A0A096NX87_PAPAN Loading...

Potassium two pore domain channel subfamily K member 15

AlphaFold DB , UniProt , Accession A0A096NX87, Species PAPAN (Papio anubis, Olive baboon), Gene KCNK15, Length 329 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
1M52.9Low77.9Confident198 Ų198102.8 Ų102.898%0.97555%0.547SS*.  0139.80-67.8171.391.500110R3 V6M1-R3 PolarHBondContact O-N 3.39Å; M1-V6 HydrophobicContact CB-CG2 4.05Å
2R63.8Low79.2Confident212 Ų212102.8 Ų102.880%0.855%0.553SS**  trans-64.2129.4176.9-70.1-178.7175.3178.3-1.1109P4 S5 V6R2-P4 VanDerWaalsContact C-N 3.32Å; R2-P4 HydrophobicContact CB-CG 4.32Å; R2-P4 VanDerWaalsContact O-N 3.14Å; R2-S5 WeakPolarHBondContact O-CB 3.25Å; R2-S5 PolarHBondContact O-N 3.48Å; R2-V6 PolarHBondContact O-N 3.41Å
3R64.4Low80.5Confident141 Ų141103.3 Ų103.353%0.53256%0.555SS.*Hα-helixtrans-46.2-36.9-177.8-67.1-179.7177.4171.30.6116.3M1 V6 R7M1-R3 PolarHBondContact O-N 3.39Å; R3-V6 PolarHBondContact O-N 3.35Å; R3-R7 PolarHBondContact O-N 3.24Å
4P68.1Low81.6Confident92 Ų92101.8 Ų101.860%0.59756%0.555SS**Hα-helixtrans-63-36.3173.319.8-32000113.7R2 V6 R7 A8R2-P4 VanDerWaalsContact C-N 3.32Å; R2-P4 HydrophobicContact CB-CG 4.32Å; R2-P4 VanDerWaalsContact O-N 3.14Å; P4-V6 VanDerWaalsContact C-N 3.3Å; P4-V6 PolarHBondContact O-N 3.13Å; P4-R7 PolarHBondContact O-N 3.27Å; P4-A8 PolarHBondContact O-N 3.02Å; P4-A8 VanDerWaalsContact O-N 3.16Å
5S79.3Confident82.5Confident64 Ų64100.7 Ų100.745%0.44855%0.552SS.*Hα-helixtrans-66.6-31.5176.2-49.50000112.3R2 A9R2-S5 WeakPolarHBondContact O-CB 3.25Å; R2-S5 PolarHBondContact O-N 3.48Å; S5-A9 VanDerWaalsContact O-CB 3.3Å; S5-A9 WeakPolarHBondContact O-CB 3.39Å; S5-A9 PolarHBondContact O-N 2.9Å
6V86.8Confident83.4Confident78 Ų78101.8 Ų101.847%0.47355%0.55SS.*Hα-helixtrans-70-38.4177.3-179.60000111.6M1 R2 R3 P4 G10M1-V6 HydrophobicContact CB-CG2 4.05Å; R2-V6 PolarHBondContact O-N 3.41Å; R3-V6 PolarHBondContact O-N 3.35Å; P4-V6 VanDerWaalsContact C-N 3.3Å; P4-V6 PolarHBondContact O-N 3.13Å; V6-G10 PolarHBondContact O-N 3.04Å
7R83.9Confident84.2Confident101 Ų10199.4 Ų99.438%0.38154%0.542SS..Hα-helixtrans-68-44.2176.1-69.7175.1177.6-177.1-15112.3R3 P4 G10 L11 W250R3-R7 PolarHBondContact O-N 3.24Å; P4-R7 PolarHBondContact O-N 3.27Å; R7-G10 PolarHBondContact O-N 3.34Å; R7-L11 WeakPolarHBondContact O-CG 3.44Å; R7-L11 PolarHBondContact O-N 2.69Å; R7-W250 VanDerWaalsContact CZ-CD1 3.47Å; R7-W250 VanDerWaalsContact CZ-CG 3.43Å; R7-W250 VanDerWaalsContact NH2-CB 3.33Å; R7-W250 VanDerWaalsContact NH2-CE3 3.3Å
8A86.3Confident84.9Confident56 Ų56104.2 Ų104.246%0.46355%0.553SS.*Hα-helixtrans-60.7-48.6176.600000110.6P4 G10 L11 V12P4-A8 PolarHBondContact O-N 3.02Å; P4-A8 VanDerWaalsContact O-N 3.16Å; A8-G10 VanDerWaalsContact C-N 3.32Å; A8-G10 PolarHBondContact O-N 3.45Å; A8-L11 PolarHBondContact O-N 2.99Å; A8-V12 WeakPolarHBondContact O-CG2 3.34Å; A8-V12 PolarHBondContact O-N 2.84Å
9A89.1Confident85.6Confident54 Ų54104.6 Ų104.645%0.44655%0.554SS.*Hα-helixtrans-60.1-40.7175.200000112.4S5 V12 L13S5-A9 VanDerWaalsContact O-CB 3.3Å; S5-A9 WeakPolarHBondContact O-CB 3.39Å; S5-A9 PolarHBondContact O-N 2.9Å; A9-V12 PolarHBondContact O-N 3.45Å; A9-L13 WeakPolarHBondContact O-CB 3.32Å; A9-L13 PolarHBondContact O-N 3.46Å
10G91.8Very high86.2Confident38 Ų38104.3 Ų104.339%0.39255%0.552SS.*Hα-helixtrans-63.8-40.617600000113.6V6 R7 A8 C14V6-G10 PolarHBondContact O-N 3.04Å; R7-G10 PolarHBondContact O-N 3.34Å; A8-G10 VanDerWaalsContact C-N 3.32Å; A8-G10 PolarHBondContact O-N 3.45Å; G10-C14 VanDerWaalsContact O-CB 3.28Å; G10-C14 WeakPolarHBondContact O-CB 3.32Å; G10-C14 PolarHBondContact O-N 2.91Å
11L90.2Very high86.8Confident97 Ų97103.9 Ų103.951%0.50855%0.554SS.*Hα-helixtrans-65.5-44.9174.7-74172.1000111.3R7 A8 L13 C14 T15R7-L11 WeakPolarHBondContact O-CG 3.44Å; R7-L11 PolarHBondContact O-N 2.69Å; A8-L11 PolarHBondContact O-N 2.99Å; L11-L13 PolarHBondContact O-N 2.95Å; L11-C14 PolarHBondContact O-N 3.47Å; L11-T15 PolarHBondContact O-N 3.49Å; L11-T15 PolarHBondContact O-OG1 2.83Å; L11-T15 VanDerWaalsContact O-OG1 3.08Å
12V93.7Very high88.9Confident103 Ų10395.5 Ų95.562%0.62452%0.518SS*.Hα-helixtrans-59.8-46.9176.6171.50000111A8 A9 C14 T15 F16A8-V12 WeakPolarHBondContact O-CG2 3.34Å; A8-V12 PolarHBondContact O-N 2.84Å; A9-V12 PolarHBondContact O-N 3.45Å; V12-C14 PolarHBondContact O-N 3.18Å; V12-T15 PolarHBondContact O-N 3.31Å; V12-F16 WeakPolarHBondContact O-CB 3.32Å; V12-F16 PolarHBondContact O-N 3.32Å
13L95.8Very high90.5Very high109 Ų10988.2 Ų88.257%0.57150%0.503SS*.Hα-helixtrans-61.8-44.3177.4-179.262000111.5A9 L11 T15 F16 C17A9-L13 WeakPolarHBondContact O-CB 3.32Å; A9-L13 PolarHBondContact O-N 3.46Å; L11-L13 PolarHBondContact O-N 2.95Å; L13-T15 PolarHBondContact O-N 2.95Å; L13-F16 PolarHBondContact O-N 2.94Å; L13-C17 PolarHBondContact O-N 3.22Å; L13-C17 PolarHBondContact O-SG 3.24Å
14C95.9Very high92.1Very high82 Ų8284.5 Ų84.555%0.55450%0.503SS*.Hα-helixtrans-60-46177.1-173.50000111.8G10 L11 V12 F16 C17 Y18G10-C14 VanDerWaalsContact O-CB 3.28Å; G10-C14 WeakPolarHBondContact O-CB 3.32Å; G10-C14 PolarHBondContact O-N 2.91Å; L11-C14 PolarHBondContact O-N 3.47Å; V12-C14 PolarHBondContact O-N 3.18Å; C14-F16 VanDerWaalsContact C-N 3.34Å; C14-F16 PolarHBondContact O-N 3.46Å; C14-C17 PolarHBondContact O-N 2.97Å; C14-Y18 WeakPolarHBondContact O-CB 3.49Å; C14-Y18 PolarHBondContact O-N 2.94Å
15T94.9Very high93.5Very high85 Ų8583.7 Ų83.752%0.52150%0.496SS..Hα-helixtrans-61.7-42.2175.8-59.30000111.6L11 V12 L13 Y18 L19L11-T15 PolarHBondContact O-N 3.49Å; L11-T15 PolarHBondContact O-OG1 2.83Å; L11-T15 VanDerWaalsContact O-OG1 3.08Å; V12-T15 PolarHBondContact O-N 3.31Å; L13-T15 PolarHBondContact O-N 2.95Å; T15-Y18 WeakPolarHBondContact O-CB 3.41Å; T15-Y18 PolarHBondContact O-N 3.39Å; T15-L19 HydrophobicContact CG2-CD1 4.49Å; T15-L19 WeakPolarHBondContact O-CG 3.3Å; T15-L19 PolarHBondContact O-N 2.96Å
16F97.3Very high94.4Very high118 Ų11887.2 Ų87.252%0.51850%0.504SS..Hα-helixtrans-63.4-45.3177-175.4-103000112V12 L13 C14 Y18 L19 L20V12-F16 WeakPolarHBondContact O-CB 3.32Å; V12-F16 PolarHBondContact O-N 3.32Å; L13-F16 PolarHBondContact O-N 2.94Å; C14-F16 VanDerWaalsContact C-N 3.34Å; C14-F16 PolarHBondContact O-N 3.46Å; F16-Y18 VanDerWaalsContact C-N 3.31Å; F16-Y18 PolarHBondContact O-N 3.4Å; F16-L19 PolarHBondContact O-N 3.19Å; F16-L20 HydrophobicContact CD1-CD1 3.94Å; F16-L20 HydrophobicContact CD1-CG 4.38Å; F16-L20 HydrophobicContact CE1-CD1 3.49Å; F16-L20 VanDerWaalsContact CE1-CD1 3.49Å; F16-L20 HydrophobicContact CE1-CD2 4.48Å; F16-L20 HydrophobicContact CE1-CG 4.04Å; F16-L20 HydrophobicContact CZ-CD1 4.1Å; F16-L20 HydrophobicContact CZ-CD2 4.27Å; F16-L20 HydrophobicContact CZ-CG 4.26Å; F16-L20 PolarHBondContact O-N 2.71Å
17C97.7Very high94.9Very high62 Ų6288.4 Ų88.442%0.41951%0.507SS..Hα-helixtrans-60.3-41173.9-68.10000112L13 C14 L19 L20 V21L13-C17 PolarHBondContact O-N 3.22Å; L13-C17 PolarHBondContact O-SG 3.24Å; C14-C17 PolarHBondContact O-N 2.97Å; C17-L19 VanDerWaalsContact C-N 3.34Å; C17-L19 PolarHBondContact O-N 3.39Å; C17-L20 PolarHBondContact O-N 2.92Å; C17-V21 WeakPolarHBondContact O-CG2 3.47Å; C17-V21 PolarHBondContact O-N 3.01Å
18Y96.9Very high95.4Very high186 Ų18687.4 Ų87.473%0.72952%0.52SS*.Hα-helixtrans-61.7-40.9176.4-173.9-98.4000112.1C14 T15 F16 V21 G22C14-Y18 WeakPolarHBondContact O-CB 3.49Å; C14-Y18 PolarHBondContact O-N 2.94Å; T15-Y18 WeakPolarHBondContact O-CB 3.41Å; T15-Y18 PolarHBondContact O-N 3.39Å; F16-Y18 VanDerWaalsContact C-N 3.31Å; F16-Y18 PolarHBondContact O-N 3.4Å; Y18-V21 PolarHBondContact O-N 3.28Å; Y18-G22 PolarHBondContact O-N 3.27Å
19L97.7Very high95.9Very high111 Ų11190 Ų9058%0.58153%0.526SS*.Hα-helixtrans-63.9-42.4174.5-71.6171.8000112.2T15 F16 C17 G22 A23T15-L19 HydrophobicContact CG2-CD1 4.49Å; T15-L19 WeakPolarHBondContact O-CG 3.3Å; T15-L19 PolarHBondContact O-N 2.96Å; F16-L19 PolarHBondContact O-N 3.19Å; C17-L19 VanDerWaalsContact C-N 3.34Å; C17-L19 PolarHBondContact O-N 3.39Å; L19-G22 PolarHBondContact O-N 3.37Å; L19-A23 WeakPolarHBondContact O-CB 3.49Å; L19-A23 PolarHBondContact O-N 3.29Å
20L97.9Very high96.2Very high98 Ų9892.6 Ų92.651%0.51353%0.529SS..Hα-helixtrans-63.3-44177.7-71.3178.5000112.2F16 C17 A23 A24F16-L20 HydrophobicContact CD1-CD1 3.94Å; F16-L20 HydrophobicContact CD1-CG 4.38Å; F16-L20 HydrophobicContact CE1-CD1 3.49Å; F16-L20 VanDerWaalsContact CE1-CD1 3.49Å; F16-L20 HydrophobicContact CE1-CD2 4.48Å; F16-L20 HydrophobicContact CE1-CG 4.04Å; F16-L20 HydrophobicContact CZ-CD1 4.1Å; F16-L20 HydrophobicContact CZ-CD2 4.27Å; F16-L20 HydrophobicContact CZ-CG 4.26Å; F16-L20 PolarHBondContact O-N 2.71Å; C17-L20 PolarHBondContact O-N 2.92Å; L20-A23 PolarHBondContact O-N 3.46Å; L20-A24 PolarHBondContact O-N 2.98Å
21V98.2Very high96.3Very high96 Ų9693 Ų9358%0.58253%0.526SS*.Hα-helixtrans-62.4-45.7175.5173.30000110.3C17 Y18 A23 A24 V25C17-V21 WeakPolarHBondContact O-CG2 3.47Å; C17-V21 PolarHBondContact O-N 3.01Å; Y18-V21 PolarHBondContact O-N 3.28Å; V21-A23 PolarHBondContact O-N 3.49Å; V21-A24 PolarHBondContact O-N 3.46Å; V21-V25 HydrophobicContact CG1-CG2 4.47Å; V21-V25 WeakPolarHBondContact O-CG2 3.15Å; V21-V25 PolarHBondContact O-N 3.41Å
22G97.1Very high96.4Very high22 Ų2296.4 Ų96.423%0.22754%0.539CS..Hα-helixtrans-57.8-46.8175.700000112.4Y18 L19 A24 V25 F26Y18-G22 PolarHBondContact O-N 3.27Å; L19-G22 PolarHBondContact O-N 3.37Å; G22-A24 PolarHBondContact O-N 2.92Å; G22-V25 PolarHBondContact O-N 3.36Å; G22-F26 WeakPolarHBondContact O-CD2 3.34Å; G22-F26 PolarHBondContact O-N 3.45Å
23A97.5Very high96.3Very high59 Ų5995.9 Ų95.949%0.48854%0.536SS..Hα-helixtrans-60.3-45.1178.900000112.3L19 L20 V21 V25 F26 D27L19-A23 WeakPolarHBondContact O-CB 3.49Å; L19-A23 PolarHBondContact O-N 3.29Å; L20-A23 PolarHBondContact O-N 3.46Å; V21-A23 PolarHBondContact O-N 3.49Å; A23-V25 PolarHBondContact O-N 2.97Å; A23-F26 PolarHBondContact O-N 3.32Å; A23-D27 WeakPolarHBondContact O-CB 3.38Å; A23-D27 PolarHBondContact O-N 2.95Å
24A97.8Very high96.1Very high64 Ų6495.6 Ų95.653%0.52953%0.532SS..Hα-helixtrans-63.9-40.3177.700000112.4L20 V21 G22 A28L20-A24 PolarHBondContact O-N 2.98Å; V21-A24 PolarHBondContact O-N 3.46Å; G22-A24 PolarHBondContact O-N 2.92Å; A24-A28 WeakPolarHBondContact O-CB 3.43Å; A24-A28 PolarHBondContact O-N 3.3Å; A24-A28 VanDerWaalsContact O-N 3.08Å
25V97.9Very high95.9Very high74 Ų7494 Ų9445%0.44852%0.521SS..Hα-helixtrans-68.9-44.4178.1173.10000111.2V21 G22 A23 A28 L29V21-V25 HydrophobicContact CG1-CG2 4.47Å; V21-V25 WeakPolarHBondContact O-CG2 3.15Å; V21-V25 PolarHBondContact O-N 3.41Å; G22-V25 PolarHBondContact O-N 3.36Å; A23-V25 PolarHBondContact O-N 2.97Å; V25-A28 PolarHBondContact O-N 2.85Å; V25-L29 HydrophobicContact CG1-CD1 3.73Å; V25-L29 HydrophobicContact CG1-CG 4.37Å; V25-L29 WeakPolarHBondContact O-CB 3.35Å; V25-L29 VanDerWaalsContact O-CG 3.26Å; V25-L29 WeakPolarHBondContact O-CG 3.27Å; V25-L29 PolarHBondContact O-N 3.02Å
26F97.1Very high95.8Very high139 Ų13991.5 Ų91.561%0.6151%0.513SS*.Hα-helixtrans-66-40.1178.2-75.1-57000112.4G22 A23 L29 E30G22-F26 WeakPolarHBondContact O-CD2 3.34Å; G22-F26 PolarHBondContact O-N 3.45Å; A23-F26 PolarHBondContact O-N 3.32Å; F26-L29 PolarHBondContact O-N 3.49Å; F26-E30 WeakPolarHBondContact O-CB 3.39Å; F26-E30 PolarHBondContact O-N 2.98Å
27D97.3Very high95.5Very high103 Ų10392.9 Ų92.955%0.55152%0.515SS*.Hα-helixtrans-59.6-47.3173.5-178.352.6000110.9A23 L29 S31A23-D27 WeakPolarHBondContact O-CB 3.38Å; A23-D27 PolarHBondContact O-N 2.95Å; D27-L29 VanDerWaalsContact C-N 3.28Å; D27-L29 PolarHBondContact O-N 3.19Å; D27-S31 WeakPolarHBondContact O-CB 2.94Å; D27-S31 PolarHBondContact O-N 3.05Å; D27-S31 VanDerWaalsContact OD1-CB 3.27Å; D27-S31 WeakPolarHBondContact OD1-CB 3.23Å; D27-S31 PolarHBondContact OD1-OG 3.3Å
28A96.3Very high95.1Very high79 Ų7995.8 Ų95.865%0.65352%0.522SS*.Hα-helixtrans-62.8-31.3178.800000113.9A24 V25A24-A28 WeakPolarHBondContact O-CB 3.43Å; A24-A28 PolarHBondContact O-N 3.3Å; A24-A28 VanDerWaalsContact O-N 3.08Å; V25-A28 PolarHBondContact O-N 2.85Å
29L95.7Very high94.9Very high111 Ų11195.3 Ų95.358%0.58152%0.519SS*.Hα-helixtrans-89-37.2-177.4-67.8174.6000113.4V25 F26 D27V25-L29 HydrophobicContact CG1-CD1 3.73Å; V25-L29 HydrophobicContact CG1-CG 4.37Å; V25-L29 WeakPolarHBondContact O-CB 3.35Å; V25-L29 VanDerWaalsContact O-CG 3.26Å; V25-L29 WeakPolarHBondContact O-CG 3.27Å; V25-L29 PolarHBondContact O-N 3.02Å; F26-L29 PolarHBondContact O-N 3.49Å; D27-L29 VanDerWaalsContact C-N 3.28Å; D27-L29 PolarHBondContact O-N 3.19Å
30E95.3Very high94.7Very high108 Ų10894 Ų9451%0.50551%0.512SS..Hα-helixtrans-108-25.6-168-62.9-64.6157.400113.8F26 E32 V33 E34F26-E30 WeakPolarHBondContact O-CB 3.39Å; F26-E30 PolarHBondContact O-N 2.98Å; E30-E32 PolarHBondContact O-N 3.46Å; E30-V33 PolarHBondContact O-N 3.36Å; E30-E34 WeakPolarHBondContact O-CB 3.27Å; E30-E34 PolarHBondContact O-N 2.89Å
31S93.9Very high94.2Very high48 Ų4893.7 Ų93.734%0.33651%0.51SS..Hα-helixtrans-62.6-42.6-169.6-172.30000113.4D27 S35D27-S31 WeakPolarHBondContact O-CB 2.94Å; D27-S31 PolarHBondContact O-N 3.05Å; D27-S31 VanDerWaalsContact OD1-CB 3.27Å; D27-S31 WeakPolarHBondContact OD1-CB 3.23Å; D27-S31 PolarHBondContact OD1-OG 3.3Å; S31-S35 VanDerWaalsContact O-CB 3.27Å; S31-S35 WeakPolarHBondContact O-CB 3.29Å; S31-S35 PolarHBondContact O-N 3.33Å; S31-S35 PolarHBondContact O-OG 3.17Å
32E92.6Very high93.7Very high167 Ų16793.5 Ų93.578%0.7851%0.509SS*.Hα-helixtrans-69-41.4177.4-67.4-159.7157.400112.1E30 S35 G36E30-E32 PolarHBondContact O-N 3.46Å; E32-S35 PolarHBondContact O-N 3.29Å; E32-G36 PolarHBondContact O-N 3.46Å
33V92.3Very high93.4Very high93 Ų9399 Ų9956%0.56453%0.529SS*.Hα-helixtrans-65.4-45-179.6179.60000110.3E30 G36 R37E30-V33 PolarHBondContact O-N 3.36Å; V33-G36 PolarHBondContact O-N 2.98Å; V33-R37 WeakPolarHBondContact O-CB 3.46Å; V33-R37 PolarHBondContact O-N 2.99Å
34E91.6Very high93Very high102 Ų102102.1 Ų102.148%0.47753%0.532SS..Hα-helixtrans-63.1-48.1176.5-179.6163.7-134.200111.5E30 G36 R37 Q38E30-E34 WeakPolarHBondContact O-CB 3.27Å; E30-E34 PolarHBondContact O-N 2.89Å; E34-G36 VanDerWaalsContact C-N 3.27Å; E34-G36 PolarHBondContact O-N 3.43Å; E34-R37 PolarHBondContact O-N 3.27Å; E34-R37 VanDerWaalsContact O-N 3.16Å; E34-R37 IonicContact OE1-NH2 3.97Å; E34-Q38 WeakPolarHBondContact O-CB 3.28Å; E34-Q38 PolarHBondContact O-N 3.44Å
35S91.3Very high92.3Very high48 Ų48104 Ų10434%0.33653%0.525SS..Hα-helixtrans-60-37.9177.2-65.50000112.2S31 E32 R39S31-S35 VanDerWaalsContact O-CB 3.27Å; S31-S35 WeakPolarHBondContact O-CB 3.29Å; S31-S35 PolarHBondContact O-N 3.33Å; S31-S35 PolarHBondContact O-OG 3.17Å; E32-S35 PolarHBondContact O-N 3.29Å; S35-R39 WeakPolarHBondContact O-CB 3.45Å; S35-R39 VanDerWaalsContact O-CG 3.29Å; S35-R39 WeakPolarHBondContact O-CG 3.39Å; S35-R39 PolarHBondContact O-N 3.34Å; S35-R39 VanDerWaalsContact O-N 3.17Å; S35-R39 PolarHBondContact O-NE 3.18Å
36G92Very high91.7Very high34 Ų34101.8 Ų101.835%0.35152%0.517SS..Hα-helixtrans-65.2-49173.200000112.3E32 V33 E34 Q38 R39 L40E32-G36 PolarHBondContact O-N 3.46Å; V33-G36 PolarHBondContact O-N 2.98Å; E34-G36 VanDerWaalsContact C-N 3.27Å; E34-G36 PolarHBondContact O-N 3.43Å; G36-Q38 PolarHBondContact O-N 2.81Å; G36-R39 PolarHBondContact O-N 2.85Å; G36-L40 PolarHBondContact O-N 3.08Å
37R91.1Very high91.3Very high147 Ų14797.4 Ų97.456%0.55551%0.507SS*.Hα-helixtrans-61.1-42.9178.4-173.7178.566.11161.4111.8V33 E34 L40 L41V33-R37 WeakPolarHBondContact O-CB 3.46Å; V33-R37 PolarHBondContact O-N 2.99Å; E34-R37 PolarHBondContact O-N 3.27Å; E34-R37 VanDerWaalsContact O-N 3.16Å; E34-R37 IonicContact OE1-NH2 3.97Å; R37-L40 PolarHBondContact O-N 3.18Å; R37-L41 HydrophobicContact CG-CD1 4.19Å; R37-L41 WeakPolarHBondContact O-CB 3.47Å; R37-L41 VanDerWaalsContact O-CG 3.28Å; R37-L41 WeakPolarHBondContact O-CG 3.46Å; R37-L41 PolarHBondContact O-N 2.85Å
38Q90.4Very high90.8Very high122 Ų12295.8 Ų95.857%0.5750%0.498SS*.Hα-helixtrans-64.8-43.4178.7-171.6171.7-8.300111.6E34 G36 L40 L41 V42E34-Q38 WeakPolarHBondContact O-CB 3.28Å; E34-Q38 PolarHBondContact O-N 3.44Å; G36-Q38 PolarHBondContact O-N 2.81Å; Q38-L40 VanDerWaalsContact C-N 3.33Å; Q38-L40 PolarHBondContact O-N 3.43Å; Q38-L41 PolarHBondContact O-N 3.38Å; Q38-V42 WeakPolarHBondContact O-CG2 3.21Å; Q38-V42 PolarHBondContact O-N 3.32Å
39R92.4Very high90.1Very high176 Ų17696.9 Ų96.966%0.66449%0.485SS*.Hα-helixtrans-58.9-44.5173.2-77.3-178.8-82.3-156.60.5111.7S35 G36 V42 Q43S35-R39 WeakPolarHBondContact O-CB 3.45Å; S35-R39 VanDerWaalsContact O-CG 3.29Å; S35-R39 WeakPolarHBondContact O-CG 3.39Å; S35-R39 PolarHBondContact O-N 3.34Å; S35-R39 VanDerWaalsContact O-N 3.17Å; S35-R39 PolarHBondContact O-NE 3.18Å; G36-R39 PolarHBondContact O-N 2.85Å; R39-V42 PolarHBondContact O-N 3.39Å; R39-Q43 WeakPolarHBondContact O-CB 3.46Å; R39-Q43 PolarHBondContact O-N 2.89Å
40L92.3Very high89.6Confident83 Ų83101.7 Ų101.744%0.43550%0.495SS..Hα-helixtrans-64.1-41.6176.9-176.366.7000112.4G36 R37 Q38 Q43 K44G36-L40 PolarHBondContact O-N 3.08Å; R37-L40 PolarHBondContact O-N 3.18Å; Q38-L40 VanDerWaalsContact C-N 3.33Å; Q38-L40 PolarHBondContact O-N 3.43Å; L40-Q43 PolarHBondContact O-N 3.17Å; L40-K44 HydrophobicContact CG-CD 4.49Å; L40-K44 WeakPolarHBondContact O-CB 3.41Å; L40-K44 WeakPolarHBondContact O-CG 3.27Å; L40-K44 PolarHBondContact O-N 3.4Å
41L87.5Confident89.4Confident92 Ų92104.4 Ų104.448%0.48251%0.506SS..Hα-helixtrans-63.6-44.5177.6-75.1171.7000111.4R37 Q38 Q43 K44 R45R37-L41 HydrophobicContact CG-CD1 4.19Å; R37-L41 WeakPolarHBondContact O-CB 3.47Å; R37-L41 VanDerWaalsContact O-CG 3.28Å; R37-L41 WeakPolarHBondContact O-CG 3.46Å; R37-L41 PolarHBondContact O-N 2.85Å; Q38-L41 PolarHBondContact O-N 3.38Å; L41-Q43 VanDerWaalsContact C-N 3.31Å; L41-Q43 PolarHBondContact O-N 3.4Å; L41-K44 PolarHBondContact O-N 2.9Å; L41-R45 WeakPolarHBondContact O-CB 3.48Å; L41-R45 PolarHBondContact O-N 2.88Å
42V87.8Confident88.9Confident92 Ų92108 Ų10856%0.55852%0.515SS*.Hα-helixtrans-60.9-42.3175.11720000110.8Q38 R39 G46Q38-V42 WeakPolarHBondContact O-CG2 3.21Å; Q38-V42 PolarHBondContact O-N 3.32Å; R39-V42 PolarHBondContact O-N 3.39Å; V42-G46 PolarHBondContact O-N 3.25Å
43Q91.4Very high88.6Confident138 Ų138103.1 Ų103.165%0.64551%0.51SS*.Hα-helixtrans-64.5-47.6177.2-169.7-176.114.200112.2R39 L40 L41 G46 A47R39-Q43 WeakPolarHBondContact O-CB 3.46Å; R39-Q43 PolarHBondContact O-N 2.89Å; L40-Q43 PolarHBondContact O-N 3.17Å; L41-Q43 VanDerWaalsContact C-N 3.31Å; L41-Q43 PolarHBondContact O-N 3.4Å; Q43-G46 PolarHBondContact O-N 3.08Å; Q43-A47 PolarHBondContact O-N 3.26Å
44K88.2Confident88.1Confident124 Ų124102.2 Ų102.254%0.53950%0.498SS..Hα-helixtrans-62.6-43.7177.3-77.8-171.7176.7-176.20111.6L40 L41 G46 A47 L48L40-K44 HydrophobicContact CG-CD 4.49Å; L40-K44 WeakPolarHBondContact O-CB 3.41Å; L40-K44 WeakPolarHBondContact O-CG 3.27Å; L40-K44 PolarHBondContact O-N 3.4Å; L41-K44 PolarHBondContact O-N 2.9Å; K44-G46 VanDerWaalsContact C-N 3.34Å; K44-G46 PolarHBondContact O-N 3.36Å; K44-A47 PolarHBondContact O-N 2.9Å; K44-L48 PolarHBondContact O-N 2.9Å
45R83.9Confident87.6Confident104 Ų10499.8 Ų99.839%0.39249%0.493SS..Hα-helixtrans-58.1-46.2175.1-176-177.1-74.6173.5-6.3110.9L41 A47 L48 R49 Y59 E63L41-R45 WeakPolarHBondContact O-CB 3.48Å; L41-R45 PolarHBondContact O-N 2.88Å; R45-A47 PolarHBondContact O-N 3.42Å; R45-L48 PolarHBondContact O-N 3.28Å; R45-R49 WeakPolarHBondContact O-CG 3.46Å; R45-R49 PolarHBondContact O-N 3.47Å; R45-Y59 HydrophobicContact CG-CD1 4.15Å; R45-Y59 HydrophobicContact CG-CE1 3.79Å; R45-Y59 HydrophobicContact CG-CE2 4.37Å; R45-E63 IonicContact CZ-OE1 3.5Å; R45-E63 IonicContact CZ-OE2 3.97Å; R45-E63 IonicContact NE-OE1 3.6Å; R45-E63 IonicContact NH2-OE1 2.71Å; R45-E63 PolarHBondContact NH2-OE1 2.93Å; R45-E63 IonicContact NH2-OE2 3.19Å; R45-E63 PolarHBondContact NH2-OE2 3.16Å
46G85.3Confident87Confident27 Ų27100 Ų10028%0.27850%0.498SS..Hα-helixtrans-64.7-35.6176.600000113.8V42 Q43 K44 R50V42-G46 PolarHBondContact O-N 3.25Å; Q43-G46 PolarHBondContact O-N 3.08Å; K44-G46 VanDerWaalsContact C-N 3.34Å; K44-G46 PolarHBondContact O-N 3.36Å; G46-R50 WeakPolarHBondContact O-CG 3.36Å; G46-R50 PolarHBondContact O-N 3.31Å; G46-R50 PolarHBondContact O-NE 3.49Å
47A88.3Confident86.5Confident47 Ų47105.3 Ų105.339%0.38851%0.513SS..Hα-helixtrans-67.7-45174.500000112.1Q43 K44 R45 R50 K51Q43-A47 PolarHBondContact O-N 3.26Å; K44-A47 PolarHBondContact O-N 2.9Å; R45-A47 PolarHBondContact O-N 3.42Å; A47-R50 PolarHBondContact O-N 3.35Å; A47-K51 VanDerWaalsContact O-CB 3.32Å; A47-K51 WeakPolarHBondContact O-CB 3.37Å; A47-K51 PolarHBondContact O-N 3.02Å
48L86.4Confident86Confident70 Ų70102.2 Ų102.237%0.36651%0.508SS..Hα-helixtrans-61.3-46.5175.8-97.5128.1000111.9K44 R45 R50 K51 F52 Y59K44-L48 PolarHBondContact O-N 2.9Å; R45-L48 PolarHBondContact O-N 3.28Å; L48-R50 VanDerWaalsContact C-N 3.33Å; L48-R50 PolarHBondContact O-N 3.23Å; L48-K51 PolarHBondContact O-N 3.5Å; L48-F52 HydrophobicContact CD2-CD2 3.97Å; L48-F52 HydrophobicContact CD2-CE2 3.93Å; L48-F52 HydrophobicContact CG-CE2 4.48Å; L48-F52 WeakPolarHBondContact O-CD2 3.25Å; L48-F52 PolarHBondContact O-N 3.04Å; L48-Y59 HydrophobicContact CB-CE2 4.23Å
49R83.3Confident85.2Confident101 Ų10198.9 Ų98.938%0.38149%0.49SS..Hα-helixtrans-58-44.2177.4-75.4-178.267.9-159.7-0.8112.2R45 G53 F54 Y59R45-R49 WeakPolarHBondContact O-CG 3.46Å; R45-R49 PolarHBondContact O-N 3.47Å; R49-G53 VanDerWaalsContact O-CA 3.32Å; R49-G53 WeakPolarHBondContact O-CA 3.37Å; R49-G53 PolarHBondContact O-N 3.38Å; R49-F54 HydrophobicContact CG-CB 4.41Å; R49-F54 PolarHBondContact NE-O 3.28Å; R49-F54 PolarHBondContact O-N 3.01Å; R49-Y59 HydrophobicContact CG-CD2 4.02Å; R49-Y59 HydrophobicContact CG-CE2 4.48Å
50R85.3Confident84.6Confident213 Ų21393.4 Ų93.480%0.80448%0.479SS*.Hα-helixtrans-68.3-39.9177.1-74-173-68.2176.3-0.5113G46 A47 L48G46-R50 WeakPolarHBondContact O-CG 3.36Å; G46-R50 PolarHBondContact O-N 3.31Å; G46-R50 PolarHBondContact O-NE 3.49Å; A47-R50 PolarHBondContact O-N 3.35Å; L48-R50 VanDerWaalsContact C-N 3.33Å; L48-R50 PolarHBondContact O-N 3.23Å
51K89.5Confident84.1Confident165 Ų16593.8 Ų93.872%0.71748%0.478SS*.Hα-helixtrans-70-35.3-176.6-172.3174.7179.9-178.50112.8A47 L48A47-K51 VanDerWaalsContact O-CB 3.32Å; A47-K51 WeakPolarHBondContact O-CB 3.37Å; A47-K51 PolarHBondContact O-N 3.02Å; L48-K51 PolarHBondContact O-N 3.5Å
52F84.6Confident83.6Confident123 Ų12394.1 Ų94.154%0.53948%0.48SS..Hα-helixtrans-113.80.6-173.6-62.2-75.3000114.1L48 F54L48-F52 HydrophobicContact CD2-CD2 3.97Å; L48-F52 HydrophobicContact CD2-CE2 3.93Å; L48-F52 HydrophobicContact CG-CE2 4.48Å; L48-F52 WeakPolarHBondContact O-CD2 3.25Å; L48-F52 PolarHBondContact O-N 3.04Å; F52-F54 VanDerWaalsContact C-N 3.28Å; F52-F54 HydrophobicContact CB-CD2 3.75Å; F52-F54 HydrophobicContact CB-CE2 3.81Å; F52-F54 HydrophobicContact CG-CE2 4.46Å; F52-F54 PolarHBondContact O-N 3.46Å
53G85.3Confident82.9Confident65 Ų6593.6 Ų93.667%0.6747%0.472SS*.  trans70.716.4177.200000115.2R49 S55R49-G53 VanDerWaalsContact O-CA 3.32Å; R49-G53 WeakPolarHBondContact O-CA 3.37Å; R49-G53 PolarHBondContact O-N 3.38Å; G53-S55 PolarHBondContact O-N 2.88Å
54F82.3Confident81.9Confident73 Ų7395.9 Ų95.932%0.3248%0.475SS..  trans-64.5131.3-179.1-78.5-61.2000112.7R49 F52 D58 Y59 L62R49-F54 HydrophobicContact CG-CB 4.41Å; R49-F54 PolarHBondContact NE-O 3.28Å; R49-F54 PolarHBondContact O-N 3.01Å; F52-F54 VanDerWaalsContact C-N 3.28Å; F52-F54 HydrophobicContact CB-CD2 3.75Å; F52-F54 HydrophobicContact CB-CE2 3.81Å; F52-F54 HydrophobicContact CG-CE2 4.46Å; F52-F54 PolarHBondContact O-N 3.46Å; F54-D58 HydrophobicContact CD1-CB 3.74Å; F54-D58 HydrophobicContact CE1-CB 4.49Å; F54-Y59 HydrophobicContact CB-CD2 4.47Å; F54-L62 HydrophobicContact CE1-CD1 4.46Å; F54-L62 HydrophobicContact CZ-CD1 4.36Å
55S81.6Confident81Confident52 Ų5295.4 Ų95.436%0.36447%0.474SS..  trans-63160.3165.3-176.50000110.4G53 E57 D58 Y59G53-S55 PolarHBondContact O-N 2.88Å; S55-E57 PolarHBondContact O-N 3.28Å; S55-E57 PolarHBondContact OG-N 3.04Å; S55-D58 VanDerWaalsContact CB-OD2 3.25Å; S55-D58 WeakPolarHBondContact CB-OD2 3.41Å; S55-D58 PolarHBondContact N-OD2 3.49Å; S55-Y59 PolarHBondContact O-N 3.37Å
56A78.7Confident80Confident52 Ų5292 Ų9243%0.4347%0.468SS..Hα-helixtrans-61.6-34.2172.400000111.2S60A56-S60 PolarHBondContact O-N 3.28Å; A56-S60 VanDerWaalsContact O-N 3.13Å
57E79.9Confident78.8Confident146 Ų14698.1 Ų98.168%0.68249%0.49SS*.Hα-helixtrans-67.9-48.8179.1-69.4165.3169.900111.2S55 Y59 S60 E61S55-E57 PolarHBondContact O-N 3.28Å; S55-E57 PolarHBondContact OG-N 3.04Å; E57-Y59 PolarHBondContact O-N 2.94Å; E57-S60 PolarHBondContact O-N 3.06Å; E57-S60 PolarHBondContact O-OG 2.89Å; E57-E61 PolarHBondContact O-N 3.37Å
58D81Confident77.2Confident82 Ų82100 Ų10044%0.43950%0.498SS..Hα-helixtrans-56.1-41.4176.7-57.4-33.9000111.6F54 S55 E61 L62F54-D58 HydrophobicContact CD1-CB 3.74Å; F54-D58 HydrophobicContact CE1-CB 4.49Å; S55-D58 VanDerWaalsContact CB-OD2 3.25Å; S55-D58 WeakPolarHBondContact CB-OD2 3.41Å; S55-D58 PolarHBondContact N-OD2 3.49Å; D58-E61 PolarHBondContact O-N 2.85Å; D58-L62 WeakPolarHBondContact O-CB 3.33Å; D58-L62 PolarHBondContact O-N 3.47Å
59Y75.1Confident75.6Confident51 Ų51104 Ų10420%0.251%0.514CS..Hα-helixtrans-66.7-39.6179-149-82.4000111.7R45 L48 R49 F54 S55 E57 L62 E63R45-Y59 HydrophobicContact CG-CD1 4.15Å; R45-Y59 HydrophobicContact CG-CE1 3.79Å; R45-Y59 HydrophobicContact CG-CE2 4.37Å; L48-Y59 HydrophobicContact CB-CE2 4.23Å; R49-Y59 HydrophobicContact CG-CD2 4.02Å; R49-Y59 HydrophobicContact CG-CE2 4.48Å; F54-Y59 HydrophobicContact CB-CD2 4.47Å; S55-Y59 PolarHBondContact O-N 3.37Å; E57-Y59 PolarHBondContact O-N 2.94Å; Y59-L62 PolarHBondContact O-N 3.47Å; Y59-E63 HydrophobicContact CD1-CG 4.15Å; Y59-E63 HydrophobicContact CE1-CG 4.21Å; Y59-E63 VanDerWaalsContact CE1-OE1 3.3Å; Y59-E63 WeakPolarHBondContact CE1-OE1 3.36Å; Y59-E63 WeakPolarHBondContact O-CG 3.38Å; Y59-E63 PolarHBondContact O-N 2.84Å
60S78.9Confident74.3Confident61 Ų61109.2 Ų109.243%0.42753%0.534SS..Hα-helixtrans-68.9-36.3177.871.40000112.7A56 E57 E63 R64A56-S60 PolarHBondContact O-N 3.28Å; A56-S60 VanDerWaalsContact O-N 3.13Å; E57-S60 PolarHBondContact O-N 3.06Å; E57-S60 PolarHBondContact O-OG 2.89Å; S60-E63 PolarHBondContact O-N 3.3Å; S60-R64 PolarHBondContact O-N 3.33Å
61E80.8Confident72.9Confident91 Ų91100 Ų10043%0.42550%0.501SS..Hα-helixtrans-68.1-41.4175.7-172.558.1-147.400110.5E57 D58 R64 Q65E57-E61 PolarHBondContact O-N 3.37Å; D58-E61 PolarHBondContact O-N 2.85Å; E61-R64 WeakPolarHBondContact O-CB 3.33Å; E61-R64 PolarHBondContact O-N 2.88Å; E61-Q65 WeakPolarHBondContact O-CB 3.37Å; E61-Q65 WeakPolarHBondContact O-CG 3.09Å; E61-Q65 PolarHBondContact O-N 3.22Å; E61-Q65 PolarHBondContact OE1-NE2 2.89Å
62L77.7Confident71.6Confident99 Ų9994.4 Ų94.452%0.51849%0.491SS..Hα-helixtrans-66.8-38.6177.4-144.9144.6000111.8F54 D58 Y59 Q65 A66F54-L62 HydrophobicContact CE1-CD1 4.46Å; F54-L62 HydrophobicContact CZ-CD1 4.36Å; D58-L62 WeakPolarHBondContact O-CB 3.33Å; D58-L62 PolarHBondContact O-N 3.47Å; Y59-L62 PolarHBondContact O-N 3.47Å; L62-Q65 PolarHBondContact O-N 3.16Å; L62-A66 WeakPolarHBondContact O-CB 3.38Å; L62-A66 PolarHBondContact O-N 3.42Å
63E74.5Confident70.7Confident82 Ų8292.2 Ų92.238%0.38349%0.49SS..Hα-helixtrans-61.9-46.9171.3-78.6-177.7167.300111.3R45 Y59 S60 Q65 A66 E67R45-E63 IonicContact CZ-OE1 3.5Å; R45-E63 IonicContact CZ-OE2 3.97Å; R45-E63 IonicContact NE-OE1 3.6Å; R45-E63 IonicContact NH2-OE1 2.71Å; R45-E63 PolarHBondContact NH2-OE1 2.93Å; R45-E63 IonicContact NH2-OE2 3.19Å; R45-E63 PolarHBondContact NH2-OE2 3.16Å; Y59-E63 HydrophobicContact CD1-CG 4.15Å; Y59-E63 HydrophobicContact CE1-CG 4.21Å; Y59-E63 VanDerWaalsContact CE1-OE1 3.3Å; Y59-E63 WeakPolarHBondContact CE1-OE1 3.36Å; Y59-E63 WeakPolarHBondContact O-CG 3.38Å; Y59-E63 PolarHBondContact O-N 2.84Å; S60-E63 PolarHBondContact O-N 3.3Å; E63-Q65 VanDerWaalsContact C-N 3.33Å; E63-Q65 PolarHBondContact O-N 2.91Å; E63-A66 PolarHBondContact O-N 3.48Å; E63-E67 PolarHBondContact O-N 3.35Å
64R70.1Confident70.1Confident186 Ų18689.9 Ų89.970%0.70246%0.462SS*.Hα-helixtrans-58.6-41176-91-177.571.5139.8-1.7113.2S60 E61 P68S60-R64 PolarHBondContact O-N 3.33Å; E61-R64 WeakPolarHBondContact O-CB 3.33Å; E61-R64 PolarHBondContact O-N 2.88Å; R64-P68 WeakPolarHBondContact O-CD 3.3Å
65Q68.5Low70Confident113 Ų11392.2 Ų92.253%0.52847%0.469SS..Hα-helixtrans-78.8-27.8-178.1-69.7-177.38.300112.7E61 L62 E63 H69E61-Q65 WeakPolarHBondContact O-CB 3.37Å; E61-Q65 WeakPolarHBondContact O-CG 3.09Å; E61-Q65 PolarHBondContact O-N 3.22Å; E61-Q65 PolarHBondContact OE1-NE2 2.89Å; L62-Q65 PolarHBondContact O-N 3.16Å; E63-Q65 VanDerWaalsContact C-N 3.33Å; E63-Q65 PolarHBondContact O-N 2.91Å; Q65-H69 PolarHBondContact O-ND1 3.32Å
66A63.9Low70.2Confident33 Ų3394.4 Ų94.427%0.27347%0.472SS..Hα-helixtrans-76.5-32.7-178.800000113.7L62 E63 H69L62-A66 WeakPolarHBondContact O-CB 3.38Å; L62-A66 PolarHBondContact O-N 3.42Å; E63-A66 PolarHBondContact O-N 3.48Å; A66-H69 PolarHBondContact O-N 3.42Å
67E58.3Low70.5Confident155 Ų155100.2 Ų100.272%0.72449%0.488SS*.Hα-helixtrans-57.6-45.4-175.6-106.4165.2162.400114.8E63E63-E67 PolarHBondContact O-N 3.35Å
68P55.3Low70.8Confident88 Ų8894.3 Ų94.357%0.57146%0.463SS*.Hα-helixtrans-76.7-23.1-178.7-15.830.1000114.7R64R64-P68 WeakPolarHBondContact O-CD 3.3Å
69H53.2Low71.1Confident152 Ų15290.7 Ų90.770%0.70445%0.446SS*.Hα-helixtrans-97.2-5.4-166.7-67.794.3000114.4Q65 A66 T71Q65-H69 PolarHBondContact O-ND1 3.32Å; A66-H69 PolarHBondContact O-N 3.42Å; H69-T71 PolarHBondContact O-N 3Å; H69-T71 VanDerWaalsContact O-N 3.14Å
70R55.2Low71.9Confident211 Ų21190.6 Ų90.680%0.79645%0.452SS*.THydrogen-bonded Turntrans-63.7-18.7-177.4-81.7-170.9177.2172.83.5114.7
71T55.8Low72.5Confident19 Ų1992 Ų9212%0.11745%0.451CS..THydrogen-bonded Turntrans-113.21.5-16769.30000114.3H69 Q74 H206 G208H69-T71 PolarHBondContact O-N 3Å; H69-T71 VanDerWaalsContact O-N 3.14Å; T71-Q74 VanDerWaalsContact CB-NE2 3.27Å; T71-Q74 PolarHBondContact O-NE2 3.41Å; T71-Q74 VanDerWaalsContact OG1-CG 3.25Å; T71-Q74 WeakPolarHBondContact OG1-CG 3.28Å; T71-Q74 PolarHBondContact OG1-NE2 2.94Å; T71-H206 WeakPolarHBondContact CG2-CE1 3.14Å; T71-H206 VanDerWaalsContact CG2-NE2 3.28Å; T71-H206 WeakPolarHBondContact CG2-NE2 3.11Å; T71-G208 PolarHBondContact O-N 2.99Å
72G63.1Low73Confident49 Ų4987.8 Ų87.851%0.50543%0.431SS..  trans73.7-167.1-176.500000114Q74G72-Q74 PolarHBondContact O-N 3.29Å
73C65.7Low73.7Confident76 Ų7684.7 Ų84.751%0.51441%0.414SS..  trans-73.692.8-177.9-173.80000111.5
74Q71.6Confident74.7Confident17 Ų1781.7 Ų81.78%0.07940%0.403CS..  trans-74.8-25-180-66.5-64.2-35.700113.7T71 G72 K76 G79 H206T71-Q74 VanDerWaalsContact CB-NE2 3.27Å; T71-Q74 PolarHBondContact O-NE2 3.41Å; T71-Q74 VanDerWaalsContact OG1-CG 3.25Å; T71-Q74 WeakPolarHBondContact OG1-CG 3.28Å; T71-Q74 PolarHBondContact OG1-NE2 2.94Å; G72-Q74 PolarHBondContact O-N 3.29Å; Q74-K76 PolarHBondContact O-N 3.4Å; Q74-G79 WeakPolarHBondContact O-CA 3.48Å; Q74-H206 PolarHBondContact NE2-O 2.86Å
75W81.1Confident75.8Confident121 Ų12173.1 Ų73.146%0.45837%0.371SS..  trans-9774.4-173.6-61.2106.9000112F83 A96W75-F83 HydrophobicContact CH2-CB 4.4Å; W75-F83 AromaticContact CH2-CD1 3.88Å; W75-F83 HydrophobicContact CH2-CD1 3.88Å; W75-F83 AromaticContact CH2-CD2 3.96Å; W75-F83 HydrophobicContact CH2-CD2 3.96Å; W75-F83 HydrophobicContact CH2-CE1 4.12Å; W75-F83 HydrophobicContact CH2-CE2 4.2Å; W75-F83 AromaticContact CH2-CG 3.8Å; W75-F83 HydrophobicContact CH2-CG 3.8Å; W75-F83 HydrophobicContact CH2-CZ 4.28Å; W75-F83 HydrophobicContact CZ3-CB 4.24Å; W75-F83 AromaticContact CZ3-CD1 3.9Å; W75-F83 HydrophobicContact CZ3-CD1 3.9Å; W75-F83 HydrophobicContact CZ3-CE1 4.44Å; W75-F83 AromaticContact CZ3-CG 3.98Å; W75-F83 HydrophobicContact CZ3-CG 3.98Å; W75-A96 HydrophobicContact CZ2-CB 4.29Å
76K85.3Confident77Confident99 Ų9968 Ų6843%0.4335%0.347SS..SBendtrans-128.1168.8162.9-69.8-177175.5-178.90108.3Q74 A78 G79 S80 Q212Q74-K76 PolarHBondContact O-N 3.4Å; K76-A78 VanDerWaalsContact C-N 3.31Å; K76-A78 PolarHBondContact O-N 2.9Å; K76-A78 VanDerWaalsContact O-N 3.1Å; K76-G79 WeakPolarHBondContact O-CA 3.49Å; K76-G79 PolarHBondContact O-N 3.36Å; K76-S80 PolarHBondContact O-N 3.48Å; K76-S80 PolarHBondContact O-OG 3.08Å; K76-Q212 HydrophobicContact CD-CG 4.35Å; K76-Q212 VanDerWaalsContact CD-NE2 3.3Å
77F86.4Confident78.5Confident174 Ų17467.4 Ų67.476%0.76334%0.34SS*.Hα-helixtrans-46.9-48.7-173.5-178.9-99.2000114.3G79 S80 F81F77-G79 VanDerWaalsContact C-N 3.33Å; F77-G79 PolarHBondContact O-N 2.91Å; F77-S80 PolarHBondContact O-N 2.94Å; F77-F81 VanDerWaalsContact O-CB 3.27Å; F77-F81 WeakPolarHBondContact O-CB 3.4Å; F77-F81 PolarHBondContact O-N 2.96Å
78A85.9Confident80.4Confident21 Ų2161.6 Ų61.617%0.17431%0.314CS..Hα-helixtrans-61.9-37.9178.200000113.3K76 Y82 L211 V218 F222K76-A78 VanDerWaalsContact C-N 3.31Å; K76-A78 PolarHBondContact O-N 2.9Å; K76-A78 VanDerWaalsContact O-N 3.1Å; A78-Y82 PolarHBondContact O-N 3.47Å; A78-L211 HydrophobicContact CB-CD1 4.26Å; A78-L211 HydrophobicContact CB-CD2 3.95Å; A78-L211 HydrophobicContact CB-CG 3.79Å; A78-V218 HydrophobicContact CB-CG1 4.43Å; A78-F222 WeakPolarHBondContact O-CZ 3.39Å
79G87.4Confident82.3Confident7 Ų757.7 Ų57.77%0.07229%0.288CS..Hα-helixtrans-77.6-39.118000000111.8Q74 K76 F77 F81 Y82 F83 L211Q74-G79 WeakPolarHBondContact O-CA 3.48Å; K76-G79 WeakPolarHBondContact O-CA 3.49Å; K76-G79 PolarHBondContact O-N 3.36Å; F77-G79 VanDerWaalsContact C-N 3.33Å; F77-G79 PolarHBondContact O-N 2.91Å; G79-F81 VanDerWaalsContact C-N 3.28Å; G79-F81 PolarHBondContact O-N 3.49Å; G79-Y82 PolarHBondContact O-N 3.28Å; G79-F83 WeakPolarHBondContact O-CB 3.35Å; G79-F83 PolarHBondContact O-N 3.16Å; G79-L211 VanDerWaalsContact N-CD2 3.34Å
80S91.1Very high84.3Confident48 Ų4853.6 Ų53.634%0.33627%0.274SS..Hα-helixtrans-61.2-37.4170.1-580000111.8K76 F77 A84K76-S80 PolarHBondContact O-N 3.48Å; K76-S80 PolarHBondContact O-OG 3.08Å; F77-S80 PolarHBondContact O-N 2.94Å; S80-A84 VanDerWaalsContact O-CB 3.29Å; S80-A84 WeakPolarHBondContact O-CB 3.4Å; S80-A84 PolarHBondContact O-N 3.21Å
81F91.4Very high86.2Confident90 Ų9043.8 Ų43.840%0.39524%0.238SC..Hα-helixtrans-70.5-41175.8-172-101.6000111.9F77 G79 A84 I85 F222F77-F81 VanDerWaalsContact O-CB 3.27Å; F77-F81 WeakPolarHBondContact O-CB 3.4Å; F77-F81 PolarHBondContact O-N 2.96Å; G79-F81 VanDerWaalsContact C-N 3.28Å; G79-F81 PolarHBondContact O-N 3.49Å; F81-A84 WeakPolarHBondContact O-CB 3.49Å; F81-A84 PolarHBondContact O-N 3.14Å; F81-I85 HydrophobicContact CD1-CD1 3.7Å; F81-I85 HydrophobicContact CD1-CG1 4.38Å; F81-I85 HydrophobicContact CE1-CD1 3.38Å; F81-I85 HydrophobicContact CE1-CG1 4.15Å; F81-I85 HydrophobicContact CZ-CD1 4.07Å; F81-I85 HydrophobicContact CZ-CG1 4.46Å; F81-I85 WeakPolarHBondContact O-CG1 3.39Å; F81-I85 PolarHBondContact O-N 3.04Å; F81-F222 AromaticContact CD1-CD2 3.61Å; F81-F222 HydrophobicContact CD1-CD2 3.61Å; F81-F222 AromaticContact CD1-CE2 3.47Å; F81-F222 HydrophobicContact CD1-CE2 3.47Å; F81-F222 VanDerWaalsContact CD1-CE2 3.47Å; F81-F222 HydrophobicContact CD1-CG 4.34Å; F81-F222 HydrophobicContact CD1-CZ 4.13Å; F81-F222 AromaticContact CE1-CD2 3.69Å; F81-F222 HydrophobicContact CE1-CD2 3.69Å; F81-F222 HydrophobicContact CE1-CE2 4.06Å; F81-F222 HydrophobicContact CE1-CG 4.3Å
82Y90.9Very high87.9Confident4 Ų445 Ų452%0.01626%0.255CS..Hα-helixtrans-61-47.2172.7-174.5-123.7000111.7A78 G79 A84 I85 T86 Y93 H95 V203 A204 L205 F222 I225A78-Y82 PolarHBondContact O-N 3.47Å; G79-Y82 PolarHBondContact O-N 3.28Å; Y82-A84 VanDerWaalsContact C-N 3.34Å; Y82-A84 PolarHBondContact O-N 3.38Å; Y82-I85 PolarHBondContact O-N 3.33Å; Y82-T86 HydrophobicContact CD2-CG2 4.37Å; Y82-T86 HydrophobicContact CE1-CG2 4.4Å; Y82-T86 HydrophobicContact CE2-CG2 4.19Å; Y82-T86 WeakPolarHBondContact O-CG2 3.39Å; Y82-T86 PolarHBondContact O-N 3.29Å; Y82-T86 PolarHBondContact O-OG1 3.42Å; Y82-Y93 HydrophobicContact CE1-CD2 4.42Å; Y82-Y93 HydrophobicContact CE1-CE2 4.46Å; Y82-Y93 AromaticContact CZ-CE2 3.84Å; Y82-Y93 WeakPolarHBondContact OH-CE2 3.48Å; Y82-H95 AromaticContact CD1-CE1 3.84Å; Y82-H95 AromaticContact CD1-NE2 3.58Å; Y82-H95 AromaticContact CE1-CE1 3.42Å; Y82-H95 VanDerWaalsContact CE1-CE1 3.42Å; Y82-H95 WeakPolarHBondContact CE1-CE1 3.23Å; Y82-H95 AromaticContact CE1-NE2 3.48Å; Y82-H95 WeakPolarHBondContact CE1-NE2 3.18Å; Y82-V203 HydrophobicContact CE1-CG1 3.98Å; Y82-A204 PolarHBondContact OH-O 2.82Å; Y82-L205 HydrophobicContact CD2-CD1 4.47Å; Y82-L205 HydrophobicContact CE2-CD1 4.48Å; Y82-F222 AromaticContact CD2-CD1 3.82Å; Y82-F222 HydrophobicContact CD2-CD1 3.82Å; Y82-F222 AromaticContact CD2-CE1 3.38Å; Y82-F222 HydrophobicContact CD2-CE1 3.38Å; Y82-F222 HydrophobicContact CD2-CZ 4.46Å; Y82-F222 HydrophobicContact CE2-CE1 4.32Å; Y82-F222 AromaticContact CG-CE1 3.85Å; Y82-F222 HydrophobicContact CG-CE1 3.85Å; Y82-I225 HydrophobicContact CE2-CD1 3.76Å
83F92.3Very high89.2Confident33 Ų3343.1 Ų43.115%0.14523%0.232CC..Hα-helixtrans-55.5-49.1172.4174.7-100.3000110.9W75 G79 I85 T86 V87 A96 P98W75-F83 HydrophobicContact CH2-CB 4.4Å; W75-F83 AromaticContact CH2-CD1 3.88Å; W75-F83 HydrophobicContact CH2-CD1 3.88Å; W75-F83 AromaticContact CH2-CD2 3.96Å; W75-F83 HydrophobicContact CH2-CD2 3.96Å; W75-F83 HydrophobicContact CH2-CE1 4.12Å; W75-F83 HydrophobicContact CH2-CE2 4.2Å; W75-F83 AromaticContact CH2-CG 3.8Å; W75-F83 HydrophobicContact CH2-CG 3.8Å; W75-F83 HydrophobicContact CH2-CZ 4.28Å; W75-F83 HydrophobicContact CZ3-CB 4.24Å; W75-F83 AromaticContact CZ3-CD1 3.9Å; W75-F83 HydrophobicContact CZ3-CD1 3.9Å; W75-F83 HydrophobicContact CZ3-CE1 4.44Å; W75-F83 AromaticContact CZ3-CG 3.98Å; W75-F83 HydrophobicContact CZ3-CG 3.98Å; G79-F83 WeakPolarHBondContact O-CB 3.35Å; G79-F83 PolarHBondContact O-N 3.16Å; F83-I85 PolarHBondContact O-N 2.86Å; F83-T86 WeakPolarHBondContact CA-OG1 3.23Å; F83-T86 PolarHBondContact O-N 2.9Å; F83-T86 PolarHBondContact O-OG1 3.38Å; F83-V87 HydrophobicContact CD1-CG2 4.25Å; F83-V87 HydrophobicContact CD2-CG2 4.05Å; F83-V87 HydrophobicContact CE1-CG2 3.86Å; F83-V87 HydrophobicContact CE2-CG2 3.63Å; F83-V87 HydrophobicContact CG-CG2 4.34Å; F83-V87 HydrophobicContact CZ-CG2 3.52Å; F83-V87 WeakPolarHBondContact O-CB 3.26Å; F83-V87 VanDerWaalsContact O-CG2 3.26Å; F83-V87 WeakPolarHBondContact O-CG2 3.35Å; F83-V87 PolarHBondContact O-N 2.8Å; F83-A96 WeakPolarHBondContact CD2-O 3.28Å; F83-A96 WeakPolarHBondContact CE2-O 3.39Å; F83-P98 HydrophobicContact CZ-CG 4.47Å
84A95.3Very high90.2Very high20 Ų2042.4 Ų42.417%0.16524%0.237CC..Hα-helixtrans-57-46177.700000112.7S80 F81 Y82 V87 I88 Y110S80-A84 VanDerWaalsContact O-CB 3.29Å; S80-A84 WeakPolarHBondContact O-CB 3.4Å; S80-A84 PolarHBondContact O-N 3.21Å; F81-A84 WeakPolarHBondContact O-CB 3.49Å; F81-A84 PolarHBondContact O-N 3.14Å; Y82-A84 VanDerWaalsContact C-N 3.34Å; Y82-A84 PolarHBondContact O-N 3.38Å; A84-V87 PolarHBondContact O-N 2.94Å; A84-I88 WeakPolarHBondContact O-CG1 3.23Å; A84-I88 PolarHBondContact O-N 3.05Å; A84-I88 VanDerWaalsContact O-N 3.07Å; A84-Y110 HydrophobicContact CB-CE1 4.19Å
85I94.4Very high90.6Very high6 Ų643.2 Ų43.23%0.03124%0.241CC..Hα-helixtrans-57.4-54.7174.3-70.4168.8000110.2F81 Y82 F83 V87 I88 T89 F222 I225 L226F81-I85 HydrophobicContact CD1-CD1 3.7Å; F81-I85 HydrophobicContact CD1-CG1 4.38Å; F81-I85 HydrophobicContact CE1-CD1 3.38Å; F81-I85 HydrophobicContact CE1-CG1 4.15Å; F81-I85 HydrophobicContact CZ-CD1 4.07Å; F81-I85 HydrophobicContact CZ-CG1 4.46Å; F81-I85 WeakPolarHBondContact O-CG1 3.39Å; F81-I85 PolarHBondContact O-N 3.04Å; Y82-I85 PolarHBondContact O-N 3.33Å; F83-I85 PolarHBondContact O-N 2.86Å; I85-V87 PolarHBondContact O-N 3.34Å; I85-I88 WeakPolarHBondContact O-CG1 3.34Å; I85-I88 PolarHBondContact O-N 2.89Å; I85-T89 HydrophobicContact CG2-CG2 4.1Å; I85-T89 VanDerWaalsContact O-CB 3.3Å; I85-T89 WeakPolarHBondContact O-CB 3.48Å; I85-T89 VanDerWaalsContact O-CG2 3.29Å; I85-T89 WeakPolarHBondContact O-CG2 3.45Å; I85-T89 PolarHBondContact O-N 3.26Å; I85-T89 PolarHBondContact O-OG1 3.05Å; I85-F222 HydrophobicContact CD1-CB 4.03Å; I85-F222 HydrophobicContact CD1-CD1 4.13Å; I85-F222 HydrophobicContact CD1-CD2 4.47Å; I85-F222 HydrophobicContact CD1-CG 3.96Å; I85-I225 HydrophobicContact CG2-CG2 4.12Å; I85-L226 HydrophobicContact CG2-CD2 4.38Å
86T94.3Very high90.7Very high4 Ų438.2 Ų38.23%0.02523%0.226CC..Hα-helixtrans-61.7-30.7-174.959.30000112.9Y82 F83 T90 I91 G92 Y93Y82-T86 HydrophobicContact CD2-CG2 4.37Å; Y82-T86 HydrophobicContact CE1-CG2 4.4Å; Y82-T86 HydrophobicContact CE2-CG2 4.19Å; Y82-T86 WeakPolarHBondContact O-CG2 3.39Å; Y82-T86 PolarHBondContact O-N 3.29Å; Y82-T86 PolarHBondContact O-OG1 3.42Å; F83-T86 WeakPolarHBondContact CA-OG1 3.23Å; F83-T86 PolarHBondContact O-N 2.9Å; F83-T86 PolarHBondContact O-OG1 3.38Å; T86-T90 PolarHBondContact O-N 3.2Å; T86-I91 PolarHBondContact O-N 3.23Å; T86-G92 PolarHBondContact O-N 3.29Å; T86-Y93 HydrophobicContact CG2-CD2 3.69Å; T86-Y93 HydrophobicContact CG2-CE2 3.71Å
87V95.6Very high90.8Very high21 Ų2136.6 Ų36.613%0.12723%0.231CC..Hα-helixtrans-74-50.7177.4169.70000111.9F83 A84 I85 T89 T90 Y110 V111F83-V87 HydrophobicContact CD1-CG2 4.25Å; F83-V87 HydrophobicContact CD2-CG2 4.05Å; F83-V87 HydrophobicContact CE1-CG2 3.86Å; F83-V87 HydrophobicContact CE2-CG2 3.63Å; F83-V87 HydrophobicContact CG-CG2 4.34Å; F83-V87 HydrophobicContact CZ-CG2 3.52Å; F83-V87 WeakPolarHBondContact O-CB 3.26Å; F83-V87 VanDerWaalsContact O-CG2 3.26Å; F83-V87 WeakPolarHBondContact O-CG2 3.35Å; F83-V87 PolarHBondContact O-N 2.8Å; A84-V87 PolarHBondContact O-N 2.94Å; I85-V87 PolarHBondContact O-N 3.34Å; V87-T89 VanDerWaalsContact C-N 3.32Å; V87-T89 PolarHBondContact O-N 2.79Å; V87-T90 PolarHBondContact O-N 3.39Å; V87-Y110 HydrophobicContact CG1-CD1 4.11Å; V87-Y110 HydrophobicContact CG1-CE1 4.34Å; V87-V111 HydrophobicContact CG1-CG2 3.18Å
88I96.3Very high90.9Very high34 Ų3429.7 Ų29.717%0.17420%0.203CC..Hα-helixtrans-72.4-27-178.167.2-174.3000113A84 I85 T90 Y110A84-I88 WeakPolarHBondContact O-CG1 3.23Å; A84-I88 PolarHBondContact O-N 3.05Å; A84-I88 VanDerWaalsContact O-N 3.07Å; I85-I88 WeakPolarHBondContact O-CG1 3.34Å; I85-I88 PolarHBondContact O-N 2.89Å; I88-T90 VanDerWaalsContact C-N 3.27Å; I88-Y110 HydrophobicContact CG2-CD1 4.1Å; I88-Y110 HydrophobicContact CG2-CE1 3.27Å; I88-Y110 HydrophobicContact CG2-CE2 4.36Å; I88-Y110 VanDerWaalsContact CG2-CZ 3.41Å; I88-Y110 WeakPolarHBondContact CG2-OH 3.26Å
89T95.3Very high91Very high5 Ų531.7 Ų31.73%0.03123%0.227CC..THydrogen-bonded Turntrans-86.72.717559.30000113.2I85 V87 I91 T118 F122 T196 L229I85-T89 HydrophobicContact CG2-CG2 4.1Å; I85-T89 VanDerWaalsContact O-CB 3.3Å; I85-T89 WeakPolarHBondContact O-CB 3.48Å; I85-T89 VanDerWaalsContact O-CG2 3.29Å; I85-T89 WeakPolarHBondContact O-CG2 3.45Å; I85-T89 PolarHBondContact O-N 3.26Å; I85-T89 PolarHBondContact O-OG1 3.05Å; V87-T89 VanDerWaalsContact C-N 3.32Å; V87-T89 PolarHBondContact O-N 2.79Å; T89-I91 PolarHBondContact O-N 3.01Å; T89-I91 VanDerWaalsContact O-N 3.14Å; T89-I91 WeakPolarHBondContact OG1-CD1 3.42Å; T89-I91 WeakPolarHBondContact OG1-CG1 3.28Å; T89-T118 HydrophobicContact CG2-CG2 4.22Å; T89-F122 HydrophobicContact CG2-CE2 3.98Å; T89-F122 HydrophobicContact CG2-CZ 3.99Å; T89-T196 VanDerWaalsContact O-CG2 3.28Å; T89-T196 WeakPolarHBondContact O-CG2 3.49Å; T89-L229 HydrophobicContact CG2-CD1 3.59Å
90T96Very high91.2Very high67 Ų6735.5 Ų35.541%0.41125%0.248SC..THydrogen-bonded Turntrans56.424.1179.668.60000115.1T86 V87 I88 I115 T196T86-T90 PolarHBondContact O-N 3.2Å; V87-T90 PolarHBondContact O-N 3.39Å; I88-T90 VanDerWaalsContact C-N 3.27Å; T90-I115 HydrophobicContact CG2-CD1 3.46Å; T90-I115 VanDerWaalsContact CG2-CD1 3.46Å; T90-I115 HydrophobicContact CG2-CG1 3.69Å; T90-I115 HydrophobicContact CG2-CG2 4.18Å; T90-T196 VanDerWaalsContact O-O 3.1Å
91I95.6Very high91.4Very high4 Ų439 Ų392%0.02126%0.263CS..  trans-73.7-51.8173.2-59.3166.9000109.9T86 T89 Y93 T193 T196 G198 I225 L229T86-I91 PolarHBondContact O-N 3.23Å; T89-I91 PolarHBondContact O-N 3.01Å; T89-I91 VanDerWaalsContact O-N 3.14Å; T89-I91 WeakPolarHBondContact OG1-CD1 3.42Å; T89-I91 WeakPolarHBondContact OG1-CG1 3.28Å; I91-Y93 HydrophobicContact CG2-CD1 3.9Å; I91-Y93 HydrophobicContact CG2-CD2 4.1Å; I91-Y93 HydrophobicContact CG2-CE1 3.57Å; I91-Y93 HydrophobicContact CG2-CE2 3.78Å; I91-Y93 HydrophobicContact CG2-CG 4.16Å; I91-Y93 PolarHBondContact O-N 2.93Å; I91-T193 HydrophobicContact CD1-CG2 4.17Å; I91-T196 HydrophobicContact CG1-CG2 4.16Å; I91-G198 WeakPolarHBondContact O-CA 3.42Å; I91-I225 HydrophobicContact CD1-CG2 3.66Å; I91-L229 HydrophobicContact CD1-CD1 4.24Å
92G91.8Very high91.6Very high46 Ų4639 Ų3947%0.47427%0.274SS..  trans56.446.6169.100000117.5T86 G94T86-G92 PolarHBondContact O-N 3.29Å; G92-G94 PolarHBondContact O-N 3.21Å
93Y90Very high91.8Very high8 Ų839.6 Ų39.63%0.03128%0.282CS..  trans-48.8-19.8-179.1-64.6-60000117.8Y82 T86 I91 H95 Y189 T193 G198 G200 V203Y82-Y93 HydrophobicContact CE1-CD2 4.42Å; Y82-Y93 HydrophobicContact CE1-CE2 4.46Å; Y82-Y93 AromaticContact CZ-CE2 3.84Å; Y82-Y93 WeakPolarHBondContact OH-CE2 3.48Å; T86-Y93 HydrophobicContact CG2-CD2 3.69Å; T86-Y93 HydrophobicContact CG2-CE2 3.71Å; I91-Y93 HydrophobicContact CG2-CD1 3.9Å; I91-Y93 HydrophobicContact CG2-CD2 4.1Å; I91-Y93 HydrophobicContact CG2-CE1 3.57Å; I91-Y93 HydrophobicContact CG2-CE2 3.78Å; I91-Y93 HydrophobicContact CG2-CG 4.16Å; I91-Y93 PolarHBondContact O-N 2.93Å; Y93-H95 WeakPolarHBondContact CB-ND1 3.28Å; Y93-H95 AromaticContact CD2-CE1 3.88Å; Y93-H95 AromaticContact CD2-ND1 3.89Å; Y93-H95 AromaticContact CG-ND1 3.99Å; Y93-H95 PolarHBondContact O-N 3.14Å; Y93-Y189 HydrophobicContact CE1-CE2 4.2Å; Y93-Y189 AromaticContact CZ-CE2 3.96Å; Y93-Y189 WeakPolarHBondContact OH-CE2 3.27Å; Y93-Y189 PolarHBondContact OH-OH 3.33Å; Y93-T193 WeakPolarHBondContact OH-CB 3.4Å; Y93-T193 WeakPolarHBondContact OH-CG2 3.47Å; Y93-T193 PolarHBondContact OH-OG1 3.04Å; Y93-G198 VanDerWaalsContact CA-O 3.28Å; Y93-G198 WeakPolarHBondContact CA-O 3.36Å; Y93-G200 VanDerWaalsContact O-CA 3.27Å; Y93-G200 WeakPolarHBondContact O-CA 3.45Å; Y93-V203 HydrophobicContact CD1-CG2 4.15Å; Y93-V203 HydrophobicContact CD2-CG1 4.25Å; Y93-V203 HydrophobicContact CD2-CG2 4.49Å; Y93-V203 HydrophobicContact CG-CG2 3.98Å
94G85.8Confident91.9Very high61 Ų6142.4 Ų42.463%0.62929%0.294SS*.SBendtrans72.6-5.5-179.500000116.3G92 A96G92-G94 PolarHBondContact O-N 3.21Å; G94-A96 PolarHBondContact O-N 3.07Å
95H81.1Confident92Very high34 Ų3444.9 Ų44.916%0.15731%0.307CS..SBendtrans-61.7-23.1174.369.4-81.3000113.8Y82 Y93 V203Y82-H95 AromaticContact CD1-CE1 3.84Å; Y82-H95 AromaticContact CD1-NE2 3.58Å; Y82-H95 AromaticContact CE1-CE1 3.42Å; Y82-H95 VanDerWaalsContact CE1-CE1 3.42Å; Y82-H95 WeakPolarHBondContact CE1-CE1 3.23Å; Y82-H95 AromaticContact CE1-NE2 3.48Å; Y82-H95 WeakPolarHBondContact CE1-NE2 3.18Å; Y93-H95 WeakPolarHBondContact CB-ND1 3.28Å; Y93-H95 AromaticContact CD2-CE1 3.88Å; Y93-H95 AromaticContact CD2-ND1 3.89Å; Y93-H95 AromaticContact CG-ND1 3.99Å; Y93-H95 PolarHBondContact O-N 3.14Å; H95-V203 HydrophobicContact CB-CG1 4.48Å; H95-V203 HydrophobicContact CB-CG2 4.15Å
96A82.9Confident92.1Very high16 Ų1651.1 Ų51.113%0.13233%0.334CS..SBendtrans-139.2129.617300000109.4W75 F83 G94W75-A96 HydrophobicContact CZ2-CB 4.29Å; F83-A96 WeakPolarHBondContact CD2-O 3.28Å; F83-A96 WeakPolarHBondContact CE2-O 3.39Å; G94-A96 PolarHBondContact O-N 3.07Å
97A87.1Confident92.2Very high65 Ų6552.1 Ų52.154%0.53734%0.341SS..  trans-139.1147.4177.400000110.3G99A97-G99 PolarHBondContact O-N 3.3Å; A97-G99 VanDerWaalsContact O-N 3.08Å
98P89.4Confident92.2Very high29 Ų2958.3 Ų58.319%0.18837%0.366CS..  trans-65.5112.6-179.725.7-32.7000110.4F83 K104 C107F83-P98 HydrophobicContact CZ-CG 4.47Å; P98-K104 HydrophobicContact CB-CG 4.32Å; P98-K104 HydrophobicContact CG-CG 4.07Å; P98-K104 VanDerWaalsContact O-CE 3.23Å; P98-K104 WeakPolarHBondContact O-CE 3.42Å; P98-K104 WeakPolarHBondContact O-CG 3.5Å; P98-C107 HydrophobicContact CG-CB 4.33Å
99G87.1Confident92.3Very high64 Ų6463.1 Ų63.166%0.6639%0.387SS*.  trans-73.9-30.9176.800000113.2A97 K104A97-G99 PolarHBondContact O-N 3.3Å; A97-G99 VanDerWaalsContact O-N 3.08Å; G99-K104 PolarHBondContact O-NZ 3.38Å
100T92.2Very high92.4Very high87 Ų8766.4 Ų66.453%0.53440%0.399SS..SBendtrans-83.1147.3-17761.60000112.4S102 G103 K104T100-S102 VanDerWaalsContact C-N 3.33Å; T100-S102 PolarHBondContact O-N 2.81Å; T100-G103 PolarHBondContact O-N 2.84Å; T100-G103 PolarHBondContact OG1-N 3.33Å; T100-G103 VanDerWaalsContact OG1-N 3.16Å; T100-K104 WeakPolarHBondContact O-CG 3.48Å; T100-K104 PolarHBondContact O-N 2.87Å
101D94.9Very high92.4Very high120 Ų12065.2 Ų65.264%0.64239%0.391SS*.Hα-helixtrans-65.5-37.5178.9-65.6-24.9000112.3G103 K104 V105D101-G103 PolarHBondContact O-N 3.22Å; D101-K104 PolarHBondContact O-N 3Å; D101-K104 IonicContact OD1-NZ 3.3Å; D101-K104 PolarHBondContact OD1-NZ 3.06Å; D101-V105 WeakPolarHBondContact O-CG2 3.25Å; D101-V105 PolarHBondContact O-N 3.4Å
102S95.6Very high92.4Very high90 Ų9070.7 Ų70.763%0.62942%0.42SS*.Hα-helixtrans-61.4-42172.155.80000112.2T100 V105 F106T100-S102 VanDerWaalsContact C-N 3.33Å; T100-S102 PolarHBondContact O-N 2.81Å; S102-V105 PolarHBondContact O-N 3.47Å; S102-F106 WeakPolarHBondContact O-CB 3.41Å; S102-F106 PolarHBondContact O-N 2.9Å
103G94.6Very high92.6Very high18 Ų1874.8 Ų74.819%0.18643%0.43CS..Hα-helixtrans-64.1-40.3176.200000112.6T100 D101 C107T100-G103 PolarHBondContact O-N 2.84Å; T100-G103 PolarHBondContact OG1-N 3.33Å; T100-G103 VanDerWaalsContact OG1-N 3.16Å; D101-G103 PolarHBondContact O-N 3.22Å; G103-C107 VanDerWaalsContact O-CB 3.27Å; G103-C107 WeakPolarHBondContact O-CB 3.33Å; G103-C107 PolarHBondContact O-N 2.72Å
104K95Very high93Very high91 Ų9174.8 Ų74.840%0.39643%0.433SS..Hα-helixtrans-64.7-43174.9-67.7168.9-165158.40111.8P98 G99 T100 D101 C107 K108P98-K104 HydrophobicContact CB-CG 4.32Å; P98-K104 HydrophobicContact CG-CG 4.07Å; P98-K104 VanDerWaalsContact O-CE 3.23Å; P98-K104 WeakPolarHBondContact O-CE 3.42Å; P98-K104 WeakPolarHBondContact O-CG 3.5Å; G99-K104 PolarHBondContact O-NZ 3.38Å; T100-K104 WeakPolarHBondContact O-CG 3.48Å; T100-K104 PolarHBondContact O-N 2.87Å; D101-K104 PolarHBondContact O-N 3Å; D101-K104 IonicContact OD1-NZ 3.3Å; D101-K104 PolarHBondContact OD1-NZ 3.06Å; K104-C107 PolarHBondContact O-N 2.91Å; K104-K108 WeakPolarHBondContact O-CG 3.37Å; K104-K108 PolarHBondContact O-N 3.33Å; K104-K108 VanDerWaalsContact O-N 3.17Å
105V97.6Very high93.5Very high73 Ų7374.2 Ų74.244%0.44242%0.415SS..Hα-helixtrans-63-48.5176.7171.70000110.6D101 S102 C107 K108 F109D101-V105 WeakPolarHBondContact O-CG2 3.25Å; D101-V105 PolarHBondContact O-N 3.4Å; S102-V105 PolarHBondContact O-N 3.47Å; V105-C107 VanDerWaalsContact C-N 3.32Å; V105-C107 PolarHBondContact O-N 3.46Å; V105-K108 PolarHBondContact O-N 3.41Å; V105-F109 HydrophobicContact CG1-CD2 4.11Å; V105-F109 HydrophobicContact CG1-CE2 3.77Å; V105-F109 VanDerWaalsContact O-CD2 3.25Å; V105-F109 WeakPolarHBondContact O-CD2 3.38Å; V105-F109 PolarHBondContact O-N 3.2Å
106F96.8Very high94.2Very high136 Ų13675.9 Ų75.960%0.59643%0.429SS*.Hα-helixtrans-57.2-45.5175.5175-100.2000111.9S102 K108 F109 Y110S102-F106 WeakPolarHBondContact O-CB 3.41Å; S102-F106 PolarHBondContact O-N 2.9Å; F106-K108 VanDerWaalsContact C-N 3.31Å; F106-K108 PolarHBondContact O-N 3.21Å; F106-F109 PolarHBondContact O-N 2.95Å; F106-Y110 HydrophobicContact CE1-CG 4.31Å; F106-Y110 HydrophobicContact CZ-CD2 4.29Å; F106-Y110 HydrophobicContact CZ-CG 4.48Å; F106-Y110 WeakPolarHBondContact O-CB 3.27Å; F106-Y110 PolarHBondContact O-N 3.14Å
107C96.3Very high94.9Very high25 Ų2580.7 Ų80.717%0.16945%0.452CS..Hα-helixtrans-56.6-42.3179-172.50000112.2P98 G103 K104 V105 F109 Y110 V111P98-C107 HydrophobicContact CG-CB 4.33Å; G103-C107 VanDerWaalsContact O-CB 3.27Å; G103-C107 WeakPolarHBondContact O-CB 3.33Å; G103-C107 PolarHBondContact O-N 2.72Å; K104-C107 PolarHBondContact O-N 2.91Å; V105-C107 VanDerWaalsContact C-N 3.32Å; V105-C107 PolarHBondContact O-N 3.46Å; C107-F109 PolarHBondContact O-N 2.95Å; C107-Y110 PolarHBondContact O-N 3.07Å; C107-V111 WeakPolarHBondContact O-CB 3.29Å; C107-V111 VanDerWaalsContact O-CG2 3.23Å; C107-V111 WeakPolarHBondContact O-CG2 3.48Å; C107-V111 PolarHBondContact O-N 3.28Å
108K95.8Very high95.2Very high151 Ų15178.4 Ų78.466%0.65743%0.431SS*.Hα-helixtrans-58.1-46.8177-68.3170.5-172.5179.50112.1K104 V105 F106 L112K104-K108 WeakPolarHBondContact O-CG 3.37Å; K104-K108 PolarHBondContact O-N 3.33Å; K104-K108 VanDerWaalsContact O-N 3.17Å; V105-K108 PolarHBondContact O-N 3.41Å; F106-K108 VanDerWaalsContact C-N 3.31Å; F106-K108 PolarHBondContact O-N 3.21Å; K108-L112 WeakPolarHBondContact O-CB 3.44Å; K108-L112 PolarHBondContact O-N 2.97Å
109F97.3Very high95.4Very high136 Ų13682.1 Ų82.160%0.59645%0.449SS*.Hα-helixtrans-69.6-39.6178.2-70.5-70.9000112.4V105 F106 C107 L112 L113V105-F109 HydrophobicContact CG1-CD2 4.11Å; V105-F109 HydrophobicContact CG1-CE2 3.77Å; V105-F109 VanDerWaalsContact O-CD2 3.25Å; V105-F109 WeakPolarHBondContact O-CD2 3.38Å; V105-F109 PolarHBondContact O-N 3.2Å; F106-F109 PolarHBondContact O-N 2.95Å; C107-F109 PolarHBondContact O-N 2.95Å; F109-L112 PolarHBondContact O-N 3.27Å; F109-L113 PolarHBondContact O-N 3.41Å
110Y97.2Very high95.8Very high73 Ų7383.4 Ų83.429%0.28644%0.444SS..Hα-helixtrans-61.5-45.1178.2-178.1-112.1000111.8A84 V87 I88 F106 C107 G114A84-Y110 HydrophobicContact CB-CE1 4.19Å; V87-Y110 HydrophobicContact CG1-CD1 4.11Å; V87-Y110 HydrophobicContact CG1-CE1 4.34Å; I88-Y110 HydrophobicContact CG2-CD1 4.1Å; I88-Y110 HydrophobicContact CG2-CE1 3.27Å; I88-Y110 HydrophobicContact CG2-CE2 4.36Å; I88-Y110 VanDerWaalsContact CG2-CZ 3.41Å; I88-Y110 WeakPolarHBondContact CG2-OH 3.26Å; F106-Y110 HydrophobicContact CE1-CG 4.31Å; F106-Y110 HydrophobicContact CZ-CD2 4.29Å; F106-Y110 HydrophobicContact CZ-CG 4.48Å; F106-Y110 WeakPolarHBondContact O-CB 3.27Å; F106-Y110 PolarHBondContact O-N 3.14Å; C107-Y110 PolarHBondContact O-N 3.07Å; Y110-G114 WeakPolarHBondContact O-CA 3.38Å; Y110-G114 PolarHBondContact O-N 3.44Å
111V96.5Very high95.9Very high42 Ų4282.1 Ų82.126%0.25544%0.436SS..Hα-helixtrans-64-43177.1170.60000112V87 C107 L113 G114 I115V87-V111 HydrophobicContact CG1-CG2 3.18Å; C107-V111 WeakPolarHBondContact O-CB 3.29Å; C107-V111 VanDerWaalsContact O-CG2 3.23Å; C107-V111 WeakPolarHBondContact O-CG2 3.48Å; C107-V111 PolarHBondContact O-N 3.28Å; V111-L113 VanDerWaalsContact C-N 3.27Å; V111-L113 PolarHBondContact O-N 2.88Å; V111-G114 PolarHBondContact O-N 3.38Å; V111-I115 HydrophobicContact CG1-CD1 3.4Å; V111-I115 HydrophobicContact CG1-CG1 3.98Å; V111-I115 PolarHBondContact O-N 2.84Å
112L96.3Very high95.9Very high119 Ų11977.6 Ų77.662%0.62341%0.411SS*.Hα-helixtrans-57-40.4-178-178.765.5000112.4K108 F109 P116K108-L112 WeakPolarHBondContact O-CB 3.44Å; K108-L112 PolarHBondContact O-N 2.97Å; F109-L112 PolarHBondContact O-N 3.27Å; L112-P116 VanDerWaalsContact O-CD 3.23Å; L112-P116 WeakPolarHBondContact O-CD 3.38Å; L112-P116 WeakPolarHBondContact O-CG 3.48Å
113L96.2Very high95.7Very high132 Ų13278 Ų7869%0.69140%0.402SS*.Hα-helixtrans-90.3-35177.9-62.6176.1000112.5F109 V111 L117F109-L113 PolarHBondContact O-N 3.41Å; V111-L113 VanDerWaalsContact C-N 3.27Å; V111-L113 PolarHBondContact O-N 2.88Å; L113-L117 WeakPolarHBondContact O-CB 3.19Å; L113-L117 PolarHBondContact O-N 3.26Å
114G97Very high95.6Very high9 Ų979.6 Ų79.69%0.09341%0.411CS..Hα-helixtrans-70.8-42-172.900000113.9Y110 V111 T118Y110-G114 WeakPolarHBondContact O-CA 3.38Å; Y110-G114 PolarHBondContact O-N 3.44Å; V111-G114 PolarHBondContact O-N 3.38Å; G114-T118 VanDerWaalsContact O-CB 3.27Å; G114-T118 WeakPolarHBondContact O-CB 3.39Å; G114-T118 PolarHBondContact O-N 2.98Å; G114-T118 PolarHBondContact O-OG1 2.84Å
115I96.4Very high95.7Very high48 Ų4878.9 Ų78.925%0.24641%0.411CS..Hα-helixtrans-63.9-53.2-179.5-66.6176.8000111.1T90 V111 L117 T118 L119T90-I115 HydrophobicContact CG2-CD1 3.46Å; T90-I115 VanDerWaalsContact CG2-CD1 3.46Å; T90-I115 HydrophobicContact CG2-CG1 3.69Å; T90-I115 HydrophobicContact CG2-CG2 4.18Å; V111-I115 HydrophobicContact CG1-CD1 3.4Å; V111-I115 HydrophobicContact CG1-CG1 3.98Å; V111-I115 PolarHBondContact O-N 2.84Å; I115-L117 VanDerWaalsContact C-N 3.31Å; I115-L117 PolarHBondContact O-N 3.36Å; I115-T118 PolarHBondContact O-N 3.24Å; I115-T118 VanDerWaalsContact O-N 3.14Å; I115-L119 HydrophobicContact CG2-CD1 3.87Å; I115-L119 HydrophobicContact CG2-CG 4.22Å; I115-L119 WeakPolarHBondContact O-CG 3.26Å; I115-L119 PolarHBondContact O-N 2.82Å
116P97Very high95.5Very high69 Ų6975.4 Ų75.445%0.44839%0.39SS..Hα-helixtrans-58.7-42.1179.5-24.934.9000112.7L112 T118 L119 V120L112-P116 VanDerWaalsContact O-CD 3.23Å; L112-P116 WeakPolarHBondContact O-CD 3.38Å; L112-P116 WeakPolarHBondContact O-CG 3.48Å; P116-T118 VanDerWaalsContact C-N 3.34Å; P116-T118 PolarHBondContact O-N 3.43Å; P116-L119 PolarHBondContact O-N 2.86Å; P116-V120 WeakPolarHBondContact O-CG2 3.44Å; P116-V120 PolarHBondContact O-N 3.1Å
117L96Very high95.3Very high118 Ų11873.4 Ų73.462%0.61838%0.383SS*.Hα-helixtrans-61.3-43.7176.9179.262.5000111.6L113 I115 T121L113-L117 WeakPolarHBondContact O-CB 3.19Å; L113-L117 PolarHBondContact O-N 3.26Å; I115-L117 VanDerWaalsContact C-N 3.31Å; I115-L117 PolarHBondContact O-N 3.36Å; L117-T121 WeakPolarHBondContact O-CB 3.08Å; L117-T121 PolarHBondContact O-N 3.27Å; L117-T121 PolarHBondContact O-OG1 3.02Å
118T95.1Very high95.2Very high17 Ų1781 Ų8110%0.10441%0.408CS..Hα-helixtrans-65.4-43.6179.2-60.10000111.4T89 G114 I115 P116 T121 F122T89-T118 HydrophobicContact CG2-CG2 4.22Å; G114-T118 VanDerWaalsContact O-CB 3.27Å; G114-T118 WeakPolarHBondContact O-CB 3.39Å; G114-T118 PolarHBondContact O-N 2.98Å; G114-T118 PolarHBondContact O-OG1 2.84Å; I115-T118 PolarHBondContact O-N 3.24Å; I115-T118 VanDerWaalsContact O-N 3.14Å; P116-T118 VanDerWaalsContact C-N 3.34Å; P116-T118 PolarHBondContact O-N 3.43Å; T118-T121 WeakPolarHBondContact O-CB 3.23Å; T118-T121 PolarHBondContact O-N 3.02Å; T118-F122 HydrophobicContact CG2-CD2 3.6Å; T118-F122 HydrophobicContact CG2-CE2 3.33Å; T118-F122 HydrophobicContact CG2-CZ 4.05Å; T118-F122 PolarHBondContact O-N 3.07Å
119L93.1Very high95.1Very high107 Ų10775.9 Ų75.956%0.5639%0.387SS*.Hα-helixtrans-60.6-47.9177.2-71.4174.9000112.1I115 P116 T121 F122 Q123I115-L119 HydrophobicContact CG2-CD1 3.87Å; I115-L119 HydrophobicContact CG2-CG 4.22Å; I115-L119 WeakPolarHBondContact O-CG 3.26Å; I115-L119 PolarHBondContact O-N 2.82Å; P116-L119 PolarHBondContact O-N 2.86Å; L119-T121 VanDerWaalsContact C-N 3.29Å; L119-T121 PolarHBondContact O-N 3.33Å; L119-F122 PolarHBondContact O-N 3.21Å; L119-Q123 WeakPolarHBondContact O-CB 3.2Å; L119-Q123 PolarHBondContact O-N 3.41Å
120V94.6Very high94.9Very high90 Ų9070.9 Ų70.955%0.54537%0.367SS..Hα-helixtrans-62.3-39.6176.9172.60000111.2P116 Q123 S124P116-V120 WeakPolarHBondContact O-CG2 3.44Å; P116-V120 PolarHBondContact O-N 3.1Å; V120-Q123 PolarHBondContact O-N 3.45Å; V120-S124 WeakPolarHBondContact O-CB 3.44Å; V120-S124 PolarHBondContact O-N 2.94Å; V120-S124 PolarHBondContact O-OG 3Å
121T94.9Very high94.7Very high61 Ų6169.2 Ų69.237%0.37437%0.368SS..Hα-helixtrans-63.6-49.4177.7-59.70000110.9L117 T118 L119 Q123 S124 L125L117-T121 WeakPolarHBondContact O-CB 3.08Å; L117-T121 PolarHBondContact O-N 3.27Å; L117-T121 PolarHBondContact O-OG1 3.02Å; T118-T121 WeakPolarHBondContact O-CB 3.23Å; T118-T121 PolarHBondContact O-N 3.02Å; L119-T121 VanDerWaalsContact C-N 3.29Å; L119-T121 PolarHBondContact O-N 3.33Å; T121-Q123 VanDerWaalsContact C-N 3.34Å; T121-Q123 PolarHBondContact O-N 3.4Å; T121-S124 PolarHBondContact O-N 3.18Å; T121-L125 HydrophobicContact CG2-CD1 3.82Å; T121-L125 HydrophobicContact CG2-CG 4.3Å; T121-L125 WeakPolarHBondContact O-CB 3.49Å; T121-L125 VanDerWaalsContact O-CG 3.28Å; T121-L125 WeakPolarHBondContact O-CG 3.49Å; T121-L125 PolarHBondContact O-N 3.02Å
122F94.1Very high94.6Very high24 Ų2470.6 Ų70.611%0.10537%0.374CS..Hα-helixtrans-66.4-33.5178.5-76.5-34.8000113.1T89 T118 L119 G126 L226 L229 S233T89-F122 HydrophobicContact CG2-CE2 3.98Å; T89-F122 HydrophobicContact CG2-CZ 3.99Å; T118-F122 HydrophobicContact CG2-CD2 3.6Å; T118-F122 HydrophobicContact CG2-CE2 3.33Å; T118-F122 HydrophobicContact CG2-CZ 4.05Å; T118-F122 PolarHBondContact O-N 3.07Å; L119-F122 PolarHBondContact O-N 3.21Å; F122-G126 WeakPolarHBondContact O-CA 3.47Å; F122-G126 PolarHBondContact O-N 3.41Å; F122-L226 HydrophobicContact CZ-CD2 4.5Å; F122-L229 HydrophobicContact CE1-CB 3.99Å; F122-L229 HydrophobicContact CE2-CB 3.94Å; F122-L229 HydrophobicContact CE2-CD1 3.91Å; F122-L229 HydrophobicContact CZ-CB 3.6Å; F122-L229 HydrophobicContact CZ-CD1 3.75Å; F122-L229 HydrophobicContact CZ-CG 4.35Å; F122-S233 PolarHBondContact O-OG 3.32Å
123Q91.8Very high94.4Very high98 Ų9866.5 Ų66.546%0.45835%0.354SS..Hα-helixtrans-65.7-49.1173.4-173.5177.2-25.100110.7L119 V120 T121 L125 G126 E127L119-Q123 WeakPolarHBondContact O-CB 3.2Å; L119-Q123 PolarHBondContact O-N 3.41Å; V120-Q123 PolarHBondContact O-N 3.45Å; T121-Q123 VanDerWaalsContact C-N 3.34Å; T121-Q123 PolarHBondContact O-N 3.4Å; Q123-L125 PolarHBondContact O-N 3.24Å; Q123-G126 PolarHBondContact O-N 3.27Å; Q123-E127 WeakPolarHBondContact O-CG 3.49Å; Q123-E127 PolarHBondContact O-N 3.14Å
124S93.8Very high94.1Very high53 Ų5366.7 Ų66.737%0.37135%0.345SS..Hα-helixtrans-62.1-42.7179.1-59.30000112.4V120 T121 R128V120-S124 WeakPolarHBondContact O-CB 3.44Å; V120-S124 PolarHBondContact O-N 2.94Å; V120-S124 PolarHBondContact O-OG 3Å; T121-S124 PolarHBondContact O-N 3.18Å; S124-R128 VanDerWaalsContact O-CG 3.32Å; S124-R128 WeakPolarHBondContact O-CG 3.36Å; S124-R128 PolarHBondContact O-N 3Å
125L95.4Very high93.9Very high75 Ų7572.9 Ų72.939%0.39337%0.366SS..Hα-helixtrans-67.6-39.9175.2-71.5175.7000111.3T121 Q123 E127 R128 L129 T230T121-L125 HydrophobicContact CG2-CD1 3.82Å; T121-L125 HydrophobicContact CG2-CG 4.3Å; T121-L125 WeakPolarHBondContact O-CB 3.49Å; T121-L125 VanDerWaalsContact O-CG 3.28Å; T121-L125 WeakPolarHBondContact O-CG 3.49Å; T121-L125 PolarHBondContact O-N 3.02Å; Q123-L125 PolarHBondContact O-N 3.24Å; L125-E127 PolarHBondContact O-N 3.3Å; L125-R128 PolarHBondContact O-N 3.42Å; L125-L129 WeakPolarHBondContact O-CB 3.34Å; L125-L129 PolarHBondContact O-N 3.49Å; L125-T230 HydrophobicContact CB-CG2 3.66Å
126G93.4Very high93.7Very high0 Ų075.7 Ų75.70%038%0.381CS..Hα-helixtrans-62-41.2177.500000112.8F122 Q123 L129 N130F122-G126 WeakPolarHBondContact O-CA 3.47Å; F122-G126 PolarHBondContact O-N 3.41Å; Q123-G126 PolarHBondContact O-N 3.27Å; G126-L129 PolarHBondContact O-N 2.67Å; G126-N130 WeakPolarHBondContact O-CB 3.28Å; G126-N130 PolarHBondContact O-N 3.46Å; G126-N130 PolarHBondContact O-ND2 2.91Å
127E92.5Very high93.4Very high95 Ų9574.7 Ų74.744%0.44437%0.371SS..Hα-helixtrans-61.5-45.4172.8-71.7177.3-173.900112.2Q123 L125 L129 N130 A131 N237Q123-E127 WeakPolarHBondContact O-CG 3.49Å; Q123-E127 PolarHBondContact O-N 3.14Å; L125-E127 PolarHBondContact O-N 3.3Å; E127-L129 VanDerWaalsContact C-N 3.32Å; E127-L129 PolarHBondContact O-N 3.27Å; E127-N130 PolarHBondContact O-N 2.68Å; E127-A131 WeakPolarHBondContact O-CB 3.32Å; E127-A131 PolarHBondContact O-N 2.76Å; E127-N237 WeakPolarHBondContact CG-ND2 3.36Å
128R94.8Very high93.2Very high183 Ų18370.9 Ų70.969%0.69135%0.351SS*.Hα-helixtrans-63.2-39.4177.2-70171.7-175.5-89.6-0.4111.6S124 L125 A131 L132S124-R128 VanDerWaalsContact O-CG 3.32Å; S124-R128 WeakPolarHBondContact O-CG 3.36Å; S124-R128 PolarHBondContact O-N 3Å; L125-R128 PolarHBondContact O-N 3.42Å; R128-A131 PolarHBondContact O-N 3.45Å; R128-L132 WeakPolarHBondContact O-CB 3.01Å; R128-L132 PolarHBondContact O-N 3.41Å
129L94.3Very high92.9Very high44 Ų4471.7 Ų71.723%0.2336%0.36CS..Hα-helixtrans-66.2-45.6176.5-174.659.9000111.1L125 G126 E127 A131 L132 V133 T230 V231 A234L125-L129 WeakPolarHBondContact O-CB 3.34Å; L125-L129 PolarHBondContact O-N 3.49Å; G126-L129 PolarHBondContact O-N 2.67Å; E127-L129 VanDerWaalsContact C-N 3.32Å; E127-L129 PolarHBondContact O-N 3.27Å; L129-A131 VanDerWaalsContact C-N 3.3Å; L129-A131 PolarHBondContact O-N 2.59Å; L129-L132 HydrophobicContact CD1-CD2 4.37Å; L129-L132 WeakPolarHBondContact O-CA 3.43Å; L129-L132 WeakPolarHBondContact O-CB 3.28Å; L129-L132 PolarHBondContact O-N 3.27Å; L129-L132 VanDerWaalsContact O-N 3.08Å; L129-V133 WeakPolarHBondContact O-CG2 3.47Å; L129-V133 PolarHBondContact O-N 3.12Å; L129-T230 HydrophobicContact CD2-CG2 4.27Å; L129-V231 HydrophobicContact CD2-CB 4.49Å; L129-V231 HydrophobicContact CD2-CG2 3.92Å; L129-A234 HydrophobicContact CB-CB 4.23Å; L129-A234 HydrophobicContact CD2-CB 3.92Å; L129-A234 HydrophobicContact CG-CB 4.34Å
130N93.3Very high92.7Very high32 Ų3269 Ų6917%0.17135%0.353CS..Hα-helixtrans-59.9-40.6174.3-76.6-26000112.1G126 E127 L132 V133 R134 A234G126-N130 WeakPolarHBondContact O-CB 3.28Å; G126-N130 PolarHBondContact O-N 3.46Å; G126-N130 PolarHBondContact O-ND2 2.91Å; E127-N130 PolarHBondContact O-N 2.68Å; N130-L132 VanDerWaalsContact C-N 3.34Å; N130-V133 PolarHBondContact O-N 3.41Å; N130-R134 WeakPolarHBondContact O-CB 3.35Å; N130-R134 PolarHBondContact O-N 3.36Å; N130-A234 PolarHBondContact ND2-O 3.05Å
131A92.3Very high92.5Very high38 Ų3867 Ų6731%0.31434%0.337SS..Hα-helixtrans-64-39174.200000111.9E127 R128 L129 R134 R135E127-A131 WeakPolarHBondContact O-CB 3.32Å; E127-A131 PolarHBondContact O-N 2.76Å; R128-A131 PolarHBondContact O-N 3.45Å; L129-A131 VanDerWaalsContact C-N 3.3Å; L129-A131 PolarHBondContact O-N 2.59Å; A131-R134 PolarHBondContact O-N 2.85Å; A131-R135 WeakPolarHBondContact O-CG 3.33Å; A131-R135 PolarHBondContact O-N 2.92Å; A131-R135 PolarHBondContact O-NH1 3.46Å
132L93.5Very high92.2Very high71 Ų7171.7 Ų71.737%0.37235%0.348SS..Hα-helixtrans-63.4-50.2174.1178.564.7000111.4R128 L129 N130 R134 R135 L136R128-L132 WeakPolarHBondContact O-CB 3.01Å; R128-L132 PolarHBondContact O-N 3.41Å; L129-L132 HydrophobicContact CD1-CD2 4.37Å; L129-L132 WeakPolarHBondContact O-CA 3.43Å; L129-L132 WeakPolarHBondContact O-CB 3.28Å; L129-L132 PolarHBondContact O-N 3.27Å; L129-L132 VanDerWaalsContact O-N 3.08Å; N130-L132 VanDerWaalsContact C-N 3.34Å; L132-R134 VanDerWaalsContact C-N 3.28Å; L132-R134 PolarHBondContact O-N 2.74Å; L132-R135 WeakPolarHBondContact O-CA 3.37Å; L132-R135 WeakPolarHBondContact O-CB 3.3Å; L132-R135 PolarHBondContact O-N 2.96Å; L132-L136 HydrophobicContact CD1-CD1 4.34Å; L132-L136 HydrophobicContact CD1-CG 4.27Å; L132-L136 HydrophobicContact CG-CD1 4.06Å; L132-L136 HydrophobicContact CG-CG 4.4Å; L132-L136 WeakPolarHBondContact O-CG 3.41Å; L132-L136 PolarHBondContact O-N 2.88Å
133V91.9Very high92Very high33 Ų3376.1 Ų76.120%0.238%0.38CS..Hα-helixtrans-56.2-44.3177171.30000110.6L129 N130 R135 L136 L137 S159L129-V133 WeakPolarHBondContact O-CG2 3.47Å; L129-V133 PolarHBondContact O-N 3.12Å; N130-V133 PolarHBondContact O-N 3.41Å; V133-R135 VanDerWaalsContact C-N 3.35Å; V133-R135 PolarHBondContact O-N 3.41Å; V133-L136 PolarHBondContact O-N 3.25Å; V133-L137 HydrophobicContact CG1-CD1 3.89Å; V133-L137 HydrophobicContact CG1-CG 4.29Å; V133-L137 WeakPolarHBondContact O-CB 3.27Å; V133-L137 WeakPolarHBondContact O-CG 3.5Å; V133-L137 PolarHBondContact O-N 2.99Å; V133-S159 WeakPolarHBondContact CG1-OG 3.48Å
134R91.9Very high92Very high135 Ų13578 Ų7851%0.50939%0.393SS..Hα-helixtrans-59.1-43.8174.9-174.4175.4-178-113.32.5112.2N130 A131 L132 L138 V151 L156N130-R134 WeakPolarHBondContact O-CB 3.35Å; N130-R134 PolarHBondContact O-N 3.36Å; A131-R134 PolarHBondContact O-N 2.85Å; L132-R134 VanDerWaalsContact C-N 3.28Å; L132-R134 PolarHBondContact O-N 2.74Å; R134-L138 HydrophobicContact CG-CD1 4.25Å; R134-L138 WeakPolarHBondContact O-CB 3.44Å; R134-L138 VanDerWaalsContact O-CG 3.27Å; R134-L138 WeakPolarHBondContact O-CG 3.29Å; R134-L138 PolarHBondContact O-N 3.27Å; R134-V151 HydrophobicContact CG-CB 4.4Å; R134-V151 HydrophobicContact CG-CG1 4.3Å; R134-L156 HydrophobicContact CB-CD2 4.08Å
135R92.3Very high91.6Very high139 Ų13978.3 Ų78.353%0.52541%0.405SS..Hα-helixtrans-63.5-43.9176.7-72.8-171.5-57.9-88.44111.6A131 L132 V133 L138 A139A131-R135 WeakPolarHBondContact O-CG 3.33Å; A131-R135 PolarHBondContact O-N 2.92Å; A131-R135 PolarHBondContact O-NH1 3.46Å; L132-R135 WeakPolarHBondContact O-CA 3.37Å; L132-R135 WeakPolarHBondContact O-CB 3.3Å; L132-R135 PolarHBondContact O-N 2.96Å; V133-R135 VanDerWaalsContact C-N 3.35Å; V133-R135 PolarHBondContact O-N 3.41Å; R135-L138 PolarHBondContact O-N 3.4Å; R135-A139 WeakPolarHBondContact O-CB 3.12Å; R135-A139 PolarHBondContact O-N 3.13Å
136L92.1Very high91.1Very high107 Ų10779.2 Ų79.256%0.5641%0.409SS*.Hα-helixtrans-64.3-44.8178.3-68175000111.7L132 V133 L138 A139 A140L132-L136 HydrophobicContact CD1-CD1 4.34Å; L132-L136 HydrophobicContact CD1-CG 4.27Å; L132-L136 HydrophobicContact CG-CD1 4.06Å; L132-L136 HydrophobicContact CG-CG 4.4Å; L132-L136 WeakPolarHBondContact O-CG 3.41Å; L132-L136 PolarHBondContact O-N 2.88Å; V133-L136 PolarHBondContact O-N 3.25Å; L136-L138 VanDerWaalsContact C-N 3.33Å; L136-L138 PolarHBondContact O-N 3.42Å; L136-A139 PolarHBondContact O-N 2.87Å; L136-A139 VanDerWaalsContact O-N 3.16Å; L136-A140 WeakPolarHBondContact O-CB 3.35Å; L136-A140 PolarHBondContact O-N 2.95Å
137L90.4Very high90.1Very high48 Ų4891 Ų9125%0.25145%0.454SS..Hα-helixtrans-61.1-41.3174.9-74171.9000111.9V133 K141 V151 L156V133-L137 HydrophobicContact CG1-CD1 3.89Å; V133-L137 HydrophobicContact CG1-CG 4.29Å; V133-L137 WeakPolarHBondContact O-CB 3.27Å; V133-L137 WeakPolarHBondContact O-CG 3.5Å; V133-L137 PolarHBondContact O-N 2.99Å; L137-K141 WeakPolarHBondContact O-CB 3.34Å; L137-K141 WeakPolarHBondContact O-CG 3.46Å; L137-K141 PolarHBondContact O-N 2.82Å; L137-V151 HydrophobicContact CB-CG2 4.08Å; L137-V151 HydrophobicContact CD1-CG1 4.34Å; L137-L156 HydrophobicContact CD1-CD2 4.2Å
138L90.9Very high89.2Confident38 Ų3897 Ų9720%0.19947%0.472CS..Hα-helixtrans-66.6-37.4175-73.9170.4000112.2R134 R135 L136 R142 P149 V151R134-L138 HydrophobicContact CG-CD1 4.25Å; R134-L138 WeakPolarHBondContact O-CB 3.44Å; R134-L138 VanDerWaalsContact O-CG 3.27Å; R134-L138 WeakPolarHBondContact O-CG 3.29Å; R134-L138 PolarHBondContact O-N 3.27Å; R135-L138 PolarHBondContact O-N 3.4Å; L136-L138 VanDerWaalsContact C-N 3.33Å; L136-L138 PolarHBondContact O-N 3.42Å; L138-R142 VanDerWaalsContact O-CG 3.28Å; L138-R142 WeakPolarHBondContact O-CG 3.27Å; L138-R142 PolarHBondContact O-N 3.32Å; L138-R142 VanDerWaalsContact O-N 3.13Å; L138-R142 PolarHBondContact O-NE 3.1Å; L138-R142 VanDerWaalsContact O-NE 3.14Å; L138-P149 HydrophobicContact CD2-CB 4.15Å; L138-P149 HydrophobicContact CD2-CG 4.38Å; L138-P149 VanDerWaalsContact CD2-O 3.27Å; L138-P149 WeakPolarHBondContact CD2-O 3.33Å; L138-V151 HydrophobicContact CD2-CG2 3.62Å; L138-V151 HydrophobicContact CG-CG2 3.7Å
139A89.6Confident88.4Confident34 Ų3489.9 Ų89.928%0.28145%0.45SS..Hα-helixtrans-65.4-49.4174.400000110.8R135 L136 K141 R142 C143R135-A139 WeakPolarHBondContact O-CB 3.12Å; R135-A139 PolarHBondContact O-N 3.13Å; L136-A139 PolarHBondContact O-N 2.87Å; L136-A139 VanDerWaalsContact O-N 3.16Å; A139-K141 PolarHBondContact O-N 3.11Å; A139-R142 WeakPolarHBondContact O-CA 3.44Å; A139-R142 WeakPolarHBondContact O-CB 3.47Å; A139-R142 PolarHBondContact O-N 3.31Å; A139-C143 PolarHBondContact O-N 3.11Å; A139-C143 PolarHBondContact O-SG 2.96Å
140A89.4Confident87.8Confident50 Ų5097.8 Ų97.841%0.41348%0.476SS..Hα-helixtrans-57.3-46.1177.400000112.1L136 R142 C143 L144L136-A140 WeakPolarHBondContact O-CB 3.35Å; L136-A140 PolarHBondContact O-N 2.95Å; A140-R142 VanDerWaalsContact C-N 3.28Å; A140-R142 PolarHBondContact O-N 3.06Å; A140-C143 PolarHBondContact O-N 2.87Å; A140-L144 WeakPolarHBondContact O-CD1 3.44Å; A140-L144 WeakPolarHBondContact O-CG 3.44Å; A140-L144 PolarHBondContact O-N 3.42Å
141K89.6Confident87.5Confident49 Ų4997.3 Ų97.321%0.21348%0.475CS..Hα-helixtrans-63.7-31.7176.2-73.1-171.7-176.7-164.30113.2L137 A139 L146 P149 R150 N155L137-K141 WeakPolarHBondContact O-CB 3.34Å; L137-K141 WeakPolarHBondContact O-CG 3.46Å; L137-K141 PolarHBondContact O-N 2.82Å; A139-K141 PolarHBondContact O-N 3.11Å; K141-L146 HydrophobicContact CB-CD1 3.85Å; K141-L146 HydrophobicContact CD-CD1 4.18Å; K141-L146 HydrophobicContact CG-CD1 3.88Å; K141-L146 WeakPolarHBondContact O-CB 3.35Å; K141-L146 PolarHBondContact O-N 2.82Å; K141-P149 HydrophobicContact CB-CB 3.58Å; K141-P149 HydrophobicContact CD-CB 4.15Å; K141-R150 PolarHBondContact NZ-O 3.27Å; K141-N155 PolarHBondContact NZ-ND2 3.2Å; K141-N155 VanDerWaalsContact NZ-ND2 3.12Å
142R89.3Confident87.4Confident160 Ų16098 Ų9860%0.60448%0.477SS*.Hα-helixtrans-70-43.6172.8-77.1-179.4-78.7163-3.3111.4L138 A139 A140 L144 G145 P149L138-R142 VanDerWaalsContact O-CG 3.28Å; L138-R142 WeakPolarHBondContact O-CG 3.27Å; L138-R142 PolarHBondContact O-N 3.32Å; L138-R142 VanDerWaalsContact O-N 3.13Å; L138-R142 PolarHBondContact O-NE 3.1Å; L138-R142 VanDerWaalsContact O-NE 3.14Å; A139-R142 WeakPolarHBondContact O-CA 3.44Å; A139-R142 WeakPolarHBondContact O-CB 3.47Å; A139-R142 PolarHBondContact O-N 3.31Å; A140-R142 VanDerWaalsContact C-N 3.28Å; A140-R142 PolarHBondContact O-N 3.06Å; R142-L144 PolarHBondContact O-N 3.09Å; R142-G145 PolarHBondContact O-N 2.98Å; R142-P149 HydrophobicContact CG-CG 3.82Å
143C90Very high87Confident116 Ų11698 Ų9878%0.78448%0.481SS*.Hα-helixtrans-61.4-31.8175.4-61.10000112.1A139 A140 G145A139-C143 PolarHBondContact O-N 3.11Å; A139-C143 PolarHBondContact O-SG 2.96Å; A140-C143 PolarHBondContact O-N 2.87Å; C143-G145 PolarHBondContact O-N 2.92Å
144L90.4Very high86.8Confident138 Ų138102.6 Ų102.672%0.72350%0.5SS*.THydrogen-bonded Turntrans-77.54.4173.7-70.7160.3000114.1A140 R142 L146A140-L144 WeakPolarHBondContact O-CD1 3.44Å; A140-L144 WeakPolarHBondContact O-CG 3.44Å; A140-L144 PolarHBondContact O-N 3.42Å; R142-L144 PolarHBondContact O-N 3.09Å; L144-L146 PolarHBondContact O-N 3.07Å
145G85.4Confident86.7Confident60 Ų6099 Ų9962%0.61949%0.491SS*.THydrogen-bonded Turntrans77.613.5173.900000115.8R142 C143 R147R142-G145 PolarHBondContact O-N 2.98Å; C143-G145 PolarHBondContact O-N 2.92Å; G145-R147 PolarHBondContact O-N 3Å
146L85.9Confident86.7Confident93 Ų9393.8 Ų93.849%0.48747%0.473SS..  trans-71.9116.9179.9-66.2166.9000110.8K141 L144 R148 P149K141-L146 HydrophobicContact CB-CD1 3.85Å; K141-L146 HydrophobicContact CD-CD1 4.18Å; K141-L146 HydrophobicContact CG-CD1 3.88Å; K141-L146 WeakPolarHBondContact O-CB 3.35Å; K141-L146 PolarHBondContact O-N 2.82Å; L144-L146 PolarHBondContact O-N 3.07Å; L146-R148 PolarHBondContact O-N 3.3Å; L146-R148 VanDerWaalsContact O-N 3.12Å; L146-P149 WeakPolarHBondContact O-CD 3.28Å
147R71.8Confident86.7Confident248 Ų24890.1 Ų90.194%0.93646%0.455SS*.SBendtrans-62.6-19.6-172.8-71-175.7172.8-145.1-1.3115.5G145G145-R147 PolarHBondContact O-N 3Å
148R74.4Confident86.8Confident220 Ų22091.7 Ų91.783%0.8347%0.467SS*.SBendtrans-147.978.1176.3-67.4-172.7179.3171.9-0.3111.2L146 R150L146-R148 PolarHBondContact O-N 3.3Å; L146-R148 VanDerWaalsContact O-N 3.12Å; R148-R150 PolarHBondContact O-N 3.31Å; R148-R150 VanDerWaalsContact O-N 3.09Å
149P78.1Confident86.9Confident35 Ų3590.9 Ų90.923%0.22746%0.464CS..  trans-71.3110.4-175.630-32.8000109.9L138 K141 R142 L146L138-P149 HydrophobicContact CD2-CB 4.15Å; L138-P149 HydrophobicContact CD2-CG 4.38Å; L138-P149 VanDerWaalsContact CD2-O 3.27Å; L138-P149 WeakPolarHBondContact CD2-O 3.33Å; K141-P149 HydrophobicContact CB-CB 3.58Å; K141-P149 HydrophobicContact CD-CB 4.15Å; R142-P149 HydrophobicContact CG-CG 3.82Å; L146-P149 WeakPolarHBondContact O-CD 3.28Å
150R82.4Confident87.1Confident209 Ų20989.7 Ų89.779%0.78946%0.455SS*.  trans-103.4138.2168.6-68.9-176.8178.4-170.7-0.4109.7K141 R148K141-R150 PolarHBondContact NZ-O 3.27Å; R148-R150 PolarHBondContact O-N 3.31Å; R148-R150 VanDerWaalsContact O-N 3.09Å
151V86.9Confident87.3Confident23 Ų2391.7 Ų91.714%0.13946%0.458CS..  trans-104.5104.1171.6175.90000107.1R134 L137 L138 N155 L156R134-V151 HydrophobicContact CG-CB 4.4Å; R134-V151 HydrophobicContact CG-CG1 4.3Å; L137-V151 HydrophobicContact CB-CG2 4.08Å; L137-V151 HydrophobicContact CD1-CG1 4.34Å; L138-V151 HydrophobicContact CD2-CG2 3.62Å; L138-V151 HydrophobicContact CG-CG2 3.7Å; V151-N155 HydrophobicContact CG1-CB 4.31Å; V151-L156 HydrophobicContact CG1-CD1 4.22Å; V151-L156 HydrophobicContact CG1-CD2 3.7Å; V151-L156 HydrophobicContact CG1-CG 3.64Å
152S88.5Confident87.6Confident52 Ų5295 Ų9536%0.36448%0.477SS..  trans-70.1157169.6-1780000110.5E154 N155 L156S152-E154 PolarHBondContact O-N 3.42Å; S152-E154 PolarHBondContact OG-N 3.39Å; S152-N155 PolarHBondContact N-ND2 2.77Å; S152-N155 WeakPolarHBondContact O-CB 3.34Å; S152-N155 PolarHBondContact O-N 2.96Å; S152-N155 VanDerWaalsContact O-N 3.13Å; S152-L156 PolarHBondContact O-N 2.98Å
153T86Confident88Confident72 Ų7289 Ų8944%0.44246%0.462SS..Hα-helixtrans-55.8-35.7171.2-51.10000111.6N155 L156 V157T153-N155 PolarHBondContact O-N 3.47Å; T153-L156 WeakPolarHBondContact O-CB 3.4Å; T153-L156 PolarHBondContact O-N 2.61Å; T153-L156 VanDerWaalsContact O-N 3.17Å; T153-V157 WeakPolarHBondContact O-CG2 3.28Å; T153-V157 PolarHBondContact O-N 3.14Å
154E87.6Confident88.3Confident129 Ų12984 Ų8460%0.60343%0.429SS*.Hα-helixtrans-61.2-44176.3-67.5166.4177.800112S152 L156 V157 V158S152-E154 PolarHBondContact O-N 3.42Å; S152-E154 PolarHBondContact OG-N 3.39Å; E154-L156 PolarHBondContact O-N 3.34Å; E154-V157 PolarHBondContact O-N 3.26Å; E154-V158 WeakPolarHBondContact O-CG2 3.23Å; E154-V158 PolarHBondContact O-N 2.87Å
155N90.4Very high88.6Confident60 Ų6080.1 Ų80.132%0.32142%0.417SS..Hα-helixtrans-62-35.9176.5-63.3-25.3000111.3K141 V151 S152 T153 S159K141-N155 PolarHBondContact NZ-ND2 3.2Å; K141-N155 VanDerWaalsContact NZ-ND2 3.12Å; V151-N155 HydrophobicContact CG1-CB 4.31Å; S152-N155 PolarHBondContact N-ND2 2.77Å; S152-N155 WeakPolarHBondContact O-CB 3.34Å; S152-N155 PolarHBondContact O-N 2.96Å; S152-N155 VanDerWaalsContact O-N 3.13Å; T153-N155 PolarHBondContact O-N 3.47Å; N155-S159 VanDerWaalsContact O-CB 3.27Å; N155-S159 WeakPolarHBondContact O-CB 3.43Å; N155-S159 PolarHBondContact O-N 3.3Å; N155-S159 PolarHBondContact O-OG 3.37Å
156L91Very high89.1Confident28 Ų2880.1 Ų80.115%0.14741%0.41CS..Hα-helixtrans-68.3-44.2176.1-68.3171.8000111.3R134 L137 V151 S152 T153 E154 S159 G160 L238R134-L156 HydrophobicContact CB-CD2 4.08Å; L137-L156 HydrophobicContact CD1-CD2 4.2Å; V151-L156 HydrophobicContact CG1-CD1 4.22Å; V151-L156 HydrophobicContact CG1-CD2 3.7Å; V151-L156 HydrophobicContact CG1-CG 3.64Å; S152-L156 PolarHBondContact O-N 2.98Å; T153-L156 WeakPolarHBondContact O-CB 3.4Å; T153-L156 PolarHBondContact O-N 2.61Å; T153-L156 VanDerWaalsContact O-N 3.17Å; E154-L156 PolarHBondContact O-N 3.34Å; L156-S159 WeakPolarHBondContact CA-OG 3.35Å; L156-S159 PolarHBondContact O-N 2.89Å; L156-S159 PolarHBondContact O-OG 3.46Å; L156-G160 PolarHBondContact O-N 2.85Å; L156-L238 HydrophobicContact CB-CD1 4.32Å; L156-L238 HydrophobicContact CB-CD2 3.8Å; L156-L238 HydrophobicContact CD1-CD1 4.46Å
157V92.1Very high89.6Confident30 Ų3076.8 Ų76.818%0.18239%0.394CS..Hα-helixtrans-61.4-47.5177.3172.60000110.8T153 E154 S159 G160 L161 F235 L238T153-V157 WeakPolarHBondContact O-CG2 3.28Å; T153-V157 PolarHBondContact O-N 3.14Å; E154-V157 PolarHBondContact O-N 3.26Å; V157-S159 PolarHBondContact O-N 2.93Å; V157-G160 PolarHBondContact O-N 2.84Å; V157-L161 HydrophobicContact CG1-CD1 4.3Å; V157-L161 WeakPolarHBondContact O-CG 3.17Å; V157-L161 PolarHBondContact O-N 3.49Å; V157-F235 HydrophobicContact CG1-CE2 4.39Å; V157-L238 HydrophobicContact CB-CD2 4.41Å; V157-L238 HydrophobicContact CG2-CD2 3.76Å; V157-L238 HydrophobicContact CG2-CG 4.36Å
158V92.8Very high90.9Very high82 Ų8265.9 Ų65.950%0.49735%0.354SS..Hα-helixtrans-61.4-44.9176.5174.10000110.7E154 G160 L161 L162E154-V158 WeakPolarHBondContact O-CG2 3.23Å; E154-V158 PolarHBondContact O-N 2.87Å; V158-G160 VanDerWaalsContact C-N 3.3Å; V158-G160 PolarHBondContact O-N 3.42Å; V158-L161 PolarHBondContact O-N 2.8Å; V158-L162 HydrophobicContact CG1-CD1 4.08Å; V158-L162 HydrophobicContact CG1-CG 4.46Å; V158-L162 WeakPolarHBondContact O-CG 3.31Å; V158-L162 PolarHBondContact O-N 3.41Å
159S93.3Very high92Very high21 Ų2157.9 Ų57.915%0.14734%0.335CS..Hα-helixtrans-63.6-35.117768.90000113.1V133 N155 L156 V157 L162 A163V133-S159 WeakPolarHBondContact CG1-OG 3.48Å; N155-S159 VanDerWaalsContact O-CB 3.27Å; N155-S159 WeakPolarHBondContact O-CB 3.43Å; N155-S159 PolarHBondContact O-N 3.3Å; N155-S159 PolarHBondContact O-OG 3.37Å; L156-S159 WeakPolarHBondContact CA-OG 3.35Å; L156-S159 PolarHBondContact O-N 2.89Å; L156-S159 PolarHBondContact O-OG 3.46Å; V157-S159 PolarHBondContact O-N 2.93Å; S159-L162 PolarHBondContact O-N 2.81Å; S159-A163 WeakPolarHBondContact O-CB 3.37Å; S159-A163 PolarHBondContact O-N 3.37Å
160G93.4Very high92.8Very high9 Ų961.6 Ų61.69%0.09335%0.352CS..Hα-helixtrans-68.2-43.1175.900000112L156 V157 V158 A163 C164L156-G160 PolarHBondContact O-N 2.85Å; V157-G160 PolarHBondContact O-N 2.84Å; V158-G160 VanDerWaalsContact C-N 3.3Å; V158-G160 PolarHBondContact O-N 3.42Å; G160-A163 PolarHBondContact O-N 3.19Å; G160-C164 PolarHBondContact O-N 2.91Å; G160-C164 PolarHBondContact O-SG 3.1Å
161L94.6Very high93.5Very high91 Ų9151.6 Ų51.648%0.47632%0.315SS..Hα-helixtrans-60.9-44.6173.4-73.4171.8000111.6V157 V158 A163 C164 A165 F235V157-L161 HydrophobicContact CG1-CD1 4.3Å; V157-L161 WeakPolarHBondContact O-CG 3.17Å; V157-L161 PolarHBondContact O-N 3.49Å; V158-L161 PolarHBondContact O-N 2.8Å; L161-A163 VanDerWaalsContact C-N 3.35Å; L161-A163 PolarHBondContact O-N 3.45Å; L161-C164 PolarHBondContact O-N 3.46Å; L161-A165 WeakPolarHBondContact O-CB 3.33Å; L161-A165 PolarHBondContact O-N 3.2Å; L161-F235 HydrophobicContact CD2-CE1 4.12Å; L161-F235 HydrophobicContact CD2-CE2 3.74Å; L161-F235 HydrophobicContact CD2-CZ 3.4Å; L161-F235 VanDerWaalsContact CD2-CZ 3.4Å; L161-F235 HydrophobicContact CG-CE2 3.73Å; L161-F235 HydrophobicContact CG-CZ 3.9Å
162L95.9Very high93.9Very high118 Ų11851 Ų5162%0.61831%0.311SS*.Hα-helixtrans-62.8-40.7175.7-71172.9000111.8V158 S159 A165 A166V158-L162 HydrophobicContact CG1-CD1 4.08Å; V158-L162 HydrophobicContact CG1-CG 4.46Å; V158-L162 WeakPolarHBondContact O-CG 3.31Å; V158-L162 PolarHBondContact O-N 3.41Å; S159-L162 PolarHBondContact O-N 2.81Å; L162-A165 PolarHBondContact O-N 3.43Å; L162-A166 VanDerWaalsContact O-CB 3.28Å; L162-A166 WeakPolarHBondContact O-CB 3.35Å; L162-A166 PolarHBondContact O-N 2.95Å
163A96.1Very high94.3Very high34 Ų3452.7 Ų52.728%0.28132%0.319SS..Hα-helixtrans-63.3-44.9175.300000111.6S159 G160 L161 A165 A166 T167 V231S159-A163 WeakPolarHBondContact O-CB 3.37Å; S159-A163 PolarHBondContact O-N 3.37Å; G160-A163 PolarHBondContact O-N 3.19Å; L161-A163 VanDerWaalsContact C-N 3.35Å; L161-A163 PolarHBondContact O-N 3.45Å; A163-A165 PolarHBondContact O-N 2.91Å; A163-A166 PolarHBondContact O-N 3.48Å; A163-T167 WeakPolarHBondContact O-CB 3.1Å; A163-T167 PolarHBondContact O-N 2.81Å; A163-T167 PolarHBondContact O-OG1 3.44Å; A163-V231 HydrophobicContact CB-CG1 4.09Å
164C96.4Very high94.7Very high13 Ų1350 Ų509%0.08830%0.304CS..Hα-helixtrans-60.3-46.7175.7-64.10000111.4G160 L161 A166 T167 L168 I232G160-C164 PolarHBondContact O-N 2.91Å; G160-C164 PolarHBondContact O-SG 3.1Å; L161-C164 PolarHBondContact O-N 3.46Å; C164-A166 PolarHBondContact O-N 2.85Å; C164-T167 PolarHBondContact O-N 3.14Å; C164-L168 WeakPolarHBondContact O-CG 3.24Å; C164-L168 PolarHBondContact O-N 3.08Å; C164-I232 HydrophobicContact CB-CD1 4.08Å
165A97Very high95Very high56 Ų5643.9 Ų43.946%0.46328%0.275SS..Hα-helixtrans-62-42.4177.500000112L161 L162 A163 L168 A169L161-A165 WeakPolarHBondContact O-CB 3.33Å; L161-A165 PolarHBondContact O-N 3.2Å; L162-A165 PolarHBondContact O-N 3.43Å; A163-A165 PolarHBondContact O-N 2.91Å; A165-L168 PolarHBondContact O-N 3.37Å; A165-A169 WeakPolarHBondContact O-CB 3.42Å; A165-A169 PolarHBondContact O-N 2.77Å
166A97Very high95.2Very high59 Ų5941.5 Ų41.549%0.48826%0.264SS..Hα-helixtrans-64.3-41.3176.400000112.2L162 A163 C164 A169 L170L162-A166 VanDerWaalsContact O-CB 3.28Å; L162-A166 WeakPolarHBondContact O-CB 3.35Å; L162-A166 PolarHBondContact O-N 2.95Å; A163-A166 PolarHBondContact O-N 3.48Å; C164-A166 PolarHBondContact O-N 2.85Å; A166-A169 PolarHBondContact O-N 3.04Å; A166-L170 VanDerWaalsContact O-CB 3.32Å; A166-L170 WeakPolarHBondContact O-CB 3.46Å; A166-L170 PolarHBondContact O-N 3.46Å
167T96.9Very high95.2Very high23 Ų2347.3 Ų47.314%0.14129%0.291CS..Hα-helixtrans-62.4-42.7174.8-61.80000111.8A163 C164 G171 L194 Y224A163-T167 WeakPolarHBondContact O-CB 3.1Å; A163-T167 PolarHBondContact O-N 2.81Å; A163-T167 PolarHBondContact O-OG1 3.44Å; C164-T167 PolarHBondContact O-N 3.14Å; T167-G171 PolarHBondContact O-N 2.95Å; T167-G171 VanDerWaalsContact O-N 3.1Å; T167-L194 HydrophobicContact CG2-CD1 3.73Å; T167-Y224 HydrophobicContact CG2-CE2 4.21Å; T167-Y224 WeakPolarHBondContact O-CE2 3.37Å; T167-Y224 PolarHBondContact O-OH 3.28Å
168L97.5Very high95.1Very high19 Ų1950.5 Ų50.510%0.09930%0.302CS..Hα-helixtrans-64.4-45.6175.3-71.4171.4000111.3C164 A165 G171 T172 Y187 C190 F191 L194C164-L168 WeakPolarHBondContact O-CG 3.24Å; C164-L168 PolarHBondContact O-N 3.08Å; A165-L168 PolarHBondContact O-N 3.37Å; L168-G171 PolarHBondContact O-N 3.45Å; L168-T172 WeakPolarHBondContact O-CB 3.18Å; L168-T172 PolarHBondContact O-N 2.87Å; L168-T172 PolarHBondContact O-OG1 3.2Å; L168-Y187 HydrophobicContact CB-CE2 4.18Å; L168-Y187 HydrophobicContact CD1-CE2 4.22Å; L168-C190 HydrophobicContact CD2-CB 3.97Å; L168-F191 HydrophobicContact CD1-CD2 4.16Å; L168-F191 HydrophobicContact CD2-CB 4.3Å; L168-L194 HydrophobicContact CD2-CD1 4.06Å
169A97.1Very high94.9Very high53 Ų5349 Ų4944%0.43829%0.29SS..Hα-helixtrans-62.4-44.8178.900000112.2A165 A166 G171 T172 V173A165-A169 WeakPolarHBondContact O-CB 3.42Å; A165-A169 PolarHBondContact O-N 2.77Å; A166-A169 PolarHBondContact O-N 3.04Å; A169-G171 PolarHBondContact O-N 2.86Å; A169-T172 WeakPolarHBondContact O-CB 3.45Å; A169-T172 PolarHBondContact O-N 2.84Å; A169-V173 WeakPolarHBondContact O-CG2 3.49Å; A169-V173 PolarHBondContact O-N 2.83Å
170L96.5Very high94.7Very high112 Ų11251.2 Ų51.259%0.58632%0.315SS*.Hα-helixtrans-60.7-45.6177.8179.964.1000111.7A166 A174A166-L170 VanDerWaalsContact O-CB 3.32Å; A166-L170 WeakPolarHBondContact O-CB 3.46Å; A166-L170 PolarHBondContact O-N 3.46Å; L170-A174 WeakPolarHBondContact O-CB 3.27Å; L170-A174 PolarHBondContact O-N 3.11Å; L170-A174 VanDerWaalsContact O-N 3.17Å
171G95.9Very high94.8Very high0 Ų053.3 Ų53.30%032%0.32CS..Hα-helixtrans-62.9-45.7175.300000111.8T167 L168 A169 V173 A174 F175T167-G171 PolarHBondContact O-N 2.95Å; T167-G171 VanDerWaalsContact O-N 3.1Å; L168-G171 PolarHBondContact O-N 3.45Å; A169-G171 PolarHBondContact O-N 2.86Å; G171-V173 PolarHBondContact O-N 3.47Å; G171-A174 PolarHBondContact O-N 3.31Å; G171-F175 WeakPolarHBondContact O-CD2 3.45Å; G171-F175 PolarHBondContact O-N 3.38Å
172T96.9Very high94.8Very high10 Ų1052.8 Ų52.86%0.06132%0.321CS..Hα-helixtrans-55.8-50-179.8-580000111.3L168 A169 A174 A176 F183 A186 Y187L168-T172 WeakPolarHBondContact O-CB 3.18Å; L168-T172 PolarHBondContact O-N 2.87Å; L168-T172 PolarHBondContact O-OG1 3.2Å; A169-T172 WeakPolarHBondContact O-CB 3.45Å; A169-T172 PolarHBondContact O-N 2.84Å; T172-A174 PolarHBondContact O-N 3.34Å; T172-A176 WeakPolarHBondContact O-CB 3.41Å; T172-A176 PolarHBondContact O-N 3.06Å; T172-F183 HydrophobicContact CG2-CD1 3.94Å; T172-F183 VanDerWaalsContact CG2-O 3.29Å; T172-F183 WeakPolarHBondContact CG2-O 3.25Å; T172-A186 HydrophobicContact CG2-CB 4.14Å; T172-A186 WeakPolarHBondContact O-CB 3.34Å; T172-Y187 VanDerWaalsContact OG1-CA 3.31Å; T172-Y187 WeakPolarHBondContact OG1-CA 3.49Å
173V96.6Very high94.8Very high88 Ų8853.9 Ų53.953%0.53332%0.321SS..Hα-helixtrans-61.7-45179.2173.30000110.9A169 G171 H177 F183A169-V173 WeakPolarHBondContact O-CG2 3.49Å; A169-V173 PolarHBondContact O-N 2.83Å; G171-V173 PolarHBondContact O-N 3.47Å; V173-H177 WeakPolarHBondContact O-CB 3.15Å; V173-H177 PolarHBondContact O-N 3.02Å; V173-F183 HydrophobicContact CG2-CE1 4.23Å
174A94.3Very high94.9Very high15 Ų1559.2 Ų59.212%0.12434%0.338CS..Hα-helixtrans-67.9-49.4-17800000112.6L170 G171 T172 H177 F178 Y220L170-A174 WeakPolarHBondContact O-CB 3.27Å; L170-A174 PolarHBondContact O-N 3.11Å; L170-A174 VanDerWaalsContact O-N 3.17Å; G171-A174 PolarHBondContact O-N 3.31Å; T172-A174 PolarHBondContact O-N 3.34Å; A174-H177 PolarHBondContact O-N 3.34Å; A174-F178 HydrophobicContact CB-CD2 4.31Å; A174-F178 HydrophobicContact CB-CE2 4.41Å; A174-F178 WeakPolarHBondContact O-CB 3.34Å; A174-F178 WeakPolarHBondContact O-CD2 3.37Å; A174-F178 PolarHBondContact O-N 3.29Å; A174-Y220 HydrophobicContact CB-CE1 3.68Å; A174-Y220 WeakPolarHBondContact CB-OH 3.46Å
175F94.1Very high94.8Very high0 Ų061.8 Ų61.80%035%0.349CS..Hα-helixtrans-70.6-34.3-178.5-70.2-65.7000112.4G171 H177 F178 E179 A186 Y189 A204 Y217 Y220 Y224G171-F175 WeakPolarHBondContact O-CD2 3.45Å; G171-F175 PolarHBondContact O-N 3.38Å; F175-H177 VanDerWaalsContact C-N 3.27Å; F175-H177 PolarHBondContact O-N 3.05Å; F175-F178 PolarHBondContact O-N 3Å; F175-E179 WeakPolarHBondContact O-CB 3.48Å; F175-E179 PolarHBondContact O-N 3.46Å; F175-A186 HydrophobicContact CB-CB 4.23Å; F175-Y189 HydrophobicContact CB-CD1 4.49Å; F175-Y189 HydrophobicContact CD1-CE1 4.04Å; F175-Y189 HydrophobicContact CD2-CD1 4.01Å; F175-Y189 AromaticContact CD2-CE1 3.77Å; F175-Y189 HydrophobicContact CD2-CE1 3.77Å; F175-Y189 HydrophobicContact CE1-CE1 4.06Å; F175-Y189 HydrophobicContact CE2-CD1 4.44Å; F175-Y189 AromaticContact CE2-CE1 3.79Å; F175-Y189 HydrophobicContact CE2-CE1 3.79Å; F175-Y189 HydrophobicContact CG-CD1 4.12Å; F175-Y189 AromaticContact CG-CE1 3.92Å; F175-Y189 HydrophobicContact CG-CE1 3.92Å; F175-Y189 AromaticContact CZ-CE1 3.94Å; F175-Y189 HydrophobicContact CZ-CE1 3.94Å; F175-A204 HydrophobicContact CD1-CB 3.93Å; F175-A204 HydrophobicContact CE1-CB 3.66Å; F175-Y217 HydrophobicContact CD1-CE2 4.37Å; F175-Y217 WeakPolarHBondContact CD1-OH 3.1Å; F175-Y217 HydrophobicContact CE1-CE2 4.21Å; F175-Y220 HydrophobicContact CE2-CE1 4.48Å; F175-Y220 HydrophobicContact CZ-CE1 4.2Å; F175-Y224 AromaticContact CE2-CD1 3.53Å; F175-Y224 HydrophobicContact CE2-CD1 3.53Å; F175-Y224 AromaticContact CE2-CE1 3.71Å; F175-Y224 HydrophobicContact CE2-CE1 3.71Å; F175-Y224 AromaticContact CE2-CG 3.98Å; F175-Y224 HydrophobicContact CE2-CG 3.98Å; F175-Y224 AromaticContact CZ-CD1 3.96Å; F175-Y224 HydrophobicContact CZ-CD1 3.96Å; F175-Y224 HydrophobicContact CZ-CG 4.33Å
176A94.8Very high94.8Very high11 Ų1159.1 Ų59.19%0.09133%0.327CS..Hα-helixtrans-59.2-41.517100000111.3T172 G180 W181 F183 A186T172-A176 WeakPolarHBondContact O-CB 3.41Å; T172-A176 PolarHBondContact O-N 3.06Å; A176-G180 CarbonylContact O-C 3.59Å; A176-G180 VanDerWaalsContact O-CA 3.28Å; A176-G180 WeakPolarHBondContact O-CA 3.41Å; A176-G180 PolarHBondContact O-N 3.22Å; A176-G180 VanDerWaalsContact O-N 3.14Å; A176-W181 PolarHBondContact O-N 3.42Å; A176-F183 HydrophobicContact CB-CD1 4.49Å; A176-A186 HydrophobicContact CB-CB 3.83Å
177H91.1Very high94.8Very high150 Ų15061.4 Ų61.469%0.69432%0.324SS*.Hα-helixtrans-72.3-45.3178.1-179.3-88.8000113.2V173 A174 F175V173-H177 WeakPolarHBondContact O-CB 3.15Å; V173-H177 PolarHBondContact O-N 3.02Å; A174-H177 PolarHBondContact O-N 3.34Å; F175-H177 VanDerWaalsContact C-N 3.27Å; F175-H177 PolarHBondContact O-N 3.05Å
178F89.4Confident94.8Very high96 Ų9663.2 Ų63.242%0.42133%0.328SS..Hα-helixtrans-77.2-39.7-174.5-75.8-61.7000114A174 F175 Y217A174-F178 HydrophobicContact CB-CD2 4.31Å; A174-F178 HydrophobicContact CB-CE2 4.41Å; A174-F178 WeakPolarHBondContact O-CB 3.34Å; A174-F178 WeakPolarHBondContact O-CD2 3.37Å; A174-F178 PolarHBondContact O-N 3.29Å; F175-F178 PolarHBondContact O-N 3Å; F178-Y217 HydrophobicContact CB-CD2 3.92Å; F178-Y217 HydrophobicContact CB-CE2 3.44Å; F178-Y217 VanDerWaalsContact CB-CE2 3.44Å; F178-Y217 AromaticContact CD1-CD2 3.92Å; F178-Y217 HydrophobicContact CD1-CD2 3.92Å; F178-Y217 HydrophobicContact CD1-CE2 4.33Å; F178-Y217 HydrophobicContact CD1-CG 4.46Å; F178-Y217 AromaticContact CD2-CD2 3.67Å; F178-Y217 HydrophobicContact CD2-CD2 3.67Å; F178-Y217 AromaticContact CD2-CE2 3.64Å; F178-Y217 HydrophobicContact CD2-CE2 3.64Å; F178-Y217 HydrophobicContact CE1-CD2 4.36Å; F178-Y217 HydrophobicContact CE2-CD2 4.14Å; F178-Y217 HydrophobicContact CE2-CE2 4.48Å; F178-Y217 AromaticContact CG-CD2 3.57Å; F178-Y217 HydrophobicContact CG-CD2 3.57Å; F178-Y217 AromaticContact CG-CE2 3.56Å; F178-Y217 HydrophobicContact CG-CE2 3.56Å; F178-Y217 HydrophobicContact CG-CG 4.45Å; F178-Y217 HydrophobicContact CZ-CD2 4.47Å
179E88.6Confident94.8Very high52 Ų5262.5 Ų62.524%0.24332%0.324CS..Hα-helixtrans-95.8-5.6-178.2-64.9-72.7177.800112.3F175 W181 A204 L205 Y217F175-E179 WeakPolarHBondContact O-CB 3.48Å; F175-E179 PolarHBondContact O-N 3.46Å; E179-W181 HydrophobicContact CB-CD2 3.61Å; E179-W181 HydrophobicContact CB-CE3 4.04Å; E179-W181 HydrophobicContact CB-CG 3.96Å; E179-W181 HydrophobicContact CB-CH2 4.32Å; E179-W181 HydrophobicContact CB-CZ2 3.91Å; E179-W181 HydrophobicContact CB-CZ3 4.38Å; E179-W181 HydrophobicContact CG-CD2 4.37Å; E179-W181 HydrophobicContact CG-CE3 4.43Å; E179-W181 HydrophobicContact CG-CH2 4.05Å; E179-W181 HydrophobicContact CG-CZ2 3.96Å; E179-W181 HydrophobicContact CG-CZ3 4.28Å; E179-W181 PolarHBondContact O-N 3.42Å; E179-A204 WeakPolarHBondContact OE1-CA 3.37Å; E179-L205 PolarHBondContact OE1-N 2.93Å; E179-Y217 WeakPolarHBondContact CG-OH 3.33Å; E179-Y217 PolarHBondContact OE1-OH 2.87Å
180G89.6Confident94.8Very high66 Ų6660 Ų6068%0.6830%0.303SS*.  trans68.418.3-179.200000113.6A176A176-G180 CarbonylContact O-C 3.59Å; A176-G180 VanDerWaalsContact O-CA 3.28Å; A176-G180 WeakPolarHBondContact O-CA 3.41Å; A176-G180 PolarHBondContact O-N 3.22Å; A176-G180 VanDerWaalsContact O-N 3.14Å
181W93.8Very high94.9Very high53 Ų5358.8 Ų58.820%0.20129%0.294CS..  trans-75.7157.2178.2-63-19.2000111.8A176 E179 H185 A186 Y189 F202A176-W181 PolarHBondContact O-N 3.42Å; E179-W181 HydrophobicContact CB-CD2 3.61Å; E179-W181 HydrophobicContact CB-CE3 4.04Å; E179-W181 HydrophobicContact CB-CG 3.96Å; E179-W181 HydrophobicContact CB-CH2 4.32Å; E179-W181 HydrophobicContact CB-CZ2 3.91Å; E179-W181 HydrophobicContact CB-CZ3 4.38Å; E179-W181 HydrophobicContact CG-CD2 4.37Å; E179-W181 HydrophobicContact CG-CE3 4.43Å; E179-W181 HydrophobicContact CG-CH2 4.05Å; E179-W181 HydrophobicContact CG-CZ2 3.96Å; E179-W181 HydrophobicContact CG-CZ3 4.28Å; E179-W181 PolarHBondContact O-N 3.42Å; W181-H185 HydrophobicContact CB-CB 4.19Å; W181-A186 HydrophobicContact CE3-CB 4.45Å; W181-Y189 HydrophobicContact CH2-CD2 4.31Å; W181-Y189 HydrophobicContact CH2-CG 4.26Å; W181-Y189 AromaticContact CZ3-CD1 3.78Å; W181-Y189 HydrophobicContact CZ3-CD1 3.78Å; W181-Y189 HydrophobicContact CZ3-CD2 4.14Å; W181-Y189 HydrophobicContact CZ3-CE1 4.38Å; W181-Y189 AromaticContact CZ3-CG 3.64Å; W181-Y189 HydrophobicContact CZ3-CG 3.64Å; W181-F202 AromaticContact CD2-CD1 3.96Å; W181-F202 HydrophobicContact CD2-CD1 3.96Å; W181-F202 AromaticContact CE2-CD1 3.8Å; W181-F202 HydrophobicContact CE3-CD1 4.3Å; W181-F202 HydrophobicContact CG-CD1 4.46Å; W181-F202 HydrophobicContact CH2-CB 4.08Å; W181-F202 HydrophobicContact CH2-CD1 4.35Å; W181-F202 HydrophobicContact CZ2-CB 4.4Å; W181-F202 HydrophobicContact CZ2-CD1 4.02Å; W181-F202 HydrophobicContact CZ3-CB 4.35Å; W181-F202 HydrophobicContact CZ3-CD1 4.49Å
182T96.2Very high94.9Very high80 Ų8059.4 Ų59.449%0.49130%0.297SS..  trans-63.7152.9167.869.60000109.9F184 H185 A186T182-F184 PolarHBondContact O-N 3.27Å; T182-F184 VanDerWaalsContact O-N 3.15Å; T182-H185 PolarHBondContact O-N 3.38Å; T182-H185 VanDerWaalsContact O-N 3.11Å; T182-H185 PolarHBondContact OG1-CD2 2.93Å; T182-H185 PolarHBondContact OG1-N 3.15Å; T182-A186 PolarHBondContact O-N 3.01Å
183F95.9Very high94.9Very high141 Ų14158.9 Ų58.962%0.61829%0.294SS*.Hα-helixtrans-52.2-38.3176.3-84.3-84.2000112.5T172 V173 A176 Y187T172-F183 HydrophobicContact CG2-CD1 3.94Å; T172-F183 VanDerWaalsContact CG2-O 3.29Å; T172-F183 WeakPolarHBondContact CG2-O 3.25Å; V173-F183 HydrophobicContact CG2-CE1 4.23Å; A176-F183 HydrophobicContact CB-CD1 4.49Å; F183-Y187 VanDerWaalsContact O-CB 3.3Å; F183-Y187 WeakPolarHBondContact O-CB 3.5Å; F183-Y187 PolarHBondContact O-N 3.32Å
184F96.5Very high94.9Very high146 Ų14654.9 Ų54.964%0.6427%0.269SS*.Hα-helixtrans-64.8-47.6178.3-179.4-98.7000112.3T182 Y187 Y188T182-F184 PolarHBondContact O-N 3.27Å; T182-F184 VanDerWaalsContact O-N 3.15Å; F184-Y187 PolarHBondContact O-N 3.23Å; F184-Y188 WeakPolarHBondContact O-CB 3.35Å; F184-Y188 PolarHBondContact O-N 3.21Å
185H95.4Very high95Very high68 Ų6856.5 Ų56.532%0.31528%0.278SS..Hα-helixtrans-65.3-40178.2-71.7-49000112.2W181 T182 Y188 Y189 F202W181-H185 HydrophobicContact CB-CB 4.19Å; T182-H185 PolarHBondContact O-N 3.38Å; T182-H185 VanDerWaalsContact O-N 3.11Å; T182-H185 PolarHBondContact OG1-CD2 2.93Å; T182-H185 PolarHBondContact OG1-N 3.15Å; H185-Y188 PolarHBondContact O-N 3.08Å; H185-Y189 WeakPolarHBondContact O-CB 3.34Å; H185-Y189 PolarHBondContact O-N 3.42Å; H185-F202 HydrophobicContact CB-CD1 4.28Å; H185-F202 HydrophobicContact CB-CE1 3.75Å; H185-F202 HydrophobicContact CB-CZ 3.91Å; H185-F202 AromaticContact CD2-CZ 3.98Å; H185-F202 AromaticContact CE1-CZ 3.67Å; H185-F202 AromaticContact CG-CE1 3.76Å; H185-F202 AromaticContact CG-CZ 3.46Å; H185-F202 VanDerWaalsContact CG-CZ 3.46Å; H185-F202 AromaticContact ND1-CE2 3.59Å; H185-F202 AromaticContact ND1-CZ 3.23Å; H185-F202 WeakPolarHBondContact ND1-CZ 3.48Å
186A96.7Very high95Very high0 Ų059 Ų590%029%0.293CS..Hα-helixtrans-64.4-40175.400000112.2T172 F175 A176 W181 T182 C190T172-A186 HydrophobicContact CG2-CB 4.14Å; T172-A186 WeakPolarHBondContact O-CB 3.34Å; F175-A186 HydrophobicContact CB-CB 4.23Å; A176-A186 HydrophobicContact CB-CB 3.83Å; W181-A186 HydrophobicContact CE3-CB 4.45Å; T182-A186 PolarHBondContact O-N 3.01Å; A186-C190 PolarHBondContact O-N 3.35Å; A186-C190 PolarHBondContact O-SG 2.98Å
187Y97.4Very high95.1Very high106 Ų10662.3 Ų62.342%0.41631%0.308SS..Hα-helixtrans-64.5-48174.9173.6-97.3000111.6L168 T172 F183 F184 Y189 C190 F191L168-Y187 HydrophobicContact CB-CE2 4.18Å; L168-Y187 HydrophobicContact CD1-CE2 4.22Å; T172-Y187 VanDerWaalsContact OG1-CA 3.31Å; T172-Y187 WeakPolarHBondContact OG1-CA 3.49Å; F183-Y187 VanDerWaalsContact O-CB 3.3Å; F183-Y187 WeakPolarHBondContact O-CB 3.5Å; F183-Y187 PolarHBondContact O-N 3.32Å; F184-Y187 PolarHBondContact O-N 3.23Å; Y187-Y189 VanDerWaalsContact C-N 3.34Å; Y187-Y189 PolarHBondContact O-N 3.46Å; Y187-C190 PolarHBondContact O-N 3.48Å; Y187-F191 WeakPolarHBondContact O-CB 3.3Å; Y187-F191 PolarHBondContact O-N 3.39Å
188Y97.3Very high95.3Very high62 Ų6255.4 Ų55.424%0.24328%0.278CS..Hα-helixtrans-56.9-47.4176.1169-93.6000111.3F184 H185 C190 F191 I192 F199 D201 F202F184-Y188 WeakPolarHBondContact O-CB 3.35Å; F184-Y188 PolarHBondContact O-N 3.21Å; H185-Y188 PolarHBondContact O-N 3.08Å; Y188-C190 PolarHBondContact O-N 3.32Å; Y188-F191 PolarHBondContact O-N 2.86Å; Y188-I192 HydrophobicContact CD1-CG1 4.48Å; Y188-I192 HydrophobicContact CD2-CG1 4.01Å; Y188-I192 HydrophobicContact CE1-CG1 4.18Å; Y188-I192 HydrophobicContact CE2-CD1 4.18Å; Y188-I192 HydrophobicContact CE2-CG1 3.69Å; Y188-I192 HydrophobicContact CG-CG1 4.41Å; Y188-I192 WeakPolarHBondContact O-CB 3.29Å; Y188-I192 WeakPolarHBondContact O-CG1 3.47Å; Y188-I192 PolarHBondContact O-N 3.14Å; Y188-F199 VanDerWaalsContact OH-CD2 3.28Å; Y188-F199 WeakPolarHBondContact OH-CD2 3.35Å; Y188-D201 WeakPolarHBondContact CE1-OD2 3.28Å; Y188-D201 PolarHBondContact OH-OD2 3.19Å; Y188-F202 HydrophobicContact CD1-CD2 4.1Å; Y188-F202 HydrophobicContact CE1-CD2 4.05Å
189Y96.6Very high95.4Very high3 Ų357.1 Ų57.11%0.01229%0.285CS..Hα-helixtrans-55.2-52.8173.5166.4-104.6000111.4Y93 F175 W181 H185 Y187 F191 I192 T193 F202 A204Y93-Y189 HydrophobicContact CE1-CE2 4.2Å; Y93-Y189 AromaticContact CZ-CE2 3.96Å; Y93-Y189 WeakPolarHBondContact OH-CE2 3.27Å; Y93-Y189 PolarHBondContact OH-OH 3.33Å; F175-Y189 HydrophobicContact CB-CD1 4.49Å; F175-Y189 HydrophobicContact CD1-CE1 4.04Å; F175-Y189 HydrophobicContact CD2-CD1 4.01Å; F175-Y189 AromaticContact CD2-CE1 3.77Å; F175-Y189 HydrophobicContact CD2-CE1 3.77Å; F175-Y189 HydrophobicContact CE1-CE1 4.06Å; F175-Y189 HydrophobicContact CE2-CD1 4.44Å; F175-Y189 AromaticContact CE2-CE1 3.79Å; F175-Y189 HydrophobicContact CE2-CE1 3.79Å; F175-Y189 HydrophobicContact CG-CD1 4.12Å; F175-Y189 AromaticContact CG-CE1 3.92Å; F175-Y189 HydrophobicContact CG-CE1 3.92Å; F175-Y189 AromaticContact CZ-CE1 3.94Å; F175-Y189 HydrophobicContact CZ-CE1 3.94Å; W181-Y189 HydrophobicContact CH2-CD2 4.31Å; W181-Y189 HydrophobicContact CH2-CG 4.26Å; W181-Y189 AromaticContact CZ3-CD1 3.78Å; W181-Y189 HydrophobicContact CZ3-CD1 3.78Å; W181-Y189 HydrophobicContact CZ3-CD2 4.14Å; W181-Y189 HydrophobicContact CZ3-CE1 4.38Å; W181-Y189 AromaticContact CZ3-CG 3.64Å; W181-Y189 HydrophobicContact CZ3-CG 3.64Å; H185-Y189 WeakPolarHBondContact O-CB 3.34Å; H185-Y189 PolarHBondContact O-N 3.42Å; Y187-Y189 VanDerWaalsContact C-N 3.34Å; Y187-Y189 PolarHBondContact O-N 3.46Å; Y189-F191 VanDerWaalsContact C-N 3.3Å; Y189-F191 PolarHBondContact O-N 3.48Å; Y189-I192 PolarHBondContact O-N 3.16Å; Y189-T193 VanDerWaalsContact CE2-OG1 3.32Å; Y189-T193 WeakPolarHBondContact CE2-OG1 3.41Å; Y189-T193 WeakPolarHBondContact O-CB 3.37Å; Y189-T193 PolarHBondContact O-N 3.14Å; Y189-T193 PolarHBondContact O-OG1 2.97Å; Y189-F202 HydrophobicContact CD2-CB 4.13Å; Y189-F202 VanDerWaalsContact CD2-O 3.27Å; Y189-F202 WeakPolarHBondContact CD2-O 3.44Å; Y189-A204 HydrophobicContact CE1-CB 4.09Å; Y189-A204 HydrophobicContact CE2-CB 4.46Å; Y189-A204 VanDerWaalsContact OH-CB 3.27Å; Y189-A204 WeakPolarHBondContact OH-CB 3.45Å
190C97.3Very high95.4Very high0 Ų055.7 Ų55.70%029%0.285CS..Hα-helixtrans-59.1-42.3180-67.20000111.8L168 A186 Y187 Y188 L194 Y224L168-C190 HydrophobicContact CD2-CB 3.97Å; A186-C190 PolarHBondContact O-N 3.35Å; A186-C190 PolarHBondContact O-SG 2.98Å; Y187-C190 PolarHBondContact O-N 3.48Å; Y188-C190 PolarHBondContact O-N 3.32Å; C190-L194 WeakPolarHBondContact O-CB 3.47Å; C190-L194 VanDerWaalsContact O-CG 3.28Å; C190-L194 WeakPolarHBondContact O-CG 3.47Å; C190-L194 PolarHBondContact O-N 2.67Å; C190-Y224 WeakPolarHBondContact CB-OH 3.43Å
191F97.4Very high95.4Very high88 Ų8856.7 Ų56.739%0.38627%0.274SS..Hα-helixtrans-64.2-52.2179.8-174.7-91.5000111.9L168 Y187 Y188 Y189 T193 L194 T195L168-F191 HydrophobicContact CD1-CD2 4.16Å; L168-F191 HydrophobicContact CD2-CB 4.3Å; Y187-F191 WeakPolarHBondContact O-CB 3.3Å; Y187-F191 PolarHBondContact O-N 3.39Å; Y188-F191 PolarHBondContact O-N 2.86Å; Y189-F191 VanDerWaalsContact C-N 3.3Å; Y189-F191 PolarHBondContact O-N 3.48Å; F191-T193 VanDerWaalsContact C-N 3.29Å; F191-T193 PolarHBondContact O-N 2.96Å; F191-L194 PolarHBondContact O-N 3.26Å; F191-T195 HydrophobicContact CD1-CG2 4.36Å; F191-T195 HydrophobicContact CE1-CG2 4.06Å; F191-T195 HydrophobicContact CE2-CG2 4.35Å; F191-T195 HydrophobicContact CZ-CG2 4.05Å; F191-T195 WeakPolarHBondContact O-CB 3.35Å; F191-T195 VanDerWaalsContact O-CG2 3.28Å; F191-T195 WeakPolarHBondContact O-CG2 3.44Å; F191-T195 PolarHBondContact O-N 2.87Å; F191-T195 PolarHBondContact O-OG1 2.93Å
192I96.8Very high95.3Very high12 Ų1256.4 Ų56.46%0.06227%0.274CS..Hα-helixtrans-64.3-34.2179.5-67.4-57.5000111.9Y188 Y189 T195 T196 I197 G198 F199Y188-I192 HydrophobicContact CD1-CG1 4.48Å; Y188-I192 HydrophobicContact CD2-CG1 4.01Å; Y188-I192 HydrophobicContact CE1-CG1 4.18Å; Y188-I192 HydrophobicContact CE2-CD1 4.18Å; Y188-I192 HydrophobicContact CE2-CG1 3.69Å; Y188-I192 HydrophobicContact CG-CG1 4.41Å; Y188-I192 WeakPolarHBondContact O-CB 3.29Å; Y188-I192 WeakPolarHBondContact O-CG1 3.47Å; Y188-I192 PolarHBondContact O-N 3.14Å; Y189-I192 PolarHBondContact O-N 3.16Å; I192-T195 WeakPolarHBondContact CA-OG1 3.12Å; I192-T195 PolarHBondContact O-OG1 3.47Å; I192-T196 PolarHBondContact O-N 3.39Å; I192-I197 HydrophobicContact CD1-CB 4.34Å; I192-I197 HydrophobicContact CD1-CD1 3.92Å; I192-I197 HydrophobicContact CD1-CG2 4.32Å; I192-I197 HydrophobicContact CG2-CB 4.05Å; I192-I197 HydrophobicContact CG2-CG2 4.17Å; I192-I197 PolarHBondContact O-N 3.35Å; I192-G198 PolarHBondContact O-N 2.83Å; I192-G198 VanDerWaalsContact O-N 3.12Å; I192-F199 HydrophobicContact CD1-CD2 3.96Å; I192-F199 HydrophobicContact CD1-CE2 3.65Å; I192-F199 HydrophobicContact CG1-CD2 4.14Å; I192-F199 HydrophobicContact CG1-CE2 4.32Å; I192-F199 HydrophobicContact CG2-CB 4.43Å; I192-F199 HydrophobicContact CG2-CD2 3.79Å; I192-F199 HydrophobicContact CG2-CE2 4.48Å; I192-F199 HydrophobicContact CG2-CG 4.32Å
193T96.9Very high95Very high0 Ų052.9 Ų52.90%025%0.253CS..Hα-helixtrans-66.1-54.5175.3-60.10000111.7I91 Y93 Y189 F191 T195 T196 I225I91-T193 HydrophobicContact CD1-CG2 4.17Å; Y93-T193 WeakPolarHBondContact OH-CB 3.4Å; Y93-T193 WeakPolarHBondContact OH-CG2 3.47Å; Y93-T193 PolarHBondContact OH-OG1 3.04Å; Y189-T193 VanDerWaalsContact CE2-OG1 3.32Å; Y189-T193 WeakPolarHBondContact CE2-OG1 3.41Å; Y189-T193 WeakPolarHBondContact O-CB 3.37Å; Y189-T193 PolarHBondContact O-N 3.14Å; Y189-T193 PolarHBondContact O-OG1 2.97Å; F191-T193 VanDerWaalsContact C-N 3.29Å; F191-T193 PolarHBondContact O-N 2.96Å; T193-T195 VanDerWaalsContact C-N 3.29Å; T193-T195 PolarHBondContact O-N 3.25Å; T193-T196 PolarHBondContact O-N 3.09Å; T193-I225 HydrophobicContact CG2-CD1 4.44Å; T193-I225 HydrophobicContact CG2-CG1 3.99Å
194L96.5Very high94.5Very high3 Ų346.1 Ų46.12%0.01622%0.223CC..Hα-helixtrans-76.4-18-173.5-64.4-173.7000113.3T167 L168 C190 F191 T196 Y224 L229 I232T167-L194 HydrophobicContact CG2-CD1 3.73Å; L168-L194 HydrophobicContact CD2-CD1 4.06Å; C190-L194 WeakPolarHBondContact O-CB 3.47Å; C190-L194 VanDerWaalsContact O-CG 3.28Å; C190-L194 WeakPolarHBondContact O-CG 3.47Å; C190-L194 PolarHBondContact O-N 2.67Å; F191-L194 PolarHBondContact O-N 3.26Å; L194-T196 VanDerWaalsContact C-N 3.25Å; L194-Y224 HydrophobicContact CD1-CE1 4.3Å; L194-Y224 HydrophobicContact CD2-CE1 4.23Å; L194-Y224 HydrophobicContact CG-CE1 4.35Å; L194-L229 HydrophobicContact CD2-CG 4.38Å; L194-L229 WeakPolarHBondContact O-CD2 3.46Å; L194-I232 HydrophobicContact CB-CG1 4.01Å
195T95.6Very high93.7Very high49 Ų4939.3 Ų39.330%0.30119%0.194SC..THydrogen-bonded Turntrans-84.41.2168.753.70000112.9F191 I192 T193 I197F191-T195 HydrophobicContact CD1-CG2 4.36Å; F191-T195 HydrophobicContact CE1-CG2 4.06Å; F191-T195 HydrophobicContact CE2-CG2 4.35Å; F191-T195 HydrophobicContact CZ-CG2 4.05Å; F191-T195 WeakPolarHBondContact O-CB 3.35Å; F191-T195 VanDerWaalsContact O-CG2 3.28Å; F191-T195 WeakPolarHBondContact O-CG2 3.44Å; F191-T195 PolarHBondContact O-N 2.87Å; F191-T195 PolarHBondContact O-OG1 2.93Å; I192-T195 WeakPolarHBondContact CA-OG1 3.12Å; I192-T195 PolarHBondContact O-OG1 3.47Å; T193-T195 VanDerWaalsContact C-N 3.29Å; T193-T195 PolarHBondContact O-N 3.25Å; T195-I197 PolarHBondContact O-N 3.01Å; T195-I197 WeakPolarHBondContact OG1-CD1 3.28Å
196T96Very high92.5Very high52 Ų5239.5 Ų39.532%0.31919%0.194SC..THydrogen-bonded Turntrans58.524-178.964.10000114T89 T90 I91 I192 T193 L194 L229T89-T196 VanDerWaalsContact O-CG2 3.28Å; T89-T196 WeakPolarHBondContact O-CG2 3.49Å; T90-T196 VanDerWaalsContact O-O 3.1Å; I91-T196 HydrophobicContact CG1-CG2 4.16Å; I192-T196 PolarHBondContact O-N 3.39Å; T193-T196 PolarHBondContact O-N 3.09Å; L194-T196 VanDerWaalsContact C-N 3.25Å; T196-L229 HydrophobicContact CG2-CD2 3.52Å
197I96.4Very high90.9Very high81 Ų8142.5 Ų42.542%0.41522%0.216SC..  trans-77.5-48.5173.8-64.6172.5000109.5I192 T195 F199I192-I197 HydrophobicContact CD1-CB 4.34Å; I192-I197 HydrophobicContact CD1-CD1 3.92Å; I192-I197 HydrophobicContact CD1-CG2 4.32Å; I192-I197 HydrophobicContact CG2-CB 4.05Å; I192-I197 HydrophobicContact CG2-CG2 4.17Å; I192-I197 PolarHBondContact O-N 3.35Å; T195-I197 PolarHBondContact O-N 3.01Å; T195-I197 WeakPolarHBondContact OG1-CD1 3.28Å; I197-F199 HydrophobicContact CG2-CD1 3.92Å; I197-F199 HydrophobicContact CG2-CD2 3.99Å; I197-F199 HydrophobicContact CG2-CE1 3.58Å; I197-F199 HydrophobicContact CG2-CE2 3.68Å; I197-F199 HydrophobicContact CG2-CG 4.12Å; I197-F199 HydrophobicContact CG2-CZ 3.46Å; I197-F199 VanDerWaalsContact CG2-CZ 3.46Å
198G94.8Very high89Confident5 Ų538 Ų385%0.05220%0.202CC..  trans52.359.4171.900000115.6I91 Y93 I192 G200I91-G198 WeakPolarHBondContact O-CA 3.42Å; Y93-G198 VanDerWaalsContact CA-O 3.28Å; Y93-G198 WeakPolarHBondContact CA-O 3.36Å; I192-G198 PolarHBondContact O-N 2.83Å; I192-G198 VanDerWaalsContact O-N 3.12Å; G198-G200 PolarHBondContact O-N 3.1Å
199F91.6Very high87.3Confident133 Ų13341.1 Ų41.158%0.58322%0.218SC*.  trans-59.5-31.9179.1-67.9-55.2000114.4Y188 I192 I197 D201Y188-F199 VanDerWaalsContact OH-CD2 3.28Å; Y188-F199 WeakPolarHBondContact OH-CD2 3.35Å; I192-F199 HydrophobicContact CD1-CD2 3.96Å; I192-F199 HydrophobicContact CD1-CE2 3.65Å; I192-F199 HydrophobicContact CG1-CD2 4.14Å; I192-F199 HydrophobicContact CG1-CE2 4.32Å; I192-F199 HydrophobicContact CG2-CB 4.43Å; I192-F199 HydrophobicContact CG2-CD2 3.79Å; I192-F199 HydrophobicContact CG2-CE2 4.48Å; I192-F199 HydrophobicContact CG2-CG 4.32Å; I197-F199 HydrophobicContact CG2-CD1 3.92Å; I197-F199 HydrophobicContact CG2-CD2 3.99Å; I197-F199 HydrophobicContact CG2-CE1 3.58Å; I197-F199 HydrophobicContact CG2-CE2 3.68Å; I197-F199 HydrophobicContact CG2-CG 4.12Å; I197-F199 HydrophobicContact CG2-CZ 3.46Å; I197-F199 VanDerWaalsContact CG2-CZ 3.46Å; F199-D201 VanDerWaalsContact C-N 3.32Å
200G89.6Confident85.8Confident22 Ų2243 Ų4323%0.22723%0.23CC..SBendtrans81.96.917800000115.6Y93 G198 F202 V203Y93-G200 VanDerWaalsContact O-CA 3.27Å; Y93-G200 WeakPolarHBondContact O-CA 3.45Å; G198-G200 PolarHBondContact O-N 3.1Å; G200-F202 VanDerWaalsContact C-N 3.33Å; G200-V203 WeakPolarHBondContact O-CG2 3.49Å
201D89.4Confident84.3Confident87 Ų8743.5 Ų43.547%0.46523%0.232SC..SBendtrans-65.2-37.4168.256.5-18.6000112Y188 F199Y188-D201 WeakPolarHBondContact CE1-OD2 3.28Å; Y188-D201 PolarHBondContact OH-OD2 3.19Å; F199-D201 VanDerWaalsContact C-N 3.32Å
202F90.6Very high82.8Confident46 Ų4644.1 Ų44.120%0.20224%0.236CC..SBendtrans-118.5126.1166.8-70.3-92.7000109.7W181 H185 Y188 Y189 G200W181-F202 AromaticContact CD2-CD1 3.96Å; W181-F202 HydrophobicContact CD2-CD1 3.96Å; W181-F202 AromaticContact CE2-CD1 3.8Å; W181-F202 HydrophobicContact CE3-CD1 4.3Å; W181-F202 HydrophobicContact CG-CD1 4.46Å; W181-F202 HydrophobicContact CH2-CB 4.08Å; W181-F202 HydrophobicContact CH2-CD1 4.35Å; W181-F202 HydrophobicContact CZ2-CB 4.4Å; W181-F202 HydrophobicContact CZ2-CD1 4.02Å; W181-F202 HydrophobicContact CZ3-CB 4.35Å; W181-F202 HydrophobicContact CZ3-CD1 4.49Å; H185-F202 HydrophobicContact CB-CD1 4.28Å; H185-F202 HydrophobicContact CB-CE1 3.75Å; H185-F202 HydrophobicContact CB-CZ 3.91Å; H185-F202 AromaticContact CD2-CZ 3.98Å; H185-F202 AromaticContact CE1-CZ 3.67Å; H185-F202 AromaticContact CG-CE1 3.76Å; H185-F202 AromaticContact CG-CZ 3.46Å; H185-F202 VanDerWaalsContact CG-CZ 3.46Å; H185-F202 AromaticContact ND1-CE2 3.59Å; H185-F202 AromaticContact ND1-CZ 3.23Å; H185-F202 WeakPolarHBondContact ND1-CZ 3.48Å; Y188-F202 HydrophobicContact CD1-CD2 4.1Å; Y188-F202 HydrophobicContact CE1-CD2 4.05Å; Y189-F202 HydrophobicContact CD2-CB 4.13Å; Y189-F202 VanDerWaalsContact CD2-O 3.27Å; Y189-F202 WeakPolarHBondContact CD2-O 3.44Å; G200-F202 VanDerWaalsContact C-N 3.33Å
203V89.3Confident81.6Confident6 Ų652.4 Ų52.44%0.03627%0.267CS..  trans-138.1120.3178.9-177.60000108.3Y82 Y93 H95 G200 H206Y82-V203 HydrophobicContact CE1-CG1 3.98Å; Y93-V203 HydrophobicContact CD1-CG2 4.15Å; Y93-V203 HydrophobicContact CD2-CG1 4.25Å; Y93-V203 HydrophobicContact CD2-CG2 4.49Å; Y93-V203 HydrophobicContact CG-CG2 3.98Å; H95-V203 HydrophobicContact CB-CG1 4.48Å; H95-V203 HydrophobicContact CB-CG2 4.15Å; G200-V203 WeakPolarHBondContact O-CG2 3.49Å; V203-H206 WeakPolarHBondContact O-CB 3.46Å
204A86.6Confident80.8Confident0 Ų058 Ų580%029%0.291CS..THydrogen-bonded Turntrans-66.8151.1171.100000109.4Y82 F175 E179 Y189 H206Y82-A204 PolarHBondContact OH-O 2.82Å; F175-A204 HydrophobicContact CD1-CB 3.93Å; F175-A204 HydrophobicContact CE1-CB 3.66Å; E179-A204 WeakPolarHBondContact OE1-CA 3.37Å; Y189-A204 HydrophobicContact CE1-CB 4.09Å; Y189-A204 HydrophobicContact CE2-CB 4.46Å; Y189-A204 VanDerWaalsContact OH-CB 3.27Å; Y189-A204 WeakPolarHBondContact OH-CB 3.45Å; A204-H206 VanDerWaalsContact C-N 3.25Å; A204-H206 PolarHBondContact O-N 3.18Å
205L80.1Confident80.2Confident3 Ų362 Ų622%0.01632%0.318CS..THydrogen-bonded Turntrans66.822.5-178.3-49.8167.2000114.2Y82 E179 S207 V210 L211 Y217 V218 F222Y82-L205 HydrophobicContact CD2-CD1 4.47Å; Y82-L205 HydrophobicContact CE2-CD1 4.48Å; E179-L205 PolarHBondContact OE1-N 2.93Å; L205-S207 VanDerWaalsContact C-N 3.29Å; L205-S207 PolarHBondContact O-N 3.47Å; L205-V210 HydrophobicContact CD2-CG1 4.41Å; L205-L211 HydrophobicContact CB-CD1 3.94Å; L205-L211 HydrophobicContact CD1-CD1 4.01Å; L205-L211 HydrophobicContact CD2-CD1 4.26Å; L205-L211 HydrophobicContact CG-CD1 4.32Å; L205-Y217 HydrophobicContact CD2-CD1 3.52Å; L205-Y217 HydrophobicContact CD2-CE1 3.38Å; L205-Y217 HydrophobicContact CG-CE1 4.22Å; L205-V218 HydrophobicContact CD1-CG1 4.33Å; L205-V218 HydrophobicContact CD2-CB 4.42Å; L205-V218 HydrophobicContact CD2-CG2 3.81Å; L205-F222 HydrophobicContact CD1-CE1 3.82Å
206H70.1Confident79.8Confident71 Ų7164.4 Ų64.433%0.32933%0.334SS..  trans-59.6-35.2-175.8-171.576.5000113.9T71 Q74 V203 A204T71-H206 WeakPolarHBondContact CG2-CE1 3.14Å; T71-H206 VanDerWaalsContact CG2-NE2 3.28Å; T71-H206 WeakPolarHBondContact CG2-NE2 3.11Å; Q74-H206 PolarHBondContact NE2-O 2.86Å; V203-H206 WeakPolarHBondContact O-CB 3.46Å; A204-H206 VanDerWaalsContact C-N 3.25Å; A204-H206 PolarHBondContact O-N 3.18Å
207S61.9Low79.4Confident64 Ų6462.4 Ų62.445%0.44832%0.321SS..SBendtrans-87.7118.5-178.3-59.60000110.9L205 E209 V210L205-S207 VanDerWaalsContact C-N 3.29Å; L205-S207 PolarHBondContact O-N 3.47Å; S207-E209 PolarHBondContact O-N 3.4Å; S207-V210 WeakPolarHBondContact O-CB 3.5Å; S207-V210 PolarHBondContact O-N 3.05Å
208G57.9Low79.1Confident12 Ų1259 Ų5912%0.12430%0.303CS..Hα-helixtrans-54.3-21.2178.400000115T71T71-G208 PolarHBondContact O-N 2.99Å
209E61.8Low78.9Confident127 Ų12760.9 Ų60.959%0.59332%0.319SS*.Hα-helixtrans-70-38172.9-129.6-166.5122.200113.1S207 L211 Q212 R213S207-E209 PolarHBondContact O-N 3.4Å; E209-L211 VanDerWaalsContact C-N 3.34Å; E209-Q212 PolarHBondContact O-N 3.24Å; E209-R213 WeakPolarHBondContact O-CB 3.32Å; E209-R213 PolarHBondContact O-N 3.2Å; E209-R213 IonicContact OE1-CZ 3.79Å; E209-R213 IonicContact OE1-NE 2.96Å; E209-R213 IonicContact OE1-NH1 3.82Å; E209-R213 PolarHBondContact OE1-NH1 3.35Å
210V65.8Low79Confident41 Ų4157.7 Ų57.725%0.24830%0.303CS..Hα-helixtrans-68.8-37.4-178.7177.30000110.7L205 S207 Q212 R213 K214 Y217L205-V210 HydrophobicContact CD2-CG1 4.41Å; S207-V210 WeakPolarHBondContact O-CB 3.5Å; S207-V210 PolarHBondContact O-N 3.05Å; V210-Q212 PolarHBondContact O-N 3.48Å; V210-R213 PolarHBondContact O-N 2.89Å; V210-K214 PolarHBondContact O-N 3.36Å; V210-K214 VanDerWaalsContact O-N 3.11Å; V210-Y217 HydrophobicContact CG1-CD1 3.93Å; V210-Y217 HydrophobicContact CG1-CE1 4.15Å
211L65.6Low79.1Confident11 Ų1156.6 Ų56.66%0.05829%0.293CS..Hα-helixtrans-61.5-27.1178.8-154.874.5000112.9A78 G79 L205 E209 V218A78-L211 HydrophobicContact CB-CD1 4.26Å; A78-L211 HydrophobicContact CB-CD2 3.95Å; A78-L211 HydrophobicContact CB-CG 3.79Å; G79-L211 VanDerWaalsContact N-CD2 3.34Å; L205-L211 HydrophobicContact CB-CD1 3.94Å; L205-L211 HydrophobicContact CD1-CD1 4.01Å; L205-L211 HydrophobicContact CD2-CD1 4.26Å; L205-L211 HydrophobicContact CG-CD1 4.32Å; E209-L211 VanDerWaalsContact C-N 3.34Å; L211-V218 HydrophobicContact CD1-CG1 4.17Å; L211-V218 HydrophobicContact CD1-CG2 4.03Å
212Q65.5Low79.3Confident101 Ų10153.5 Ų53.547%0.47228%0.275SS..Hα-helixtrans-98.3-33.2179.8-61.8-64-46.500112.6K76 E209 V210K76-Q212 HydrophobicContact CD-CG 4.35Å; K76-Q212 VanDerWaalsContact CD-NE2 3.3Å; E209-Q212 PolarHBondContact O-N 3.24Å; V210-Q212 PolarHBondContact O-N 3.48Å
213R71.4Confident79.5Confident187 Ų18757 Ų5771%0.70630%0.295SS*.Hα-helixtrans-84-24.4-176-87-173.4154.7169.9-11.9115E209 V210E209-R213 WeakPolarHBondContact O-CB 3.32Å; E209-R213 PolarHBondContact O-N 3.2Å; E209-R213 IonicContact OE1-CZ 3.79Å; E209-R213 IonicContact OE1-NE 2.96Å; E209-R213 IonicContact OE1-NH1 3.82Å; E209-R213 PolarHBondContact OE1-NH1 3.35Å; V210-R213 PolarHBondContact O-N 2.89Å
214K80.8Confident79.9Confident116 Ų11657.3 Ų57.350%0.50430%0.296SS..  trans-13068.1-173.2-63.8-175.1-178.8176.50113.1V210 Y217 V218V210-K214 PolarHBondContact O-N 3.36Å; V210-K214 VanDerWaalsContact O-N 3.11Å; K214-Y217 PolarHBondContact O-N 2.94Å; K214-Y217 VanDerWaalsContact O-N 3.09Å; K214-V218 PolarHBondContact O-N 2.8Å
215P82.4Confident80.3Confident88 Ų8857.3 Ų57.357%0.57130%0.296SS*.Hα-helixtrans-52.4-37.4178.318.7-28.3000116Y217 V218 A219P215-Y217 VanDerWaalsContact C-N 3.32Å; P215-Y217 PolarHBondContact O-N 2.78Å; P215-V218 PolarHBondContact O-N 3.47Å; P215-A219 PolarHBondContact O-N 3.49Å
216P87.4Confident81Confident100 Ų10060.1 Ų60.165%0.64931%0.31SS*.Hα-helixtrans-66.5-33.2178.325.2-35.3000113A219 Y220P216-A219 PolarHBondContact O-N 3.32Å; P216-Y220 WeakPolarHBondContact O-CB 3.44Å; P216-Y220 PolarHBondContact O-N 3.48Å
217Y88.8Confident82.3Confident10 Ų1062 Ų624%0.03932%0.323CS..Hα-helixtrans-70.2-39177.4173.9-121.1000111.9F175 F178 E179 L205 V210 K214 P215 Y220 S221F175-Y217 HydrophobicContact CD1-CE2 4.37Å; F175-Y217 WeakPolarHBondContact CD1-OH 3.1Å; F175-Y217 HydrophobicContact CE1-CE2 4.21Å; F178-Y217 HydrophobicContact CB-CD2 3.92Å; F178-Y217 HydrophobicContact CB-CE2 3.44Å; F178-Y217 VanDerWaalsContact CB-CE2 3.44Å; F178-Y217 AromaticContact CD1-CD2 3.92Å; F178-Y217 HydrophobicContact CD1-CD2 3.92Å; F178-Y217 HydrophobicContact CD1-CE2 4.33Å; F178-Y217 HydrophobicContact CD1-CG 4.46Å; F178-Y217 AromaticContact CD2-CD2 3.67Å; F178-Y217 HydrophobicContact CD2-CD2 3.67Å; F178-Y217 AromaticContact CD2-CE2 3.64Å; F178-Y217 HydrophobicContact CD2-CE2 3.64Å; F178-Y217 HydrophobicContact CE1-CD2 4.36Å; F178-Y217 HydrophobicContact CE2-CD2 4.14Å; F178-Y217 HydrophobicContact CE2-CE2 4.48Å; F178-Y217 AromaticContact CG-CD2 3.57Å; F178-Y217 HydrophobicContact CG-CD2 3.57Å; F178-Y217 AromaticContact CG-CE2 3.56Å; F178-Y217 HydrophobicContact CG-CE2 3.56Å; F178-Y217 HydrophobicContact CG-CG 4.45Å; F178-Y217 HydrophobicContact CZ-CD2 4.47Å; E179-Y217 WeakPolarHBondContact CG-OH 3.33Å; E179-Y217 PolarHBondContact OE1-OH 2.87Å; L205-Y217 HydrophobicContact CD2-CD1 3.52Å; L205-Y217 HydrophobicContact CD2-CE1 3.38Å; L205-Y217 HydrophobicContact CG-CE1 4.22Å; V210-Y217 HydrophobicContact CG1-CD1 3.93Å; V210-Y217 HydrophobicContact CG1-CE1 4.15Å; K214-Y217 PolarHBondContact O-N 2.94Å; K214-Y217 VanDerWaalsContact O-N 3.09Å; P215-Y217 VanDerWaalsContact C-N 3.32Å; P215-Y217 PolarHBondContact O-N 2.78Å; Y217-Y220 HydrophobicContact CD2-CD1 4.46Å; Y217-Y220 PolarHBondContact O-N 3.16Å; Y217-S221 WeakPolarHBondContact O-CB 3.33Å; Y217-S221 PolarHBondContact O-N 3.24Å; Y217-S221 PolarHBondContact O-OG 3.41Å
218V88.9Confident83.9Confident8 Ų859 Ų595%0.04830%0.302CS..Hα-helixtrans-59.5-50.2173.2179.80000110.4A78 L205 L211 K214 P215 Y220 S221 F222A78-V218 HydrophobicContact CB-CG1 4.43Å; L205-V218 HydrophobicContact CD1-CG1 4.33Å; L205-V218 HydrophobicContact CD2-CB 4.42Å; L205-V218 HydrophobicContact CD2-CG2 3.81Å; L211-V218 HydrophobicContact CD1-CG1 4.17Å; L211-V218 HydrophobicContact CD1-CG2 4.03Å; K214-V218 PolarHBondContact O-N 2.8Å; P215-V218 PolarHBondContact O-N 3.47Å; V218-Y220 PolarHBondContact O-N 3.36Å; V218-S221 PolarHBondContact O-N 3.47Å; V218-F222 HydrophobicContact CG1-CD2 4.12Å; V218-F222 HydrophobicContact CG1-CE1 3.95Å; V218-F222 HydrophobicContact CG1-CE2 3.37Å; V218-F222 HydrophobicContact CG1-CZ 3.28Å; V218-F222 WeakPolarHBondContact O-CG 3.5Å; V218-F222 PolarHBondContact O-N 2.94Å
219A90.9Very high85.7Confident46 Ų4658.9 Ų58.938%0.3830%0.298SS..Hα-helixtrans-61.3-44.317800000112P215 P216 S221 F222 L223P215-A219 PolarHBondContact O-N 3.49Å; P216-A219 PolarHBondContact O-N 3.32Å; A219-S221 VanDerWaalsContact C-N 3.31Å; A219-S221 PolarHBondContact O-N 2.96Å; A219-F222 PolarHBondContact O-N 3.4Å; A219-L223 WeakPolarHBondContact O-CB 3.16Å; A219-L223 VanDerWaalsContact O-CG 3.29Å; A219-L223 WeakPolarHBondContact O-CG 3.27Å; A219-L223 PolarHBondContact O-N 2.91Å
220Y93Very high87.4Confident65 Ų6553.6 Ų53.626%0.25527%0.274SS..Hα-helixtrans-55.2-47174171.1-94.5000111.6A174 F175 P216 Y217 V218 F222 L223 Y224A174-Y220 HydrophobicContact CB-CE1 3.68Å; A174-Y220 WeakPolarHBondContact CB-OH 3.46Å; F175-Y220 HydrophobicContact CE2-CE1 4.48Å; F175-Y220 HydrophobicContact CZ-CE1 4.2Å; P216-Y220 WeakPolarHBondContact O-CB 3.44Å; P216-Y220 PolarHBondContact O-N 3.48Å; Y217-Y220 HydrophobicContact CD2-CD1 4.46Å; Y217-Y220 PolarHBondContact O-N 3.16Å; V218-Y220 PolarHBondContact O-N 3.36Å; Y220-F222 PolarHBondContact O-N 3.01Å; Y220-L223 PolarHBondContact O-N 3.23Å; Y220-Y224 VanDerWaalsContact O-CB 3.27Å; Y220-Y224 WeakPolarHBondContact O-CB 3.38Å; Y220-Y224 PolarHBondContact O-N 3.5Å
221S93.1Very high88.8Confident0 Ų052.3 Ų52.30%027%0.267CS..Hα-helixtrans-63.3-42.6-178.5-58.80000112Y217 V218 A219 Y224 I225Y217-S221 WeakPolarHBondContact O-CB 3.33Å; Y217-S221 PolarHBondContact O-N 3.24Å; Y217-S221 PolarHBondContact O-OG 3.41Å; V218-S221 PolarHBondContact O-N 3.47Å; A219-S221 VanDerWaalsContact C-N 3.31Å; A219-S221 PolarHBondContact O-N 2.96Å; S221-Y224 PolarHBondContact O-N 2.95Å; S221-I225 WeakPolarHBondContact O-CG1 3.3Å; S221-I225 PolarHBondContact O-N 3.36Å; S221-I225 VanDerWaalsContact O-N 3.08Å
222F93.6Very high90.2Very high22 Ų2253.3 Ų53.310%0.09627%0.272CS..Hα-helixtrans-65.4-45.6176.6-60.5-15.7000111.9A78 F81 Y82 I85 L205 V218 A219 Y220 Y224 I225 L226A78-F222 WeakPolarHBondContact O-CZ 3.39Å; F81-F222 AromaticContact CD1-CD2 3.61Å; F81-F222 HydrophobicContact CD1-CD2 3.61Å; F81-F222 AromaticContact CD1-CE2 3.47Å; F81-F222 HydrophobicContact CD1-CE2 3.47Å; F81-F222 VanDerWaalsContact CD1-CE2 3.47Å; F81-F222 HydrophobicContact CD1-CG 4.34Å; F81-F222 HydrophobicContact CD1-CZ 4.13Å; F81-F222 AromaticContact CE1-CD2 3.69Å; F81-F222 HydrophobicContact CE1-CD2 3.69Å; F81-F222 HydrophobicContact CE1-CE2 4.06Å; F81-F222 HydrophobicContact CE1-CG 4.3Å; Y82-F222 AromaticContact CD2-CD1 3.82Å; Y82-F222 HydrophobicContact CD2-CD1 3.82Å; Y82-F222 AromaticContact CD2-CE1 3.38Å; Y82-F222 HydrophobicContact CD2-CE1 3.38Å; Y82-F222 HydrophobicContact CD2-CZ 4.46Å; Y82-F222 HydrophobicContact CE2-CE1 4.32Å; Y82-F222 AromaticContact CG-CE1 3.85Å; Y82-F222 HydrophobicContact CG-CE1 3.85Å; I85-F222 HydrophobicContact CD1-CB 4.03Å; I85-F222 HydrophobicContact CD1-CD1 4.13Å; I85-F222 HydrophobicContact CD1-CD2 4.47Å; I85-F222 HydrophobicContact CD1-CG 3.96Å; L205-F222 HydrophobicContact CD1-CE1 3.82Å; V218-F222 HydrophobicContact CG1-CD2 4.12Å; V218-F222 HydrophobicContact CG1-CE1 3.95Å; V218-F222 HydrophobicContact CG1-CE2 3.37Å; V218-F222 HydrophobicContact CG1-CZ 3.28Å; V218-F222 WeakPolarHBondContact O-CG 3.5Å; V218-F222 PolarHBondContact O-N 2.94Å; A219-F222 PolarHBondContact O-N 3.4Å; Y220-F222 PolarHBondContact O-N 3.01Å; F222-Y224 VanDerWaalsContact C-N 3.32Å; F222-Y224 PolarHBondContact O-N 3.03Å; F222-I225 PolarHBondContact O-N 3.09Å; F222-L226 WeakPolarHBondContact O-CG 3.29Å; F222-L226 PolarHBondContact O-N 3.46Å
223L94.6Very high91.6Very high119 Ų11949.6 Ų49.662%0.62326%0.257SS*.Hα-helixtrans-63.5-39.9177.5-70.8173.4000111.6A219 Y220 L226 L227A219-L223 WeakPolarHBondContact O-CB 3.16Å; A219-L223 VanDerWaalsContact O-CG 3.29Å; A219-L223 WeakPolarHBondContact O-CG 3.27Å; A219-L223 PolarHBondContact O-N 2.91Å; Y220-L223 PolarHBondContact O-N 3.23Å; L223-L226 PolarHBondContact O-N 3.18Å; L223-L227 WeakPolarHBondContact O-CB 3.42Å; L223-L227 PolarHBondContact O-N 3.27Å
224Y96.7Very high92.7Very high12 Ų1240.8 Ų40.85%0.04722%0.224CC..Hα-helixtrans-59.6-48.9176.2176.4-95.2000111.5T167 F175 C190 L194 Y220 S221 F222 G228T167-Y224 HydrophobicContact CG2-CE2 4.21Å; T167-Y224 WeakPolarHBondContact O-CE2 3.37Å; T167-Y224 PolarHBondContact O-OH 3.28Å; F175-Y224 AromaticContact CE2-CD1 3.53Å; F175-Y224 HydrophobicContact CE2-CD1 3.53Å; F175-Y224 AromaticContact CE2-CE1 3.71Å; F175-Y224 HydrophobicContact CE2-CE1 3.71Å; F175-Y224 AromaticContact CE2-CG 3.98Å; F175-Y224 HydrophobicContact CE2-CG 3.98Å; F175-Y224 AromaticContact CZ-CD1 3.96Å; F175-Y224 HydrophobicContact CZ-CD1 3.96Å; F175-Y224 HydrophobicContact CZ-CG 4.33Å; C190-Y224 WeakPolarHBondContact CB-OH 3.43Å; L194-Y224 HydrophobicContact CD1-CE1 4.3Å; L194-Y224 HydrophobicContact CD2-CE1 4.23Å; L194-Y224 HydrophobicContact CG-CE1 4.35Å; Y220-Y224 VanDerWaalsContact O-CB 3.27Å; Y220-Y224 WeakPolarHBondContact O-CB 3.38Å; Y220-Y224 PolarHBondContact O-N 3.5Å; S221-Y224 PolarHBondContact O-N 2.95Å; F222-Y224 VanDerWaalsContact C-N 3.32Å; F222-Y224 PolarHBondContact O-N 3.03Å; Y224-G228 WeakPolarHBondContact O-CA 3.37Å; Y224-G228 PolarHBondContact O-N 3.03Å
225I95.9Very high93.4Very high0 Ų037.3 Ų37.30%021%0.209CC..Hα-helixtrans-62-49.6179.5-68.1168.2000110.3Y82 I85 I91 T193 S221 F222 G228 L229Y82-I225 HydrophobicContact CE2-CD1 3.76Å; I85-I225 HydrophobicContact CG2-CG2 4.12Å; I91-I225 HydrophobicContact CD1-CG2 3.66Å; T193-I225 HydrophobicContact CG2-CD1 4.44Å; T193-I225 HydrophobicContact CG2-CG1 3.99Å; S221-I225 WeakPolarHBondContact O-CG1 3.3Å; S221-I225 PolarHBondContact O-N 3.36Å; S221-I225 VanDerWaalsContact O-N 3.08Å; F222-I225 PolarHBondContact O-N 3.09Å; I225-G228 PolarHBondContact O-N 3.41Å; I225-L229 HydrophobicContact CG2-CD1 3.88Å; I225-L229 HydrophobicContact CG2-CG 4.45Å; I225-L229 WeakPolarHBondContact O-CB 3.37Å; I225-L229 VanDerWaalsContact O-CG 3.25Å; I225-L229 WeakPolarHBondContact O-CG 3.42Å; I225-L229 PolarHBondContact O-N 3.46Å
226L95.2Very high93.8Very high62 Ų6237.6 Ų37.633%0.32521%0.205SC..Hα-helixtrans-65.3-44.5-177.6-67.3173.6000112.6I85 F122 F222 L223 T230I85-L226 HydrophobicContact CG2-CD2 4.38Å; F122-L226 HydrophobicContact CZ-CD2 4.5Å; F222-L226 WeakPolarHBondContact O-CG 3.29Å; F222-L226 PolarHBondContact O-N 3.46Å; L223-L226 PolarHBondContact O-N 3.18Å; L226-T230 WeakPolarHBondContact O-CB 3.32Å; L226-T230 PolarHBondContact O-N 3.3Å; L226-T230 VanDerWaalsContact O-N 3.1Å; L226-T230 PolarHBondContact O-OG1 3.02Å
227L96Very high94Very high112 Ų11233.6 Ų33.659%0.58618%0.179SC*.Hα-helixtrans-69-42.9177.7-179.263.5000111.2L223 T230 V231L223-L227 WeakPolarHBondContact O-CB 3.42Å; L223-L227 PolarHBondContact O-N 3.27Å; L227-T230 WeakPolarHBondContact O-CA 3.35Å; L227-T230 WeakPolarHBondContact O-CB 3.35Å; L227-T230 PolarHBondContact O-N 3.19Å; L227-T230 VanDerWaalsContact O-N 3.14Å; L227-V231 WeakPolarHBondContact O-CG2 3.28Å; L227-V231 PolarHBondContact O-N 3.32Å
228G96.8Very high94Very high1 Ų134.4 Ų34.41%0.0118%0.184CC..Hα-helixtrans-62.9-45.6179.700000111.9Y224 I225 T230 V231 I232Y224-G228 WeakPolarHBondContact O-CA 3.37Å; Y224-G228 PolarHBondContact O-N 3.03Å; I225-G228 PolarHBondContact O-N 3.41Å; G228-T230 VanDerWaalsContact C-N 3.25Å; G228-T230 PolarHBondContact O-N 3.36Å; G228-V231 WeakPolarHBondContact O-CB 3.36Å; G228-V231 PolarHBondContact O-N 3.3Å; G228-V231 VanDerWaalsContact O-N 3.09Å; G228-I232 WeakPolarHBondContact O-CG1 3.32Å; G228-I232 PolarHBondContact O-N 2.9Å
229L95.9Very high94Very high8 Ų836.9 Ų36.94%0.04220%0.199CC..Hα-helixtrans-61.9-34.6173.3-72.7174.2000112.1T89 I91 F122 L194 T196 I225 I232 S233T89-L229 HydrophobicContact CG2-CD1 3.59Å; I91-L229 HydrophobicContact CD1-CD1 4.24Å; F122-L229 HydrophobicContact CE1-CB 3.99Å; F122-L229 HydrophobicContact CE2-CB 3.94Å; F122-L229 HydrophobicContact CE2-CD1 3.91Å; F122-L229 HydrophobicContact CZ-CB 3.6Å; F122-L229 HydrophobicContact CZ-CD1 3.75Å; F122-L229 HydrophobicContact CZ-CG 4.35Å; L194-L229 HydrophobicContact CD2-CG 4.38Å; L194-L229 WeakPolarHBondContact O-CD2 3.46Å; T196-L229 HydrophobicContact CG2-CD2 3.52Å; I225-L229 HydrophobicContact CG2-CD1 3.88Å; I225-L229 HydrophobicContact CG2-CG 4.45Å; I225-L229 WeakPolarHBondContact O-CB 3.37Å; I225-L229 VanDerWaalsContact O-CG 3.25Å; I225-L229 WeakPolarHBondContact O-CG 3.42Å; I225-L229 PolarHBondContact O-N 3.46Å; L229-I232 PolarHBondContact O-N 2.94Å; L229-S233 WeakPolarHBondContact O-CB 3.38Å; L229-S233 PolarHBondContact O-N 3.3Å
230T96.1Very high93.7Very high16 Ų1638.1 Ų38.110%0.09820%0.201CC..Hα-helixtrans-64.7-39.7173.6-58.40000111.8L125 L129 L226 L227 G228 A234L125-T230 HydrophobicContact CB-CG2 3.66Å; L129-T230 HydrophobicContact CD2-CG2 4.27Å; L226-T230 WeakPolarHBondContact O-CB 3.32Å; L226-T230 PolarHBondContact O-N 3.3Å; L226-T230 VanDerWaalsContact O-N 3.1Å; L226-T230 PolarHBondContact O-OG1 3.02Å; L227-T230 WeakPolarHBondContact O-CA 3.35Å; L227-T230 WeakPolarHBondContact O-CB 3.35Å; L227-T230 PolarHBondContact O-N 3.19Å; L227-T230 VanDerWaalsContact O-N 3.14Å; G228-T230 VanDerWaalsContact C-N 3.25Å; G228-T230 PolarHBondContact O-N 3.36Å; T230-A234 WeakPolarHBondContact O-CB 3.39Å; T230-A234 PolarHBondContact O-N 2.93Å
231V96.8Very high92.9Very high15 Ų1539.3 Ų39.39%0.09121%0.211CC..Hα-helixtrans-65.5-47.5175.51730000111L129 A163 L227 G228 S233 A234 F235L129-V231 HydrophobicContact CD2-CB 4.49Å; L129-V231 HydrophobicContact CD2-CG2 3.92Å; A163-V231 HydrophobicContact CB-CG1 4.09Å; L227-V231 WeakPolarHBondContact O-CG2 3.28Å; L227-V231 PolarHBondContact O-N 3.32Å; G228-V231 WeakPolarHBondContact O-CB 3.36Å; G228-V231 PolarHBondContact O-N 3.3Å; G228-V231 VanDerWaalsContact O-N 3.09Å; V231-S233 VanDerWaalsContact C-N 3.35Å; V231-S233 PolarHBondContact O-N 3.17Å; V231-A234 WeakPolarHBondContact O-CB 3.4Å; V231-A234 PolarHBondContact O-N 3.39Å; V231-F235 PolarHBondContact O-N 3.22Å
232I95.4Very high92.3Very high31 Ų3146.3 Ų46.316%0.15924%0.238CC..Hα-helixtrans-61.6-44.7176.5-61.7-51.2000110.5C164 L194 G228 L229 A234 F235 L236C164-I232 HydrophobicContact CB-CD1 4.08Å; L194-I232 HydrophobicContact CB-CG1 4.01Å; G228-I232 WeakPolarHBondContact O-CG1 3.32Å; G228-I232 PolarHBondContact O-N 2.9Å; L229-I232 PolarHBondContact O-N 2.94Å; I232-A234 VanDerWaalsContact C-N 3.35Å; I232-A234 PolarHBondContact O-N 2.83Å; I232-F235 PolarHBondContact O-N 2.76Å; I232-L236 HydrophobicContact CG2-CD1 3.95Å; I232-L236 HydrophobicContact CG2-CG 4.2Å; I232-L236 WeakPolarHBondContact O-CB 3.01Å; I232-L236 WeakPolarHBondContact O-CG 3.44Å; I232-L236 PolarHBondContact O-N 3.49Å
233S93.8Very high91.6Very high23 Ų2351.4 Ų51.416%0.16126%0.26CS..Hα-helixtrans-59.3-42.9175177.40000112.2F122 L229 V231 F235 L236 N237F122-S233 PolarHBondContact O-OG 3.32Å; L229-S233 WeakPolarHBondContact O-CB 3.38Å; L229-S233 PolarHBondContact O-N 3.3Å; V231-S233 VanDerWaalsContact C-N 3.35Å; V231-S233 PolarHBondContact O-N 3.17Å; S233-F235 VanDerWaalsContact C-N 3.32Å; S233-F235 PolarHBondContact O-N 3.27Å; S233-L236 PolarHBondContact O-N 3.48Å; S233-N237 VanDerWaalsContact O-CB 3.24Å; S233-N237 WeakPolarHBondContact O-CB 3.44Å; S233-N237 PolarHBondContact O-N 2.95Å
234A94.8Very high90.8Very high3 Ų350.2 Ų50.23%0.02525%0.254CS..Hα-helixtrans-59.8-43.5176.100000111.7L129 N130 T230 V231 I232 L238L129-A234 HydrophobicContact CB-CB 4.23Å; L129-A234 HydrophobicContact CD2-CB 3.92Å; L129-A234 HydrophobicContact CG-CB 4.34Å; N130-A234 PolarHBondContact ND2-O 3.05Å; T230-A234 WeakPolarHBondContact O-CB 3.39Å; T230-A234 PolarHBondContact O-N 2.93Å; V231-A234 WeakPolarHBondContact O-CB 3.4Å; V231-A234 PolarHBondContact O-N 3.39Å; I232-A234 VanDerWaalsContact C-N 3.35Å; I232-A234 PolarHBondContact O-N 2.83Å; A234-L238 PolarHBondContact O-N 3.32Å; A234-L238 VanDerWaalsContact O-N 3.16Å
235F94.8Very high89.7Confident42 Ų4252 Ų5218%0.18427%0.272CS..Hα-helixtrans-66-48176.9179.2-108.5000112.1V157 L161 V231 I232 S233 N237 L238 V239V157-F235 HydrophobicContact CG1-CE2 4.39Å; L161-F235 HydrophobicContact CD2-CE1 4.12Å; L161-F235 HydrophobicContact CD2-CE2 3.74Å; L161-F235 HydrophobicContact CD2-CZ 3.4Å; L161-F235 VanDerWaalsContact CD2-CZ 3.4Å; L161-F235 HydrophobicContact CG-CE2 3.73Å; L161-F235 HydrophobicContact CG-CZ 3.9Å; V231-F235 PolarHBondContact O-N 3.22Å; I232-F235 PolarHBondContact O-N 2.76Å; S233-F235 VanDerWaalsContact C-N 3.32Å; S233-F235 PolarHBondContact O-N 3.27Å; F235-N237 VanDerWaalsContact C-N 3.32Å; F235-N237 PolarHBondContact O-N 3.14Å; F235-L238 WeakPolarHBondContact O-CB 3.46Å; F235-L238 PolarHBondContact O-N 2.89Å; F235-V239 HydrophobicContact CD2-CG2 4.42Å; F235-V239 HydrophobicContact CE1-CG2 4.06Å; F235-V239 HydrophobicContact CE2-CG2 3.94Å; F235-V239 HydrophobicContact CZ-CG2 3.74Å; F235-V239 WeakPolarHBondContact O-CG2 3.4Å; F235-V239 PolarHBondContact O-N 2.9Å; F235-V239 VanDerWaalsContact O-N 3.08Å
236L92.3Very high88.7Confident94 Ų9454.4 Ų54.449%0.49229%0.291SS..Hα-helixtrans-59.4-43.7176.6-70.8177.9000111.2I232 S233 L238 V239 V240I232-L236 HydrophobicContact CG2-CD1 3.95Å; I232-L236 HydrophobicContact CG2-CG 4.2Å; I232-L236 WeakPolarHBondContact O-CB 3.01Å; I232-L236 WeakPolarHBondContact O-CG 3.44Å; I232-L236 PolarHBondContact O-N 3.49Å; S233-L236 PolarHBondContact O-N 3.48Å; L236-L238 VanDerWaalsContact C-N 3.32Å; L236-L238 PolarHBondContact O-N 2.94Å; L236-V239 PolarHBondContact O-N 3.5Å; L236-V240 VanDerWaalsContact O-CB 3.23Å; L236-V240 WeakPolarHBondContact O-CB 3.33Å; L236-V240 WeakPolarHBondContact O-CG2 3.27Å; L236-V240 PolarHBondContact O-N 2.87Å
237N90.3Very high87.5Confident17 Ų1753.9 Ų53.99%0.09129%0.292CS..Hα-helixtrans-58.7-43.7177.3-17032000111.5E127 S233 F235 V239 L241E127-N237 WeakPolarHBondContact CG-ND2 3.36Å; S233-N237 VanDerWaalsContact O-CB 3.24Å; S233-N237 WeakPolarHBondContact O-CB 3.44Å; S233-N237 PolarHBondContact O-N 2.95Å; F235-N237 VanDerWaalsContact C-N 3.32Å; F235-N237 PolarHBondContact O-N 3.14Å; N237-V239 PolarHBondContact O-N 3.27Å; N237-L241 WeakPolarHBondContact O-CB 3.45Å; N237-L241 WeakPolarHBondContact O-CD1 3.33Å; N237-L241 WeakPolarHBondContact O-CG 3.27Å; N237-L241 PolarHBondContact O-N 3.43Å; N237-L241 WeakPolarHBondContact OD1-CD1 3.43Å; N237-L241 WeakPolarHBondContact OD1-CG 3.43Å
238L88.9Confident86Confident27 Ų2751.5 Ų51.514%0.14129%0.289CS..Hα-helixtrans-61.4-44.5176.9-176.870.4000112.3L156 V157 A234 F235 L236 R242L156-L238 HydrophobicContact CB-CD1 4.32Å; L156-L238 HydrophobicContact CB-CD2 3.8Å; L156-L238 HydrophobicContact CD1-CD1 4.46Å; V157-L238 HydrophobicContact CB-CD2 4.41Å; V157-L238 HydrophobicContact CG2-CD2 3.76Å; V157-L238 HydrophobicContact CG2-CG 4.36Å; A234-L238 PolarHBondContact O-N 3.32Å; A234-L238 VanDerWaalsContact O-N 3.16Å; F235-L238 WeakPolarHBondContact O-CB 3.46Å; F235-L238 PolarHBondContact O-N 2.89Å; L236-L238 VanDerWaalsContact C-N 3.32Å; L236-L238 PolarHBondContact O-N 2.94Å; L238-R242 PolarHBondContact O-N 2.91Å
239V88.4Confident84.3Confident60 Ų6054.8 Ų54.836%0.36431%0.307SS..Hα-helixtrans-72.8-45.3-177.81750000111.4F235 L236 N237 R242 F243F235-V239 HydrophobicContact CD2-CG2 4.42Å; F235-V239 HydrophobicContact CE1-CG2 4.06Å; F235-V239 HydrophobicContact CE2-CG2 3.94Å; F235-V239 HydrophobicContact CZ-CG2 3.74Å; F235-V239 WeakPolarHBondContact O-CG2 3.4Å; F235-V239 PolarHBondContact O-N 2.9Å; F235-V239 VanDerWaalsContact O-N 3.08Å; L236-V239 PolarHBondContact O-N 3.5Å; N237-V239 PolarHBondContact O-N 3.27Å; V239-R242 WeakPolarHBondContact O-CB 3.48Å; V239-R242 PolarHBondContact O-N 2.88Å; V239-F243 PolarHBondContact O-N 3.32Å
240V85.4Confident82.5Confident71 Ų7158.6 Ų58.643%0.4332%0.32SS..Hα-helixtrans-65.4-45.2-180171.80000110.4L236 R242 F243 L244L236-V240 VanDerWaalsContact O-CB 3.23Å; L236-V240 WeakPolarHBondContact O-CB 3.33Å; L236-V240 WeakPolarHBondContact O-CG2 3.27Å; L236-V240 PolarHBondContact O-N 2.87Å; V240-R242 VanDerWaalsContact C-N 3.25Å; V240-R242 PolarHBondContact O-N 3.38Å; V240-F243 PolarHBondContact O-N 2.89Å; V240-L244 HydrophobicContact CG1-CD1 3.78Å; V240-L244 HydrophobicContact CG1-CG 4.06Å; V240-L244 WeakPolarHBondContact O-CB 3.38Å; V240-L244 WeakPolarHBondContact O-CG 3.45Å; V240-L244 PolarHBondContact O-N 3.48Å
241L75.3Confident80.8Confident90 Ų9061.8 Ų61.847%0.47134%0.341SS..Hα-helixtrans-58.1-39.5175.4-74172000111.8N237 A245N237-L241 WeakPolarHBondContact O-CB 3.45Å; N237-L241 WeakPolarHBondContact O-CD1 3.33Å; N237-L241 WeakPolarHBondContact O-CG 3.27Å; N237-L241 PolarHBondContact O-N 3.43Å; N237-L241 WeakPolarHBondContact OD1-CD1 3.43Å; N237-L241 WeakPolarHBondContact OD1-CG 3.43Å; L241-A245 VanDerWaalsContact O-CB 3.28Å; L241-A245 WeakPolarHBondContact O-CB 3.43Å; L241-A245 PolarHBondContact O-N 3.38Å
242R80.8Confident79.1Confident148 Ų14866.9 Ų66.956%0.55836%0.364SS*.Hα-helixtrans-63.3-43.9174.8-178.1-179.1179.7174.21.2111.6L238 V239 V240 A246L238-R242 PolarHBondContact O-N 2.91Å; V239-R242 WeakPolarHBondContact O-CB 3.48Å; V239-R242 PolarHBondContact O-N 2.88Å; V240-R242 VanDerWaalsContact C-N 3.25Å; V240-R242 PolarHBondContact O-N 3.38Å; R242-A246 WeakPolarHBondContact O-CB 3.4Å; R242-A246 PolarHBondContact O-N 2.81Å
243F79.2Confident77.2Confident128 Ų12871.5 Ų71.556%0.56138%0.38SS*.Hα-helixtrans-66-44.6179-174.8-95.3000111.9V239 V240 A246 S247V239-F243 PolarHBondContact O-N 3.32Å; V240-F243 PolarHBondContact O-N 2.89Å; F243-A246 PolarHBondContact O-N 3.5Å; F243-S247 WeakPolarHBondContact O-CB 3.49Å; F243-S247 PolarHBondContact O-N 3.01Å
244L77.9Confident75.6Confident94 Ų9472.2 Ų72.249%0.49239%0.387SS..Hα-helixtrans-62-45.7176.8-68.8177.1000111.3V240 A246 S247 A248V240-L244 HydrophobicContact CG1-CD1 3.78Å; V240-L244 HydrophobicContact CG1-CG 4.06Å; V240-L244 WeakPolarHBondContact O-CB 3.38Å; V240-L244 WeakPolarHBondContact O-CG 3.45Å; V240-L244 PolarHBondContact O-N 3.48Å; L244-A246 PolarHBondContact O-N 3Å; L244-S247 WeakPolarHBondContact O-CB 3.5Å; L244-S247 PolarHBondContact O-N 2.9Å; L244-S247 VanDerWaalsContact O-N 3.14Å; L244-S247 PolarHBondContact O-OG 2.92Å; L244-A248 PolarHBondContact O-N 3.08Å
245A74.4Confident74Confident51 Ų5176.2 Ų76.242%0.42142%0.42SS..Hα-helixtrans-60.1-45.3175.100000111.8L241 S247 A248 D249L241-A245 VanDerWaalsContact O-CB 3.28Å; L241-A245 WeakPolarHBondContact O-CB 3.43Å; L241-A245 PolarHBondContact O-N 3.38Å; A245-S247 PolarHBondContact O-N 3.17Å; A245-A248 PolarHBondContact O-N 2.91Å; A245-D249 PolarHBondContact O-N 3.4Å; A245-D249 VanDerWaalsContact O-N 3.09Å
246A73.5Confident72.3Confident50 Ų5083.3 Ų83.341%0.41345%0.445SS..Hα-helixtrans-61.1-33.7176.400000112.7R242 F243 L244R242-A246 WeakPolarHBondContact O-CB 3.4Å; R242-A246 PolarHBondContact O-N 2.81Å; F243-A246 PolarHBondContact O-N 3.5Å; L244-A246 PolarHBondContact O-N 3Å
247S70.6Confident70.3Confident50 Ų5086.9 Ų86.935%0.3545%0.453SS..Hα-helixtrans-71.5-37.8176.981.80000112.7F243 L244 A245F243-S247 WeakPolarHBondContact O-CB 3.49Å; F243-S247 PolarHBondContact O-N 3.01Å; L244-S247 WeakPolarHBondContact O-CB 3.5Å; L244-S247 PolarHBondContact O-N 2.9Å; L244-S247 VanDerWaalsContact O-N 3.14Å; L244-S247 PolarHBondContact O-OG 2.92Å; A245-S247 PolarHBondContact O-N 3.17Å
248A65.4Low68.6Low62 Ų6291.9 Ų91.951%0.51249%0.486SS..Hα-helixtrans-73.9-31.8-178.800000113.6L244 A245 W250 P251L244-A248 PolarHBondContact O-N 3.08Å; A245-A248 PolarHBondContact O-N 2.91Å; A248-W250 PolarHBondContact O-N 3.38Å; A248-P251 WeakPolarHBondContact O-CD 3.42Å; A248-P251 VanDerWaalsContact O-CG 3.26Å; A248-P251 WeakPolarHBondContact O-CG 3.27Å
249D60.1Low67.1Low71 Ų7195.5 Ų95.538%0.3851%0.513SS..Hα-helixtrans-67.7-18.1178.8-73.8-10.9000114.4A245 E252 R253A245-D249 PolarHBondContact O-N 3.4Å; A245-D249 VanDerWaalsContact O-N 3.09Å; D249-E252 PolarHBondContact O-N 3.35Å; D249-R253 PolarHBondContact O-N 2.84Å; D249-R253 VanDerWaalsContact O-N 3.11Å; D249-R253 IonicContact OD2-CZ 3.89Å; D249-R253 IonicContact OD2-NH1 2.82Å; D249-R253 PolarHBondContact OD2-NH1 2.85Å; D249-R253 IonicContact OD2-NH2 3.6Å
250W58.5Low65.6Low87 Ų8798 Ų9833%0.3353%0.531SS..Hα-helixtrans-64.1-47.6-173.4-176.9-109.8000115.3R7 A248 E252 R253 A254R7-W250 VanDerWaalsContact CZ-CD1 3.47Å; R7-W250 VanDerWaalsContact CZ-CG 3.43Å; R7-W250 VanDerWaalsContact NH2-CB 3.33Å; R7-W250 VanDerWaalsContact NH2-CE3 3.3Å; A248-W250 PolarHBondContact O-N 3.38Å; W250-E252 VanDerWaalsContact C-N 3.29Å; W250-E252 PolarHBondContact O-N 3.46Å; W250-R253 PolarHBondContact O-N 3.43Å; W250-A254 WeakPolarHBondContact O-CB 3.45Å; W250-A254 PolarHBondContact O-N 3.44Å
251P60.3Low63.9Low83 Ų83106.2 Ų106.254%0.53955%0.554SS.*Hα-helixtrans-56.8-40.3174.917.4-31.7000112.9A248 A254 A255A248-P251 WeakPolarHBondContact O-CD 3.42Å; A248-P251 VanDerWaalsContact O-CG 3.26Å; A248-P251 WeakPolarHBondContact O-CG 3.27Å; P251-A254 PolarHBondContact O-N 3.47Å; P251-A255 PolarHBondContact O-N 3.48Å
252E60.3Low62.5Low123 Ų123113 Ų11358%0.57557%0.574SS**Hα-helixtrans-68.4-42.2179.1-68.9-166.417300113D249 W250 A254 A255 R256D249-E252 PolarHBondContact O-N 3.35Å; W250-E252 VanDerWaalsContact C-N 3.29Å; W250-E252 PolarHBondContact O-N 3.46Å; E252-A254 VanDerWaalsContact C-N 3.27Å; E252-A254 PolarHBondContact O-N 3.35Å; E252-A255 PolarHBondContact O-N 3.13Å; E252-R256 WeakPolarHBondContact O-CG 3.4Å; E252-R256 PolarHBondContact O-N 3.35Å; E252-R256 VanDerWaalsContact O-N 3.13Å
253R57.1Low60.8Low128 Ų128112.5 Ų112.548%0.48359%0.589SS.*Hα-helixtrans-64.9-32174.9-73.1-169.2-74-103.90.2112.3D249 W250D249-R253 PolarHBondContact O-N 2.84Å; D249-R253 VanDerWaalsContact O-N 3.11Å; D249-R253 IonicContact OD2-CZ 3.89Å; D249-R253 IonicContact OD2-NH1 2.82Å; D249-R253 PolarHBondContact OD2-NH1 2.85Å; D249-R253 IonicContact OD2-NH2 3.6Å; W250-R253 PolarHBondContact O-N 3.43Å
254A60.1Low59.5Low38 Ų38110.2 Ų110.231%0.31460%0.602SS.*Hα-helixtrans-71.7-35.7175.300000112.3W250 P251 E252W250-A254 WeakPolarHBondContact O-CB 3.45Å; W250-A254 PolarHBondContact O-N 3.44Å; P251-A254 PolarHBondContact O-N 3.47Å; E252-A254 VanDerWaalsContact C-N 3.27Å; E252-A254 PolarHBondContact O-N 3.35Å
255A61.3Low57.7Low87 Ų87110.1 Ų110.172%0.71962%0.615SS**Hα-helixtrans-71.8-26.8176.900000113.6P251 E252P251-A255 PolarHBondContact O-N 3.48Å; E252-A255 PolarHBondContact O-N 3.13Å
256R57.3Low56.1Low190 Ų190113.7 Ų113.772%0.71763%0.634SS**THydrogen-bonded Turntrans-850.9177.7-67.8179.3-167.6-107.33.6114.7E252 P258E252-R256 WeakPolarHBondContact O-CG 3.4Å; E252-R256 PolarHBondContact O-N 3.35Å; E252-R256 VanDerWaalsContact O-N 3.13Å; R256-P258 WeakPolarHBondContact O-CD 3.32Å
257R50.5Low54.6Low170 Ų170119.9 Ų119.964%0.64265%0.654SS**SBendtrans-66.7124.6174.1-72.4-169.6177.8-148.3-1.9108.7S259R257-S259 PolarHBondContact O-N 3.19Å
258P54.8Low53.1Low121 Ų121123.1 Ų123.179%0.78668%0.677SS**PPolyproline II helixtrans-55.6127.5175.2-20.130000109.1R256R256-P258 WeakPolarHBondContact O-CD 3.32Å
259S58.4Low52Low103 Ų103131.3 Ų131.372%0.7270%0.695SS**PPolyproline II helixtrans-53136.5166.1-1770000108.2R257 R261R257-S259 PolarHBondContact O-N 3.19Å; S259-R261 PolarHBondContact O-N 3.18Å
260P56.1Low50.9Low114 Ų114131 Ų13174%0.7471%0.708SS**PPolyproline II helixtrans-51.7122.3173-2029.7000108.4R262P260-R262 PolarHBondContact O-N 3.46Å
261R50.3Low50.2Low243 Ų243132.7 Ų132.792%0.91773%0.73SS**PPolyproline II helixtrans-51.6117.7172.5-87.1-179.6170168-4.1107.2S259 P263S259-R261 PolarHBondContact O-N 3.18Å; R261-P263 WeakPolarHBondContact O-CD 3.42Å
262R45.3Very low49.3Very low232 Ų232141 Ų14188%0.87575%0.751SS**PPolyproline II helixtrans-57123.4169-75.9-174.7174.6-172.9-1.7107.5P260 G264P260-R262 PolarHBondContact O-N 3.46Å; R262-G264 PolarHBondContact O-N 3.12Å
263P45.7Very low48.2Very low137 Ų137142.8 Ų142.889%0.8976%0.764SS**SBendtrans-69122.7169.6-9.324.8000107.9R261R261-P263 WeakPolarHBondContact O-CD 3.42Å
264G51.8Low47.3Very low80 Ų80142.3 Ų142.383%0.82578%0.777SS**  trans111.553.6166.700000117.1R262R262-G264 PolarHBondContact O-N 3.12Å
265A39.1Very low46.2Very low93 Ų93152.3 Ų152.377%0.76981%0.807SS**  trans-101.7127.2157.200000108.8
266P42.3Very low44.8Very low126 Ų126159.5 Ų159.582%0.81882%0.815SS**  trans-70139.1-177.428.2-32.4000111S268P266-S268 PolarHBondContact O-N 3.06Å; P266-S268 VanDerWaalsContact O-N 3.1Å
267E42.2Very low43.7Very low179 Ų179156.3 Ų156.384%0.83682%0.82SS**  trans-78.188.2-176.4-150.3178.1173.800109.8R269E267-R269 PolarHBondContact O-N 3.5Å
268S38.1Very low43Very low118 Ų118153.4 Ų153.483%0.82583%0.831SS**  trans-79.6100.8172.763.10000110P266 G270P266-S268 PolarHBondContact O-N 3.06Å; P266-S268 VanDerWaalsContact O-N 3.1Å; S268-G270 PolarHBondContact O-N 3.02Å
269R41.8Very low41.9Very low235 Ų235153.1 Ų153.189%0.88783%0.832SS**  trans-65.7118.1167.5-71.8-177.6176.2-167.3-0.4109.6E267E267-R269 PolarHBondContact O-N 3.5Å
270G38.3Very low40.8Very low65 Ų65153.9 Ų153.967%0.6784%0.838SS**  trans-132.6155.717000000111S268S268-G270 PolarHBondContact O-N 3.02Å
271P43.4Very low39.6Very low122 Ų122152.4 Ų152.479%0.79284%0.844SS**  trans-79.7155.7-150-11.728.3000115.2L273P271-L273 PolarHBondContact O-N 2.94Å
272W40.5Very low38.7Very low256 Ų256144.3 Ų144.397%0.9784%0.836SS**  trans-45113.9176-61.687.6000114.2
273L38.3Very low38.2Very low161 Ų161137.6 Ų137.684%0.84382%0.824SS**  trans-106.4140.5160.2-79.9160.6000109.1P271P271-L273 PolarHBondContact O-N 2.94Å
274P37.7Very low38Very low118 Ų118135.9 Ų135.977%0.76682%0.822SS**PPolyproline II helixtrans-71141.9-169.126.2-31.7000112.8R276P274-R276 PolarHBondContact O-N 3.33Å
275R36.8Very low37.5Very low249 Ų249136.5 Ų136.594%0.9481%0.813SS**PPolyproline II helixtrans-56.6120.7178.1-72.7178.1170.2-168.3-2.5111.3
276R31.4Very low37.5Very low237 Ų237136.8 Ų136.889%0.89481%0.805SS**PPolyproline II helixtrans-78.3142.6158.4-74.9-172.8174.9-167.6-1.1109.6P274P274-R276 PolarHBondContact O-N 3.33Å
277P34.4Very low37.4Very low124 Ų124134.9 Ų134.981%0.80580%0.795SS**PPolyproline II helixtrans-70145-178.128.7-32.5000111.2S279P277-S279 PolarHBondContact O-N 2.85Å
278A36.5Very low37.5Very low108 Ų108131.8 Ų131.889%0.89379%0.788SS**  trans-62.6110.6-178.900000111.3
279S31.9Very low37.6Very low115 Ų115130.2 Ų130.280%0.80478%0.777SS**  trans-84126.4157.754.20000108.6P277 G281P277-S279 PolarHBondContact O-N 2.85Å; S279-G281 PolarHBondContact O-N 3.41Å
280S34.2Very low37.6Very low120 Ų120122.1 Ų122.184%0.83976%0.756SS**  trans-48.3113.9176.849.60000112.2G282S280-G282 PolarHBondContact O-N 3.26Å
281G31.4Very low37.8Very low83 Ų83124.7 Ų124.786%0.85675%0.75SS**  trans-64.3102.9170.100000110.7S279S279-G281 PolarHBondContact O-N 3.41Å
282G31.4Very low38.1Very low73 Ų73123 Ų12375%0.75374%0.737SS**  trans-68130166.300000110.6S280S280-G282 PolarHBondContact O-N 3.26Å
283S35Very low38.3Very low91 Ų91115.3 Ų115.364%0.63671%0.712SS**  trans-41.2137.3173.3-75.60000114S285S283-S285 PolarHBondContact O-N 3.05Å
284A42.1Very low38.6Very low101 Ų101113 Ų11384%0.83570%0.697SS**THydrogen-bonded Turntrans-67.835.9168.400000114
285S40.8Very low39Very low92 Ų92113 Ų11364%0.64369%0.69SS**THydrogen-bonded Turntrans-100.1-3.5170.454.90000112.8S283S283-S285 PolarHBondContact O-N 3.05Å
286V40.2Very low39.5Very low100 Ų100106.8 Ų106.861%0.60667%0.671SS**Hα-helixtrans-82.1-21179.1-179.50000112.6V288 C290V286-V288 PolarHBondContact O-N 3.39Å; V286-C290 WeakPolarHBondContact O-CB 3.47Å; V286-C290 PolarHBondContact O-N 3.02Å
287S40.1Very low40.2Very low86 Ų86103 Ų10360%0.60166%0.657SS**Hα-helixtrans-73.2-23.4-169.4-1550000115.1
288V42.5Very low40.5Very low113 Ų113106.5 Ų106.569%0.68565%0.654SS**Hα-helixtrans-88.1-38.5178-177.20000111.2V286 C290 H291 V292V286-V288 PolarHBondContact O-N 3.39Å; V288-C290 VanDerWaalsContact C-N 3.34Å; V288-C290 PolarHBondContact O-N 2.93Å; V288-H291 PolarHBondContact O-N 3.34Å; V288-V292 WeakPolarHBondContact O-CG2 3.39Å; V288-V292 PolarHBondContact O-N 2.81Å; V288-V292 VanDerWaalsContact O-N 3.16Å
289S41.1Very low40.9Very low85 Ų85105.1 Ų105.159%0.59464%0.643SS**Hα-helixtrans-66.6-36.1175.8-168.30000111.9H291 H293S289-H291 PolarHBondContact O-N 3.42Å; S289-H293 VanDerWaalsContact O-CB 3.3Å; S289-H293 WeakPolarHBondContact O-CB 3.36Å; S289-H293 PolarHBondContact O-N 2.88Å
290C41.3Very low41.6Very low66 Ų66109 Ų10945%0.44664%0.64SS.*Hα-helixtrans-67.9-33.9176.4-154.60000112.6V286 V288 Q294V286-C290 WeakPolarHBondContact O-CB 3.47Å; V286-C290 PolarHBondContact O-N 3.02Å; V288-C290 VanDerWaalsContact C-N 3.34Å; V288-C290 PolarHBondContact O-N 2.93Å; C290-Q294 WeakPolarHBondContact O-CB 3.45Å; C290-Q294 WeakPolarHBondContact O-CG 3.28Å; C290-Q294 PolarHBondContact O-N 3.09Å
291H42Very low42Very low119 Ų119109.5 Ų109.555%0.55163%0.633SS**Hα-helixtrans-73.8-38.4177-104.1-39000113.4V288 S289 Q294 L295V288-H291 PolarHBondContact O-N 3.34Å; S289-H291 PolarHBondContact O-N 3.42Å; H291-Q294 PolarHBondContact O-N 2.96Å; H291-L295 PolarHBondContact O-N 2.89Å
292V49.7Very low42.4Very low87 Ų87112.6 Ų112.653%0.52763%0.63SS.*Hα-helixtrans-67.8-40.2174.5176.70000110.6V288 Q294 L295 E296V288-V292 WeakPolarHBondContact O-CG2 3.39Å; V288-V292 PolarHBondContact O-N 2.81Å; V288-V292 VanDerWaalsContact O-N 3.16Å; V292-Q294 PolarHBondContact O-N 3.13Å; V292-L295 PolarHBondContact O-N 3.26Å; V292-E296 PolarHBondContact O-N 3.14Å
293H45.1Very low43.2Very low93 Ų93117.5 Ų117.543%0.43164%0.638SS.*Hα-helixtrans-70-29.2176.6-160.3-37.1000112.9S289 R297S289-H293 VanDerWaalsContact O-CB 3.3Å; S289-H293 WeakPolarHBondContact O-CB 3.36Å; S289-H293 PolarHBondContact O-N 2.88Å; H293-R297 PolarHBondContact CE1-NE 3.12Å; H293-R297 VanDerWaalsContact CE1-NE 3.35Å; H293-R297 PolarHBondContact CE1-NH2 3.04Å; H293-R297 PolarHBondContact ND1-NE 2.87Å; H293-R297 PolarHBondContact O-N 3.16Å
294Q45.6Very low43.7Very low113 Ų113116.2 Ų116.253%0.52864%0.639SS.*Hα-helixtrans-73.1-34.7171.9-84.6-171.1-10.400112.9C290 H291 V292 R297 R298C290-Q294 WeakPolarHBondContact O-CB 3.45Å; C290-Q294 WeakPolarHBondContact O-CG 3.28Å; C290-Q294 PolarHBondContact O-N 3.09Å; H291-Q294 PolarHBondContact O-N 2.96Å; V292-Q294 PolarHBondContact O-N 3.13Å; Q294-R297 PolarHBondContact O-N 3.36Å; Q294-R298 PolarHBondContact O-N 3.37Å
295L46.5Very low43.3Very low119 Ų119121.5 Ų121.562%0.62364%0.644SS**Hα-helixtrans-68-38.8173.7-80.2161.3000111.7H291 V292 R298 A299H291-L295 PolarHBondContact O-N 2.89Å; V292-L295 PolarHBondContact O-N 3.26Å; L295-R298 PolarHBondContact O-N 3.44Å; L295-A299 WeakPolarHBondContact O-CB 3.48Å; L295-A299 PolarHBondContact O-N 3.22Å
296E47Very low43.2Very low117 Ų117122.6 Ų122.655%0.54765%0.651SS.*Hα-helixtrans-66.7-33.8173.8-103.8-176.2148.700113.6V292 R300V292-E296 PolarHBondContact O-N 3.14Å; E296-R300 PolarHBondContact O-N 2.96Å
297R44.5Very low43.3Very low159 Ų159123.2 Ų123.260%0.666%0.657SS**Hα-helixtrans-71.9-42.5173.1-76-176-161.1-122.90.7111.8H293 Q294 A299 R300 D301H293-R297 PolarHBondContact CE1-NE 3.12Å; H293-R297 VanDerWaalsContact CE1-NE 3.35Å; H293-R297 PolarHBondContact CE1-NH2 3.04Å; H293-R297 PolarHBondContact ND1-NE 2.87Å; H293-R297 PolarHBondContact O-N 3.16Å; Q294-R297 PolarHBondContact O-N 3.36Å; R297-A299 VanDerWaalsContact C-N 3.26Å; R297-A299 PolarHBondContact O-N 2.98Å; R297-R300 PolarHBondContact O-N 3.2Å; R297-D301 PolarHBondContact O-N 3.26Å
298R41Very low43.1Very low196 Ų196125.4 Ų125.474%0.7467%0.67SS**Hα-helixtrans-62.7-30174.7-90.5-175.8177.2-175.8-0.7113.6Q294 L295 R300Q294-R298 PolarHBondContact O-N 3.37Å; L295-R298 PolarHBondContact O-N 3.44Å; R298-R300 VanDerWaalsContact C-N 3.33Å
299A46.4Very low42.8Very low79 Ų79125.6 Ų125.665%0.65368%0.676SS**Hα-helixtrans-74.7-22.6174.100000113.2L295 R297L295-A299 WeakPolarHBondContact O-CB 3.48Å; L295-A299 PolarHBondContact O-N 3.22Å; R297-A299 VanDerWaalsContact C-N 3.26Å; R297-A299 PolarHBondContact O-N 2.98Å
300R44.8Very low42.3Very low198 Ų198127 Ų12775%0.74769%0.686SS**Hα-helixtrans-85.3-21.3179.5-145-178.8-78-179.3-4.8113E296 R297 R298E296-R300 PolarHBondContact O-N 2.96Å; R297-R300 PolarHBondContact O-N 3.2Å; R298-R300 VanDerWaalsContact C-N 3.33Å
301D44.6Very low42.2Very low130 Ų130130.2 Ų130.270%0.69571%0.706SS**SBendtrans-99.5-3.8-176.5-63.5-24.7000114.3R297 L303R297-D301 PolarHBondContact O-N 3.26Å; D301-L303 PolarHBondContact O-N 3.33Å
302N39.1Very low41.7Very low147 Ų147128.2 Ų128.279%0.78672%0.718SS**  trans-89.980.7174.2-93.8-20000111.3G304N302-G304 PolarHBondContact O-N 3.32Å
303L48.7Very low40.8Very low177 Ų177130.6 Ų130.693%0.92773%0.732SS**  trans-75.7107.5161.7-80.6162.8000109.2D301D301-L303 PolarHBondContact O-N 3.33Å
304G45.8Very low40.2Very low64 Ų64132.1 Ų132.166%0.6675%0.748SS**  trans175.649.9175.900000115.6N302N302-G304 PolarHBondContact O-N 3.32Å
305F33.4Very low39.5Very low212 Ų212132.4 Ų132.493%0.9376%0.762SS**  trans-155.3103.2157.4-119-84.8000109
306S38.9Very low38.7Very low115 Ų115130.8 Ų130.880%0.80477%0.774SS**PPolyproline II helixtrans-82.9133.8175.2-60.40000110.2
307P42.3Very low37.9Very low112 Ų112129 Ų12973%0.72779%0.787SS**PPolyproline II helixtrans-78.1152.9170.431.4-31.2000111.1
308P35.6Very low37.2Very low133 Ų133130.9 Ų130.986%0.86480%0.803SS**PPolyproline II helixtrans-72.7132.6178.929-31.5000111.3
309S34.6Very low37Very low117 Ų117125.7 Ų125.782%0.81880%0.802SS**PPolyproline II helixtrans-84.7132.8179.346.70000112.7
310S31.8Very low36.9Very low115 Ų115127.3 Ų127.380%0.80481%0.806SS**PPolyproline II helixtrans-70.2159.7166.1-68.10000112.3
311P39Very low36.3Very low132 Ų132130 Ų13086%0.85782%0.816SS**PPolyproline II helixtrans-88.4136.1-15333.6-32.4000113.7
312G30.5Very low35.9Very low78 Ų78132.5 Ų132.580%0.80483%0.828SS**PPolyproline II helixtrans-103.9131.5169.400000111.5
313V31.8Very low35.7Very low137 Ų137129.3 Ų129.383%0.8383%0.831SS**PPolyproline II helixtrans-63.6144.6170.6174.40000110.6
314V32.2Very low35.3Very low125 Ų125125.9 Ų125.976%0.75883%0.828SS**  169.6125.3123.3160.50000112.1
315S30.4Very low34.9Very low118 Ų118133.2 Ų133.283%0.82584%0.835SS**  trans48.1124.5148-66.60000123.7
316G29.8Very low35.2Very low85 Ų85135 Ų13588%0.87684%0.836SS**  109.394.5104.500000116.7
317G30Very low35.5Very low80 Ų80137 Ų13783%0.82583%0.83SS**  trans-178.797.9167.300000113.3
318Q30.5Very low35.7Very low198 Ų198136.9 Ų136.993%0.92583%0.832SS**  trans-44.6154.2163.8-80.1166.3-10.200112.7
319A37.3Very low36.3Very low88 Ų88141.5 Ų141.573%0.72785%0.847SS**  cis-166.8-152.85.200000108
320P42.8Very low36.3Very low113 Ų113142.7 Ų142.773%0.73485%0.848SS**  -110.4163.6-95.836.7-22.3000113.2
321R33.8Very low36.6Very low253 Ų253144.2 Ų144.296%0.95585%0.851SS**  trans-167.9105.6143.9-104.5158.2-161.4-142.65.9111.8
322L34.6Very low36.4Very low183 Ų183144.8 Ų144.896%0.95885%0.85SS**  trans-66.2139.6161.1-83140000109.9
323G35.9Very low36.8Very low81 Ų81148.8 Ų148.884%0.83585%0.853SS**  trans163.573.5165.300000115.4
324A39.3Very low37.1Very low105 Ų105149.5 Ų149.587%0.86885%0.854SS**  trans-148.197.815500000110.5
325R37.6Very low37.4Very low217 Ų217151.1 Ų151.182%0.81986%0.861SS**  trans-70.7121.7176.4-165.4-175.6-165-154.57.8108.9
326R39.6Very low37.9Very low250 Ų250153.5 Ų153.594%0.94386%0.863SS**  trans-120.1104.3159.2-140-179.9-165.2-132.93.7107.6
327K45.8Very low38.6Very low158 Ų158158.8 Ų158.869%0.68786%0.862SS**  trans-84.1130.6162-81.8-173.2172.2-169.60106.6
328S47.1Very low39.3Very low108 Ų108165.3 Ų165.376%0.75587%0.865SS**  64.4129.995-147.30000110.4
329I46.8Very low40.1Very low230 Ų230162.4 Ų162.4100%1.17986%0.86SS**  cis-151.1042.8-71.4164.1000107.5

Retrieved 329 of 329 residues in 366.8 ms (Link to these results)