-P353 HydrophobicContact CD1-CB 3.68Å; F338-P353 HydrophobicContact CE1-CB 4.2Å; F338-P353 HydrophobicContact CG-CB 4.1Å; F338-V361 HydrophobicContact CD1-CG1 4.38Å; F338-V361 HydrophobicContact CD2-CG1 4.32Å; F338-V361 HydrophobicContact CE1-CG1 3.86Å; F338-V361 HydrophobicContact CE2-CB 3.86Å; F338-V361 HydrophobicContact CE2-CG1 3.81Å; F338-V361 HydrophobicContact CZ-CB 3.79Å; F338-V361 HydrophobicContact CZ-CG1 3.57Å; F338-V361 WeakPolarHBondContact CZ-O 3.42Å; F338-F395 HydrophobicContact CB-CD2 4.49Å; F338-F395 HydrophobicContact CB-CE2 3.6Å; F338-F395 HydrophobicContact CB-CZ 4.05Å; F338-F395 HydrophobicContact CD2-CZ 4.4Å; F338-F395 HydrophobicContact CG-CE2 4.25Å; F338-F395 HydrophobicContact CG-CZ 4.44Å
339A82.4Confident75.9Confident60 Ų6096.9 Ų96.950%0.49648%0.475SS..EExtended strand (participates in β ladder)trans-98.5124169.100000108.9P341A339-P341 WeakPolarHBondContact O-CD 3.29Å
340C81.9Confident76.4Confident1 Ų199.7 Ų99.71%0.00749%0.49CS..EExtended strand (participates in β ladder)trans-64.2123.2175.6-179.90000109.4F338 I342 L343 R344 Q345 S363 A366F338-C340 HydrophobicContact CE1-CB 4.34Å; C340-I342 PolarHBondContact O-N 3.3Å; C340-L343 HydrophobicContact CB-CB 4.35Å; C340-R344 WeakPolarHBondContact O-CA 3.37Å; C340-R344 PolarHBondContact O-N 3.28Å; C340-Q345 PolarHBondContact N-O 2.96Å; C340-S363 PolarHBondContact SG-N 3.47Å; C340-S363 VanDerWaalsContact SG-N 3.36Å; C340-A366 VanDerWaalsContact SG-CB 3.6Å
341P80.3Confident77Confident55 Ų5592.2 Ų92.236%0.35746%0.458SS..THydrogen-bonded Turntrans-77.1-13.1-174.334.6-40.2000112.8A339 Y380A339-P341 WeakPolarHBondContact O-CD 3.29Å; P341-Y380 WeakPolarHBondContact CB-OH 3.22Å; P341-Y380 HydrophobicContact CG-CE2 3.83Å; P341-Y380 WeakPolarHBondContact CG-OH 3.45Å
342I82.3Confident77.9Confident62 Ų6283 Ų8332%0.31842%0.419SS..THydrogen-bonded Turntrans-86.3-50.9175.9-53.7-56.9000111.3C340 R344 I362 A366 L370 P379 Y380C340-I342 PolarHBondContact O-N 3.3Å; I342-R344 VanDerWaalsContact C-N 3.33Å; I342-I362 HydrophobicContact CG1-CG2 4.14Å; I342-A366 HydrophobicContact CB-CB 4.25Å; I342-L370 HydrophobicContact CG1-CD1 4.36Å; I342-L370 HydrophobicContact CG2-CD1 4.35Å; I342-P379 HydrophobicContact CD1-CB 3.64Å; I342-P379 HydrophobicContact CD1-CG 3.42Å; I342-P379 VanDerWaalsContact CD1-CG 3.42Å; I342-P379 HydrophobicContact CG1-CG 3.92Å; I342-Y380 HydrophobicContact CD1-CE2 4.13Å
343L80.6Confident79Confident38 Ų3882 Ų8220%0.19941%0.411CS..THydrogen-bonded Turntrans-83.9-12.4179.2-65.6-179.9000113C340 Q345 D365 A366 K369C340-L343 HydrophobicContact CB-CB 4.35Å; L343-Q345 HydrophobicContact CB-CB 4.29Å; L343-Q345 WeakPolarHBondContact O-CG 3.32Å; L343-Q345 PolarHBondContact O-N 3.18Å; L343-D365 HydrophobicContact CD1-CB 3.75Å; L343-A366 HydrophobicContact CD1-CB 4.02Å; L343-A366 HydrophobicContact CG-CB 3.98Å; L343-K369 HydrophobicContact CD2-CD 4.08Å
344R81.1Confident79.9Confident223 Ų22374.2 Ų74.284%0.84238%0.383SS*.THydrogen-bonded Turntrans52.633.6-174.1-56.7-179179.2-177.5-1112.4C340 I342C340-R344 WeakPolarHBondContact O-CA 3.37Å; C340-R344 PolarHBondContact O-N 3.28Å; I342-R344 VanDerWaalsContact C-N 3.33Å
345Q79.3Confident81Confident116 Ų11673.7 Ų73.754%0.54238%0.383SS..EExtended strand (participates in β ladder)trans-123.9144.3-177.5-75.2174.4-5.900109.8C340 L343C340-Q345 PolarHBondContact N-O 2.96Å; L343-Q345 HydrophobicContact CB-CB 4.29Å; L343-Q345 WeakPolarHBondContact O-CG 3.32Å; L343-Q345 PolarHBondContact O-N 3.18Å
346Q81.5Confident82Confident129 Ų12966.2 Ų66.260%0.60335%0.348SS*.EExtended strand (participates in β ladder)trans-66.1136.8173.5179.4169.9-3.200110.7V337V337-Q346 VanDerWaalsContact CG1-CD 3.4Å; V337-Q346 HydrophobicContact CG1-CG 3.65Å; V337-Q346 VanDerWaalsContact CG1-NE2 3.27Å
347T80.9Confident83Confident21 Ų2166.7 Ų66.713%0.12934%0.344CS..  trans-73.8146.1174.549.50000111.8F338 N351 P353F338-T347 HydrophobicContact CD1-CG2 3.57Å; F338-T347 HydrophobicContact CE1-CG2 4.12Å; F338-T347 PolarHBondContact O-N 3.36Å; F338-T347 PolarHBondContact O-OG1 2.98Å; T347-N351 WeakPolarHBondContact CA-O 3.39Å; T347-N351 WeakPolarHBondContact CB-O 3.45Å; T347-N351 VanDerWaalsContact CG2-O 3.24Å; T347-N351 WeakPolarHBondContact CG2-O 3.26Å; T347-P353 HydrophobicContact CG2-CB 4.34Å
348S81.6Confident83.7Confident55 Ų5564.1 Ų64.139%0.38533%0.33SS..BIsolated β-bridgetrans-123.3175.2178.160.80000110.4S350 N351 P352S348-S350 PolarHBondContact O-N 3.38Å; S348-S350 PolarHBondContact OG-N 3.49Å; S348-S350 PolarHBondContact OG-OG 2.9Å; S348-N351 PolarHBondContact N-O 2.96Å; S348-N351 CarbonylContact O-C 2.98Å; S348-N351 PolarHBondContact O-N 3.2Å; S348-N351 PolarHBondContact OG-N 2.84Å; S348-P352 WeakPolarHBondContact O-CA 3.27Å; S348-P352 VanDerWaalsContact O-N 3.11Å
349E80.6Confident83.9Confident193 Ų19364.2 Ų64.290%0.90234%0.341SS*.THydrogen-bonded Turntrans-58.8-33.9171.4-64.2-174.617200112.4
350S82.9Confident84.1Confident84 Ų8464.7 Ų64.759%0.58733%0.333SS*.THydrogen-bonded Turntrans-78.1-18.5174.259.70000113.7S348 R364S348-S350 PolarHBondContact O-N 3.38Å; S348-S350 PolarHBondContact OG-N 3.49Å; S348-S350 PolarHBondContact OG-OG 2.9Å; S350-R364 PolarHBondContact O-NH2 3.28Å
351N84.1Confident84.3Confident9 Ų966.1 Ų66.15%0.04834%0.341CS..BIsolated β-bridgetrans-135.969.1177.8-17216.5000110.8T347 S348 S363 R364 D365T347-N351 WeakPolarHBondContact CA-O 3.39Å; T347-N351 WeakPolarHBondContact CB-O 3.45Å; T347-N351 VanDerWaalsContact CG2-O 3.24Å; T347-N351 WeakPolarHBondContact CG2-O 3.26Å; S348-N351 PolarHBondContact N-O 2.96Å; S348-N351 CarbonylContact O-C 2.98Å; S348-N351 PolarHBondContact O-N 3.2Å; S348-N351 PolarHBondContact OG-N 2.84Å; N351-S363 PolarHBondContact ND2-OG 2.99Å; N351-S363 VanDerWaalsContact OD1-CB 3.26Å; N351-S363 WeakPolarHBondContact OD1-CB 3.29Å; N351-S363 PolarHBondContact OD1-OG 3.26Å; N351-R364 PolarHBondContact OD1-N 3.14Å; N351-D365 PolarHBondContact ND2-OD2 2.63Å; N351-D365 PolarHBondContact OD1-N 3.49Å; N351-D365 PolarHBondContact OD1-OD2 2.99Å
352P86.3Confident84.7Confident3 Ų363.5 Ų63.52%0.01932%0.324CS..  trans-73.1160.4-169.929.8-36.5000112.3S348 M354 R364 Q392S348-P352 WeakPolarHBondContact O-CA 3.27Å; S348-P352 VanDerWaalsContact O-N 3.11Å; P352-M354 HydrophobicContact CG-SD 4.41Å; P352-R364 HydrophobicContact CG-CB 4.33Å; P352-R364 PolarHBondContact O-N 3.45Å; P352-Q392 HydrophobicContact CB-CG 3.94Å; P352-Q392 HydrophobicContact CG-CG 4.22Å
353P88.8Confident85.1Confident11 Ų1160.6 Ų60.67%0.07131%0.309CS..EExtended strand (participates in β ladder)trans-68.9127.7171.528.9-33.2000110.8F338 T347 V361 I393 F395F338-P353 HydrophobicContact CB-CB 4.38Å; F338-P353 HydrophobicContact CD1-CB 3.68Å; F338-P353 HydrophobicContact CE1-CB 4.2Å; F338-P353 HydrophobicContact CG-CB 4.1Å; T347-P353 HydrophobicContact CG2-CB 4.34Å; P353-V361 HydrophobicContact CB-CG1 3.78Å; P353-I393 HydrophobicContact CG-CB 4.4Å; P353-I393 PolarHBondContact O-N 3.07Å; P353-F395 HydrophobicContact CB-CE2 3.96Å; P353-F395 HydrophobicContact CG-CD2 3.96Å; P353-F395 HydrophobicContact CG-CE2 3.58Å
354M87.9Confident85.4Confident20 Ų2063.4 Ų63.410%0.09932%0.317CS..EExtended strand (participates in β ladder)trans-114.9121.6-177.7-59.8-62.9-68.900110P352 V361 I362 R364 L367 A390 Q392P352-M354 HydrophobicContact CG-SD 4.41Å; M354-V361 WeakPolarHBondContact O-CA 3.45Å; M354-I362 WeakPolarHBondContact CA-O 3.46Å; M354-I362 WeakPolarHBondContact CB-O 3.48Å; M354-I362 PolarHBondContact N-O 2.84Å; M354-I362 PolarHBondContact O-N 3.44Å; M354-R364 HydrophobicContact CG-CB 3.95Å; M354-L367 HydrophobicContact CB-CD2 4.45Å; M354-L367 HydrophobicContact CE-CD2 4.16Å; M354-L367 HydrophobicContact CG-CD2 4.3Å; M354-A390 HydrophobicContact CB-CB 4.39Å; M354-A390 HydrophobicContact CE-CB 3.9Å; M354-A390 WeakPolarHBondContact CE-O 3.34Å; M354-Q392 HydrophobicContact SD-CB 3.89Å; M354-Q392 HydrophobicContact SD-CG 4.43Å
355K90.4Very high85.8Confident104 Ų10455.9 Ų55.945%0.45229%0.294SS..EExtended strand (participates in β ladder)trans-82.9125.6173.7-166.2177.3172.7177.60110.7A390 K391 I393K355-A390 VanDerWaalsContact O-CA 3.27Å; K355-A390 WeakPolarHBondContact O-CA 3.44Å; K355-K391 WeakPolarHBondContact CB-O 3.28Å; K355-K391 PolarHBondContact N-O 3.07Å; K355-K391 PolarHBondContact O-N 2.97Å; K355-I393 HydrophobicContact CB-CD1 3.63Å; K355-I393 HydrophobicContact CB-CG1 3.84Å; K355-I393 HydrophobicContact CD-CD1 4.29Å; K355-I393 HydrophobicContact CG-CD1 4.17Å
356L89.3Confident86.1Confident4 Ų450.3 Ų50.32%0.02127%0.268CS..  trans-80.3160.3170.3-47.2-175.3000110.3C358 G359 H360 I362 L367 L376 C378 A390L356-C358 PolarHBondContact O-N 3.4Å; L356-C358 VanDerWaalsContact O-N 3.15Å; L356-G359 PolarHBondContact O-N 3.06Å; L356-H360 HydrophobicContact CD1-CB 4.47Å; L356-H360 WeakPolarHBondContact CG-O 3.44Å; L356-H360 PolarHBondContact N-O 3.26Å; L356-I362 HydrophobicContact CD1-CD1 4.26Å; L356-I362 HydrophobicContact CD2-CD1 3.91Å; L356-I362 HydrophobicContact CD2-CG1 3.97Å; L356-I362 HydrophobicContact CG-CG1 4.41Å; L356-L367 HydrophobicContact CD2-CD1 3.65Å; L356-L376 HydrophobicContact CD1-CD2 4.13Å; L356-L376 HydrophobicContact CD2-CD2 3.55Å; L356-L376 HydrophobicContact CG-CD2 4.45Å; L356-C378 HydrophobicContact CD1-CB 4Å; L356-A390 HydrophobicContact CD2-CB 4.41Å
357I87.8Confident86.3Confident88 Ų8844.5 Ų44.545%0.45124%0.241SC..THydrogen-bonded Turntrans-59-27.8177.468.9-177000112.4G359 M383 Q385 H389I357-G359 PolarHBondContact O-N 3.49Å; I357-M383 HydrophobicContact CD1-CE 3.94Å; I357-M383 HydrophobicContact CG1-CE 3.96Å; I357-Q385 HydrophobicContact CD1-CB 3.62Å; I357-Q385 HydrophobicContact CG1-CB 4.05Å; I357-Q385 VanDerWaalsContact CG1-OE1 3.25Å; I357-H389 HydrophobicContact CG2-CB 3.84Å
358C87.9Confident86.6Confident34 Ų3448.1 Ų48.123%0.2326%0.259CS..THydrogen-bonded Turntrans-76.1-4.2176.269.80000113.5L356 H360 C378 C381 M383L356-C358 PolarHBondContact O-N 3.4Å; L356-C358 VanDerWaalsContact O-N 3.15Å; C358-H360 PolarHBondContact SG-ND1 3.29Å; C358-H360 VanDerWaalsContact SG-ND1 3.35Å; C358-C378 VanDerWaalsContact SG-SG 3.64Å; C358-C381 VanDerWaalsContact CB-SG 3.54Å; C358-M383 HydrophobicContact CB-CB 4.21Å; C358-M383 HydrophobicContact CB-CG 4.38Å; C358-M383 HydrophobicContact CB-SD 3.55Å; C358-M383 VanDerWaalsContact CB-SD 3.55Å
359G83.3Confident86.8Confident39 Ų3953 Ų5340%0.40227%0.274SS..SBendtrans92.5-12.4179.500000115.8L356 I357L356-G359 PolarHBondContact O-N 3.06Å; I357-G359 PolarHBondContact O-N 3.49Å
360H86.4Confident87Confident69 Ų6946.8 Ų46.832%0.31925%0.246SC..  trans-71.3150.4174.6-66.8117.3000111.5L356 C358 C378 Y380L356-H360 HydrophobicContact CD1-CB 4.47Å; L356-H360 WeakPolarHBondContact CG-O 3.44Å; L356-H360 PolarHBondContact N-O 3.26Å; C358-H360 PolarHBondContact SG-ND1 3.29Å; C358-H360 VanDerWaalsContact SG-ND1 3.35Å; H360-C378 PolarHBondContact ND1-SG 3.28Å; H360-C378 VanDerWaalsContact ND1-SG 3.38Å; H360-Y380 HydrophobicContact CB-CD2 4.4Å; H360-Y380 VanDerWaalsContact CE1-CB 3.45Å; H360-Y380 WeakPolarHBondContact CE1-CB 3.5Å
361V87.9Confident87.1Confident32 Ų3244.7 Ų44.719%0.19423%0.23CC..EExtended strand (participates in β ladder)trans-115.7133.4-179-171.90000109.3F338 P353 M354 I393F338-V361 HydrophobicContact CD1-CG1 4.38Å; F338-V361 HydrophobicContact CD2-CG1 4.32Å; F338-V361 HydrophobicContact CE1-CG1 3.86Å; F338-V361 HydrophobicContact CE2-CB 3.86Å; F338-V361 HydrophobicContact CE2-CG1 3.81Å; F338-V361 HydrophobicContact CZ-CB 3.79Å; F338-V361 HydrophobicContact CZ-CG1 3.57Å; F338-V361 WeakPolarHBondContact CZ-O 3.42Å; P353-V361 HydrophobicContact CB-CG1 3.78Å; M354-V361 WeakPolarHBondContact O-CA 3.45Å; V361-I393 HydrophobicContact CB-CD1 4.36Å; V361-I393 HydrophobicContact CG1-CD1 3.89Å; V361-I393 HydrophobicContact CG2-CD1 3.47Å; V361-I393 VanDerWaalsContact CG2-CD1 3.47Å
362I88.8Confident86.8Confident0 Ų050.8 Ų50.80%026%0.262CS..EExtended strand (participates in β ladder)trans-138.3164.2174.260.5173.4000109.1I342 M354 L356 A366 L367 L370I342-I362 HydrophobicContact CG1-CG2 4.14Å; M354-I362 WeakPolarHBondContact CA-O 3.46Å; M354-I362 WeakPolarHBondContact CB-O 3.48Å; M354-I362 PolarHBondContact N-O 2.84Å; M354-I362 PolarHBondContact O-N 3.44Å; L356-I362 HydrophobicContact CD1-CD1 4.26Å; L356-I362 HydrophobicContact CD2-CD1 3.91Å; L356-I362 HydrophobicContact CD2-CG1 3.97Å; L356-I362 HydrophobicContact CG-CG1 4.41Å; I362-A366 HydrophobicContact CB-CB 4.26Å; I362-A366 HydrophobicContact CD1-CB 4.5Å; I362-L367 HydrophobicContact CD1-CB 4.02Å; I362-L367 HydrophobicContact CD1-CD1 3.95Å; I362-L367 HydrophobicContact CG1-CB 4.45Å; I362-L370 HydrophobicContact CD1-CD1 4.19Å
363S89.6Confident86.4Confident0 Ų055.6 Ų55.60%030%0.302CS..EExtended strand (participates in β ladder)trans-75.5160.6175.570.50000112.2C340 N351 D365 A366 L367C340-S363 PolarHBondContact SG-N 3.47Å; C340-S363 VanDerWaalsContact SG-N 3.36Å; N351-S363 PolarHBondContact ND2-OG 2.99Å; N351-S363 VanDerWaalsContact OD1-CB 3.26Å; N351-S363 WeakPolarHBondContact OD1-CB 3.29Å; N351-S363 PolarHBondContact OD1-OG 3.26Å; S363-D365 VanDerWaalsContact C-N 3.29Å; S363-D365 PolarHBondContact O-N 3.49Å; S363-A366 WeakPolarHBondContact O-CB 3.33Å; S363-A366 PolarHBondContact O-N 3.17Å; S363-A366 VanDerWaalsContact O-N 3.15Å; S363-A366 WeakPolarHBondContact OG-CB 3.44Å; S363-A366 PolarHBondContact OG-N 2.68Å; S363-L367 PolarHBondContact O-N 3.13Å
364R87.3Confident85.8Confident97 Ų9756.9 Ų56.937%0.36632%0.318SS..Hα-helixtrans-58-38.5175.7-172.9167.872.4179.66113S350 N351 P352 M354 L367 N368S350-R364 PolarHBondContact O-NH2 3.28Å; N351-R364 PolarHBondContact OD1-N 3.14Å; P352-R364 HydrophobicContact CG-CB 4.33Å; P352-R364 PolarHBondContact O-N 3.45Å; M354-R364 HydrophobicContact CG-CB 3.95Å; R364-L367 WeakPolarHBondContact O-CB 3.31Å; R364-L367 PolarHBondContact O-N 2.9Å; R364-N368 PolarHBondContact O-N 3.36Å; R364-N368 PolarHBondContact O-ND2 2.99Å
365D88.3Confident85.5Confident65 Ų6562.4 Ų62.435%0.34834%0.341SS..Hα-helixtrans-69.4-37.2176.8-65.5-20.5000111.7L343 N351 S363 L367 N368 K369L343-D365 HydrophobicContact CD1-CB 3.75Å; N351-D365 PolarHBondContact ND2-OD2 2.63Å; N351-D365 PolarHBondContact OD1-N 3.49Å; N351-D365 PolarHBondContact OD1-OD2 2.99Å; S363-D365 VanDerWaalsContact C-N 3.29Å; S363-D365 PolarHBondContact O-N 3.49Å; D365-L367 VanDerWaalsContact C-N 3.35Å; D365-N368 PolarHBondContact O-N 3.32Å; D365-K369 WeakPolarHBondContact O-CB 3.28Å; D365-K369 WeakPolarHBondContact O-CG 3.19Å; D365-K369 PolarHBondContact O-N 3.42Å
366A86.6Confident85.2Confident0 Ų057.5 Ų57.50%032%0.32CS..Hα-helixtrans-65.7-41.117400000110.9C340 I342 L343 I362 S363 N368 K369 L370C340-A366 VanDerWaalsContact SG-CB 3.6Å; I342-A366 HydrophobicContact CB-CB 4.25Å; L343-A366 HydrophobicContact CD1-CB 4.02Å; L343-A366 HydrophobicContact CG-CB 3.98Å; I362-A366 HydrophobicContact CB-CB 4.26Å; I362-A366 HydrophobicContact CD1-CB 4.5Å; S363-A366 WeakPolarHBondContact O-CB 3.33Å; S363-A366 PolarHBondContact O-N 3.17Å; S363-A366 VanDerWaalsContact O-N 3.15Å; S363-A366 WeakPolarHBondContact OG-CB 3.44Å; S363-A366 PolarHBondContact OG-N 2.68Å; A366-N368 PolarHBondContact O-N 3.14Å; A366-K369 PolarHBondContact O-N 3.31Å; A366-L370 VanDerWaalsContact O-CB 3.29Å; A366-L370 WeakPolarHBondContact O-CB 3.42Å; A366-L370 VanDerWaalsContact O-CG 3.24Å; A366-L370 WeakPolarHBondContact O-CG 3.45Å; A366-L370 PolarHBondContact O-N 2.91Å
367L86.8Confident84.9Confident6 Ų663 Ų633%0.03134%0.344CS..Hα-helixtrans-57.4-48.1174.6-175.179.6000111M354 L356 I362 S363 R364 D365 L370 T371 L376 A390M354-L367 HydrophobicContact CB-CD2 4.45Å; M354-L367 HydrophobicContact CE-CD2 4.16Å; M354-L367 HydrophobicContact CG-CD2 4.3Å; L356-L367 HydrophobicContact CD2-CD1 3.65Å; I362-L367 HydrophobicContact CD1-CB 4.02Å; I362-L367 HydrophobicContact CD1-CD1 3.95Å; I362-L367 HydrophobicContact CG1-CB 4.45Å; S363-L367 PolarHBondContact O-N 3.13Å; R364-L367 WeakPolarHBondContact O-CB 3.31Å; R364-L367 PolarHBondContact O-N 2.9Å; D365-L367 VanDerWaalsContact C-N 3.35Å; L367-L370 PolarHBondContact O-N 3.33Å; L367-T371 PolarHBondContact O-N 3.01Å; L367-T371 VanDerWaalsContact O-N 3.14Å; L367-T371 PolarHBondContact O-OG1 3.5Å; L367-L376 HydrophobicContact CD1-CD1 3.87Å; L367-L376 HydrophobicContact CD1-CD2 3.38Å; L367-L376 HydrophobicContact CD1-CG 4.21Å; L367-L376 HydrophobicContact CG-CD1 4.45Å; L367-L376 WeakPolarHBondContact O-CD1 3.42Å; L367-A390 HydrophobicContact CD1-CB 3.97Å; L367-A390 HydrophobicContact CD2-CB 3.79Å
368N86.9Confident84.7Confident97 Ų9759.2 Ų59.252%0.51933%0.325SS..Hα-helixtrans-65.7-41.4179.3-70.3-20.3000112R364 D365 A366 T371R364-N368 PolarHBondContact O-N 3.36Å; R364-N368 PolarHBondContact O-ND2 2.99Å; D365-N368 PolarHBondContact O-N 3.32Å; A366-N368 PolarHBondContact O-N 3.14Å; N368-T371 PolarHBondContact O-N 3.31Å
369K85.9Confident84.4Confident159 Ų15960.4 Ų60.469%0.69133%0.333SS*.Hα-helixtrans-67.7-33177.8-77.7178.3177.1179.70113.8L343 D365 A366 T371L343-K369 HydrophobicContact CD2-CD 4.08Å; D365-K369 WeakPolarHBondContact O-CB 3.28Å; D365-K369 WeakPolarHBondContact O-CG 3.19Å; D365-K369 PolarHBondContact O-N 3.42Å; A366-K369 PolarHBondContact O-N 3.31Å; K369-T371 VanDerWaalsContact C-N 3.35Å
370L84.4Confident84.3Confident62 Ų6263.9 Ų63.933%0.32533%0.334SS..Hα-helixtrans-86-8.7-179.8-70.4170.8000113I342 I362 A366 L367 N372 L376 P379I342-L370 HydrophobicContact CG1-CD1 4.36Å; I342-L370 HydrophobicContact CG2-CD1 4.35Å; I362-L370 HydrophobicContact CD1-CD1 4.19Å; A366-L370 VanDerWaalsContact O-CB 3.29Å; A366-L370 WeakPolarHBondContact O-CB 3.42Å; A366-L370 VanDerWaalsContact O-CG 3.24Å; A366-L370 WeakPolarHBondContact O-CG 3.45Å; A366-L370 PolarHBondContact O-N 2.91Å; L367-L370 PolarHBondContact O-N 3.33Å; L370-N372 PolarHBondContact O-N 2.9Å; L370-L376 HydrophobicContact CB-CD1 3.47Å; L370-L376 VanDerWaalsContact CB-CD1 3.47Å; L370-P379 HydrophobicContact CD1-CG 4.22Å
371T85.1Confident84.2Confident39 Ų3962 Ų6224%0.23933%0.329CS..EExtended strand (participates in β ladder)trans-78.5118.8177.4-62.80000109.2L367 N368 K369 P387L367-T371 PolarHBondContact O-N 3.01Å; L367-T371 VanDerWaalsContact O-N 3.14Å; L367-T371 PolarHBondContact O-OG1 3.5Å; N368-T371 PolarHBondContact O-N 3.31Å; K369-T371 VanDerWaalsContact C-N 3.35Å; T371-P387 HydrophobicContact CG2-CB 4.46Å; T371-P387 HydrophobicContact CG2-CG 3.84Å
372N77.8Confident83.9Confident137 Ų13765.9 Ų65.973%0.73336%0.355SS*.EExtended strand (participates in β ladder)trans-124.3123.5176.2-152.70.5000109.4L370 G374 K375L370-N372 PolarHBondContact O-N 2.9Å; N372-G374 PolarHBondContact O-N 3.35Å; N372-K375 PolarHBondContact N-O 3.26Å; N372-K375 PolarHBondContact O-N 3.22Å; N372-K375 VanDerWaalsContact O-N 3.12Å
373A76.8Confident83.5Confident104 Ų10470.3 Ų70.386%0.8638%0.376SS*.THydrogen-bonded Turntrans49.439.2-176.200000114.7K375A373-K375 VanDerWaalsContact C-N 3.3Å; A373-K375 PolarHBondContact O-N 3.25Å
374G77.3Confident83.2Confident39 Ų3975.4 Ų75.440%0.40240%0.4SS..THydrogen-bonded Turntrans78.86.2176.800000115.4N372 P387N372-G374 PolarHBondContact O-N 3.35Å; G374-P387 WeakPolarHBondContact O-CD 3.39Å
375K81Confident83.1Confident135 Ų13571.6 Ų71.659%0.58739%0.386SS*.EExtended strand (participates in β ladder)trans-117.4140.3171.4-66.4-176.7179.4-176.70110.3N372 A373N372-K375 PolarHBondContact N-O 3.26Å; N372-K375 PolarHBondContact O-N 3.22Å; N372-K375 VanDerWaalsContact O-N 3.12Å; A373-K375 VanDerWaalsContact C-N 3.3Å; A373-K375 PolarHBondContact O-N 3.25Å
376L83.6Confident82.9Confident1 Ų172.2 Ų72.21%0.00539%0.39CS..EExtended strand (participates in β ladder)trans-115.5124.5174.5178.195.6000108.6L356 L367 L370 E384 Q385L356-L376 HydrophobicContact CD1-CD2 4.13Å; L356-L376 HydrophobicContact CD2-CD2 3.55Å; L356-L376 HydrophobicContact CG-CD2 4.45Å; L367-L376 HydrophobicContact CD1-CD1 3.87Å; L367-L376 HydrophobicContact CD1-CD2 3.38Å; L367-L376 HydrophobicContact CD1-CG 4.21Å; L367-L376 HydrophobicContact CG-CD1 4.45Å; L367-L376 WeakPolarHBondContact O-CD1 3.42Å; L370-L376 HydrophobicContact CB-CD1 3.47Å; L370-L376 VanDerWaalsContact CB-CD1 3.47Å; L376-E384 CarbonylContact O-C 3.56Å; L376-E384 WeakPolarHBondContact O-CA 3.47Å; L376-Q385 HydrophobicContact CB-CG 4.19Å; L376-Q385 HydrophobicContact CD2-CG 3.78Å; L376-Q385 VanDerWaalsContact CD2-NE2 3.35Å; L376-Q385 PolarHBondContact N-O 3.32Å; L376-Q385 PolarHBondContact O-N 3.13Å
377K84Confident82.8Confident121 Ų12173.6 Ų73.653%0.52640%0.399SS..EExtended strand (participates in β ladder)trans-96.6130.8169.3-170171.1-178.91740109.8E384K377-E384 HydrophobicContact CB-CG 4.19Å; K377-E384 HydrophobicContact CG-CG 4.12Å
378C83.6Confident82.6Confident8 Ų877.4 Ų77.45%0.05443%0.426CS..  trans-64.7133.6175.3-179.90000110.2L356 C358 H360 Y380 C381 M383L356-C378 HydrophobicContact CD1-CB 4Å; C358-C378 VanDerWaalsContact SG-SG 3.64Å; H360-C378 PolarHBondContact ND1-SG 3.28Å; H360-C378 VanDerWaalsContact ND1-SG 3.38Å; C378-Y380 PolarHBondContact O-N 3.03Å; C378-Y380 PolarHBondContact SG-N 3.45Å; C378-Y380 VanDerWaalsContact SG-N 3.39Å; C378-C381 WeakPolarHBondContact CB-SG 3.35Å; C378-C381 PolarHBondContact SG-SG 3.34Å; C378-M383 PolarHBondContact N-O 3.24Å
379P81.6Confident82.6Confident59 Ų5978 Ų7838%0.38343%0.426SS..SBendtrans-71.4-18.2177.223.8-29.9000113.5I342 L370I342-P379 HydrophobicContact CD1-CB 3.64Å; I342-P379 HydrophobicContact CD1-CG 3.42Å; I342-P379 VanDerWaalsContact CD1-CG 3.42Å; I342-P379 HydrophobicContact CG1-CG 3.92Å; L370-P379 HydrophobicContact CD1-CG 4.22Å
380Y80.9Confident82.6Confident111 Ų11171 Ų7144%0.43540%0.397SS..SBendtrans-103.3-11.5-177.5-61.9-73.2000114.1P341 I342 H360 C378P341-Y380 WeakPolarHBondContact CB-OH 3.22Å; P341-Y380 HydrophobicContact CG-CE2 3.83Å; P341-Y380 WeakPolarHBondContact CG-OH 3.45Å; I342-Y380 HydrophobicContact CD1-CE2 4.13Å; H360-Y380 HydrophobicContact CB-CD2 4.4Å; H360-Y380 VanDerWaalsContact CE1-CB 3.45Å; H360-Y380 WeakPolarHBondContact CE1-CB 3.5Å; C378-Y380 PolarHBondContact O-N 3.03Å; C378-Y380 PolarHBondContact SG-N 3.45Å; C378-Y380 VanDerWaalsContact SG-N 3.39Å
381C84.1Confident82.8Confident31 Ų3175.8 Ų75.821%0.20942%0.416CS..SBendtrans-152.3159.5-179.273.40000111.6C358 C378 M383C358-C381 VanDerWaalsContact CB-SG 3.54Å; C378-C381 WeakPolarHBondContact CB-SG 3.35Å; C378-C381 PolarHBondContact SG-SG 3.34Å; C381-M383 PolarHBondContact O-N 3.16Å
382P81.9Confident83Confident113 Ų11377.5 Ų77.573%0.73442%0.421SS*.SBendtrans-73.53-176.329.8-35.5000114.4
383M80.3Confident83.3Confident93 Ų9373 Ų7346%0.45840%0.396SS..  trans-73.3134.2-178.7-71.6-172.876.200112.2I357 C358 C378 C381I357-M383 HydrophobicContact CD1-CE 3.94Å; I357-M383 HydrophobicContact CG1-CE 3.96Å; C358-M383 HydrophobicContact CB-CB 4.21Å; C358-M383 HydrophobicContact CB-CG 4.38Å; C358-M383 HydrophobicContact CB-SD 3.55Å; C358-M383 VanDerWaalsContact CB-SD 3.55Å; C378-M383 PolarHBondContact N-O 3.24Å; C381-M383 PolarHBondContact O-N 3.16Å
384E83.9Confident83.4Confident107 Ų10776.8 Ų76.850%0.539%0.389SS..EExtended strand (participates in β ladder)trans-106146.2172-65.9-177.6-177.100110.4L376 K377L376-E384 CarbonylContact O-C 3.56Å; L376-E384 WeakPolarHBondContact O-CA 3.47Å; K377-E384 HydrophobicContact CB-CG 4.19Å; K377-E384 HydrophobicContact CG-CG 4.12Å
385Q83.9Confident82.7Confident16 Ų1682.4 Ų82.48%0.07540%0.403CS..EExtended strand (participates in β ladder)trans-147.3163178.865.5170.532.600111.7I357 L376I357-Q385 HydrophobicContact CD1-CB 3.62Å; I357-Q385 HydrophobicContact CG1-CB 4.05Å; I357-Q385 VanDerWaalsContact CG1-OE1 3.25Å; L376-Q385 HydrophobicContact CB-CG 4.19Å; L376-Q385 HydrophobicContact CD2-CG 3.78Å; L376-Q385 VanDerWaalsContact CD2-NE2 3.35Å; L376-Q385 PolarHBondContact N-O 3.32Å; L376-Q385 PolarHBondContact O-N 3.13Å
386N85.6Confident82.8Confident78 Ų7879.8 Ų79.842%0.41739%0.394SS..  trans-77.1134.4165.5-163.4-37.9000108.8S388 H389N386-S388 PolarHBondContact O-N 3.26Å; N386-S388 VanDerWaalsContact O-N 3.11Å; N386-S388 PolarHBondContact OD1-N 3.01Å; N386-S388 PolarHBondContact OD1-OG 3.39Å; N386-H389 WeakPolarHBondContact O-CB 3.35Å; N386-H389 PolarHBondContact O-N 3.29Å
387P83.1Confident82.7Confident30 Ų3083.9 Ų83.920%0.19541%0.414CS..G310 helixtrans-52.8-28.8175.720.9-36.2000113.9T371 G374 H389 A390T371-P387 HydrophobicContact CG2-CB 4.46Å; T371-P387 HydrophobicContact CG2-CG 3.84Å; G374-P387 WeakPolarHBondContact O-CD 3.39Å; P387-H389 PolarHBondContact O-N 3.47Å; P387-A390 WeakPolarHBondContact O-CB 3.36Å; P387-A390 PolarHBondContact O-N 3.35Å; P387-A390 VanDerWaalsContact O-N 3.16Å
388S83.6Confident82.6Confident86 Ų8681.8 Ų81.860%0.60141%0.408SS*.G310 helixtrans-64.7-20.5176.760.40000114.4N386 A390N386-S388 PolarHBondContact O-N 3.26Å; N386-S388 VanDerWaalsContact O-N 3.11Å; N386-S388 PolarHBondContact OD1-N 3.01Å; N386-S388 PolarHBondContact OD1-OG 3.39Å; S388-A390 VanDerWaalsContact C-N 3.3Å
389H86.1Confident82.6Confident110 Ų11086.2 Ų86.251%0.50943%0.429SS..G310 helixtrans-82.5-9.6177.8-63.8175.5000112.9I357 N386 P387 K391I357-H389 HydrophobicContact CG2-CB 3.84Å; N386-H389 WeakPolarHBondContact O-CB 3.35Å; N386-H389 PolarHBondContact O-N 3.29Å; P387-H389 PolarHBondContact O-N 3.47Å; H389-K391 PolarHBondContact O-N 3.19Å
390A86.8Confident82.6Confident12 Ų1287.9 Ų87.910%0.09943%0.432CS..  trans-70.3129175.800000109.9M354 K355 L356 L367 P387 S388M354-A390 HydrophobicContact CB-CB 4.39Å; M354-A390 HydrophobicContact CE-CB 3.9Å; M354-A390 WeakPolarHBondContact CE-O 3.34Å; K355-A390 VanDerWaalsContact O-CA 3.27Å; K355-A390 WeakPolarHBondContact O-CA 3.44Å; L356-A390 HydrophobicContact CD2-CB 4.41Å; L367-A390 HydrophobicContact CD1-CB 3.97Å; L367-A390 HydrophobicContact CD2-CB 3.79Å; P387-A390 WeakPolarHBondContact O-CB 3.36Å; P387-A390 PolarHBondContact O-N 3.35Å; P387-A390 VanDerWaalsContact O-N 3.16Å; S388-A390 VanDerWaalsContact C-N 3.3Å
391K88.6Confident82.8Confident162 Ų16286.3 Ų86.370%0.70443%0.432SS*.EExtended strand (participates in β ladder)trans-104.4132.7178.6-68.1-173178.9-176.70109.9K355 H389K355-K391 WeakPolarHBondContact CB-O 3.28Å; K355-K391 PolarHBondContact N-O 3.07Å; K355-K391 PolarHBondContact O-N 2.97Å; H389-K391 PolarHBondContact O-N 3.19Å
392Q88.6Confident82.7Confident74 Ų7490.3 Ų90.335%0.34645%0.447SS..EExtended strand (participates in β ladder)trans-63.7135171.3-178.9169.3-16.300110.1P352 M354 Y394P352-Q392 HydrophobicContact CB-CG 3.94Å; P352-Q392 HydrophobicContact CG-CG 4.22Å; M354-Q392 HydrophobicContact SD-CB 3.89Å; M354-Q392 HydrophobicContact SD-CG 4.43Å; Q392-Y394 HydrophobicContact CB-CE2 4.46Å; Q392-Y394 HydrophobicContact CG-CE1 4.48Å; Q392-Y394 HydrophobicContact CG-CE2 4.07Å; Q392-Y394 VanDerWaalsContact NE2-CE1 3.3Å; Q392-Y394 PolarHBondContact NE2-OH 3.31Å
393I84.6Confident82.7Confident42 Ų4288.5 Ų88.522%0.21543%0.425CS..  trans-96.8138.4170.5-63.8166000108.1P353 K355 V361 F395P353-I393 HydrophobicContact CG-CB 4.4Å; P353-I393 PolarHBondContact O-N 3.07Å; K355-I393 HydrophobicContact CB-CD1 3.63Å; K355-I393 HydrophobicContact CB-CG1 3.84Å; K355-I393 HydrophobicContact CD-CD1 4.29Å; K355-I393 HydrophobicContact CG-CD1 4.17Å; V361-I393 HydrophobicContact CB-CD1 4.36Å; V361-I393 HydrophobicContact CG1-CD1 3.89Å; V361-I393 HydrophobicContact CG2-CD1 3.47Å; V361-I393 VanDerWaalsContact CG2-CD1 3.47Å; I393-F395 HydrophobicContact CG2-CD1 4.39Å; I393-F395 HydrophobicContact CG2-CD2 4.32Å; I393-F395 HydrophobicContact CG2-CE1 4.26Å; I393-F395 HydrophobicContact CG2-CE2 4.19Å; I393-F395 HydrophobicContact CG2-CG 4.42Å; I393-F395 HydrophobicContact CG2-CZ 4.16Å
394Y77.9Confident82.9Confident184 Ų18488.2 Ų88.272%0.72242%0.423SS*.  trans-108.7132.3165.2-60.4-87.9000106.9Q392Q392-Y394 HydrophobicContact CB-CE2 4.46Å; Q392-Y394 HydrophobicContact CG-CE1 4.48Å; Q392-Y394 HydrophobicContact CG-CE2 4.07Å; Q392-Y394 VanDerWaalsContact NE2-CE1 3.3Å; Q392-Y394 PolarHBondContact NE2-OH 3.31Å
395F62.5Low82.8Confident157 Ų15786.5 Ų86.569%0.68942%0.416SS*.  trans-103.10-179.3-73.8-76.2000112.2F338 P353 I393F338-F395 HydrophobicContact CB-CD2 4.49Å; F338-F395 HydrophobicContact CB-CE2 3.6Å; F338-F395 HydrophobicContact CB-CZ 4.05Å; F338-F395 HydrophobicContact CD2-CZ 4.4Å; F338-F395 HydrophobicContact CG-CE2 4.25Å; F338-F395 HydrophobicContact CG-CZ 4.44Å; P353-F395 HydrophobicContact CB-CE2 3.96Å; P353-F395 HydrophobicContact CG-CD2 3.96Å; P353-F395 HydrophobicContact CG-CE2 3.58Å; I393-F395 HydrophobicContact CG2-CD1 4.39Å; I393-F395 HydrophobicContact CG2-CD2 4.32Å; I393-F395 HydrophobicContact CG2-CE1 4.26Å; I393-F395 HydrophobicContact CG2-CE2 4.19Å; I393-F395 HydrophobicContact CG2-CG 4.42Å; I393-F395 HydrophobicContact CG2-CZ 4.16Å

Retrieved 395 of 395 residues in 755.4 ms (Link to these results)

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