A0A3Q0KM14_SCHMA Loading...

Putative neuropeptide F-like receptor

AlphaFold DB , UniProt , Accession A0A3Q0KM14, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 413 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M53.5Low63.8Low219 Ų219119.5 Ų119.5100%1.07960%0.603SS**  0-24.10-85.4175.6162.500113.4S4M1-S4 PolarHBondContact O-OG 3.39Å
2N55.8Low64.1Low142 Ų142117.5 Ų117.576%0.75959%0.593SS**Hα-helixtrans-80-26.5175.2-103.818.3000115.5S5N2-S5 PolarHBondContact O-OG 3.34Å; N2-S5 VanDerWaalsContact O-OG 3.05Å
3D60.1Low64Low123 Ų123116.1 Ų116.166%0.65859%0.588SS**Hα-helixtrans-70.7-36.7-177.6-73.7-33000112.7S5 H6 Y7D3-S5 PolarHBondContact O-N 3.32Å; D3-H6 PolarHBondContact O-N 2.98Å; D3-Y7 HydrophobicContact CB-CE2 4.21Å; D3-Y7 WeakPolarHBondContact O-CD2 3.33Å; D3-Y7 PolarHBondContact O-N 3.32Å
4S64.7Low64.1Low68 Ų68116.1 Ų116.148%0.47659%0.585SS.*Hα-helixtrans-60.4-40.3-178.229.70000113.3M1 H6 Y7 D8M1-S4 PolarHBondContact O-OG 3.39Å; S4-H6 VanDerWaalsContact C-N 3.33Å; S4-H6 PolarHBondContact O-N 3.46Å; S4-Y7 PolarHBondContact O-N 2.99Å; S4-D8 PolarHBondContact O-N 3.34Å; S4-D8 VanDerWaalsContact O-N 3.17Å
5S66.8Low64Low63 Ų63112.1 Ų112.144%0.44157%0.572SS.*Hα-helixtrans-68.6-31.2178.853.20000113.1N2 D3 E9N2-S5 PolarHBondContact O-OG 3.34Å; N2-S5 VanDerWaalsContact O-OG 3.05Å; D3-S5 PolarHBondContact O-N 3.32Å; S5-E9 PolarHBondContact O-N 3.11Å; S5-E9 VanDerWaalsContact O-N 3.12Å
6H65.4Low64Low122 Ų122110.3 Ų110.357%0.56556%0.562SS**Hα-helixtrans-72.1-38.4179.5-17052.1000111.9D3 S4 M10D3-H6 PolarHBondContact O-N 2.98Å; S4-H6 VanDerWaalsContact C-N 3.33Å; S4-H6 PolarHBondContact O-N 3.46Å; H6-M10 WeakPolarHBondContact O-CB 3.34Å; H6-M10 PolarHBondContact O-N 3.12Å; H6-M10 VanDerWaalsContact O-N 3.09Å
7Y62.9Low64.1Low133 Ų133105.9 Ų105.952%0.52255%0.551SS.*Hα-helixtrans-64.7-45.1173.3-70.9-69.2000111.4D3 S4 E9 M10 F11D3-Y7 HydrophobicContact CB-CE2 4.21Å; D3-Y7 WeakPolarHBondContact O-CD2 3.33Å; D3-Y7 PolarHBondContact O-N 3.32Å; S4-Y7 PolarHBondContact O-N 2.99Å; Y7-E9 PolarHBondContact O-N 3.25Å; Y7-M10 HydrophobicContact CD1-CE 4.3Å; Y7-M10 PolarHBondContact O-N 2.94Å; Y7-F11 WeakPolarHBondContact O-CD2 3.45Å; Y7-F11 PolarHBondContact O-N 3.06Å
8D68.6Low64.1Low99 Ų99104.9 Ų104.953%0.52955%0.55SS..Hα-helixtrans-59.5-44.3178.9-70-28.1000112S4 M10 F11 I12S4-D8 PolarHBondContact O-N 3.34Å; S4-D8 VanDerWaalsContact O-N 3.17Å; D8-M10 PolarHBondContact O-N 3.37Å; D8-F11 PolarHBondContact O-N 3.45Å; D8-I12 WeakPolarHBondContact O-CB 3.26Å; D8-I12 WeakPolarHBondContact O-CD1 3.42Å; D8-I12 VanDerWaalsContact O-CG1 3.23Å; D8-I12 WeakPolarHBondContact O-CG1 3.36Å; D8-I12 PolarHBondContact O-N 3.15Å
9E68.1Low64.3Low127 Ų127106.3 Ų106.359%0.59355%0.553SS**Hα-helixtrans-63.2-40.6175-78.1-172.3168.800112.7S5 Y7 I12 N13S5-E9 PolarHBondContact O-N 3.11Å; S5-E9 VanDerWaalsContact O-N 3.12Å; Y7-E9 PolarHBondContact O-N 3.25Å; E9-I12 PolarHBondContact O-N 3.4Å; E9-N13 WeakPolarHBondContact O-CB 3.45Å; E9-N13 VanDerWaalsContact O-CG 3.23Å; E9-N13 PolarHBondContact O-N 3.49Å; E9-N13 PolarHBondContact O-ND2 3.1Å; E9-N13 VanDerWaalsContact O-ND2 3.11Å
10M67.8Low64.4Low93 Ų93104.7 Ų104.746%0.45855%0.545SS..Hα-helixtrans-66.1-42.1177.7-169.9178.870.300111.5H6 Y7 D8 N13 Q14H6-M10 WeakPolarHBondContact O-CB 3.34Å; H6-M10 PolarHBondContact O-N 3.12Å; H6-M10 VanDerWaalsContact O-N 3.09Å; Y7-M10 HydrophobicContact CD1-CE 4.3Å; Y7-M10 PolarHBondContact O-N 2.94Å; D8-M10 PolarHBondContact O-N 3.37Å; M10-N13 PolarHBondContact O-N 3.45Å; M10-Q14 WeakPolarHBondContact O-CB 3.34Å; M10-Q14 PolarHBondContact O-N 3.1Å
11F68.4Low64.7Low126 Ų126106.2 Ų106.255%0.55355%0.549SS*.Hα-helixtrans-63.4-42.6175.4-82.8-68.6000111.9Y7 D8 Q14 S15Y7-F11 WeakPolarHBondContact O-CD2 3.45Å; Y7-F11 PolarHBondContact O-N 3.06Å; D8-F11 PolarHBondContact O-N 3.45Å; F11-Q14 PolarHBondContact O-N 2.94Å; F11-S15 WeakPolarHBondContact O-CB 3.48Å; F11-S15 PolarHBondContact O-N 3.25Å; F11-S15 PolarHBondContact O-OG 3.17Å
12I67.1Low65.4Low95 Ų9599.1 Ų99.149%0.48752%0.521SS..Hα-helixtrans-63.8-44.4175.7-68.9165.6000110.7D8 E9 Q14 S15 M16D8-I12 WeakPolarHBondContact O-CB 3.26Å; D8-I12 WeakPolarHBondContact O-CD1 3.42Å; D8-I12 VanDerWaalsContact O-CG1 3.23Å; D8-I12 WeakPolarHBondContact O-CG1 3.36Å; D8-I12 PolarHBondContact O-N 3.15Å; E9-I12 PolarHBondContact O-N 3.4Å; I12-Q14 VanDerWaalsContact C-N 3.33Å; I12-Q14 PolarHBondContact O-N 2.85Å; I12-S15 WeakPolarHBondContact CA-OG 3.41Å; I12-S15 PolarHBondContact O-N 3.13Å; I12-S15 PolarHBondContact O-OG 2.96Å; I12-M16 HydrophobicContact CG2-CE 4.09Å; I12-M16 HydrophobicContact CG2-CG 4.35Å; I12-M16 HydrophobicContact CG2-SD 4.28Å; I12-M16 VanDerWaalsContact O-CB 3.31Å; I12-M16 WeakPolarHBondContact O-CB 3.42Å; I12-M16 VanDerWaalsContact O-CG 3.23Å; I12-M16 WeakPolarHBondContact O-CG 3.41Å; I12-M16 PolarHBondContact O-N 3.3Å
13N63.4Low66.3Low99 Ų9994.6 Ų94.653%0.52950%0.5SS..Hα-helixtrans-64.6-38.6177.6-74.1-32.6000112.1E9 M10 M16 G17E9-N13 WeakPolarHBondContact O-CB 3.45Å; E9-N13 VanDerWaalsContact O-CG 3.23Å; E9-N13 PolarHBondContact O-N 3.49Å; E9-N13 PolarHBondContact O-ND2 3.1Å; E9-N13 VanDerWaalsContact O-ND2 3.11Å; M10-N13 PolarHBondContact O-N 3.45Å; N13-M16 WeakPolarHBondContact OD1-CE 3.47Å; N13-G17 PolarHBondContact O-N 2.88Å
14Q64.8Low67.1Low117 Ų11791.4 Ų91.455%0.54749%0.488SS..Hα-helixtrans-68.9-44176.2-171.9173.27.500111.8M10 F11 I12 G17 V18M10-Q14 WeakPolarHBondContact O-CB 3.34Å; M10-Q14 PolarHBondContact O-N 3.1Å; F11-Q14 PolarHBondContact O-N 2.94Å; I12-Q14 VanDerWaalsContact C-N 3.33Å; I12-Q14 PolarHBondContact O-N 2.85Å; Q14-G17 PolarHBondContact O-N 3.36Å; Q14-V18 WeakPolarHBondContact O-CG2 3.25Å; Q14-V18 PolarHBondContact O-N 3.18Å
15S62.5Low68.1Low55 Ų5591.9 Ų91.939%0.38549%0.488SS..Hα-helixtrans-64.1-43.6176.966.90000111.2F11 I12 G17 V18 E19F11-S15 WeakPolarHBondContact O-CB 3.48Å; F11-S15 PolarHBondContact O-N 3.25Å; F11-S15 PolarHBondContact O-OG 3.17Å; I12-S15 WeakPolarHBondContact CA-OG 3.41Å; I12-S15 PolarHBondContact O-N 3.13Å; I12-S15 PolarHBondContact O-OG 2.96Å; S15-G17 VanDerWaalsContact C-N 3.33Å; S15-G17 PolarHBondContact O-N 3.42Å; S15-V18 PolarHBondContact O-N 3.3Å; S15-E19 WeakPolarHBondContact O-CB 3.46Å; S15-E19 WeakPolarHBondContact O-CG 3.35Å; S15-E19 PolarHBondContact O-N 3.47Å
16M63.6Low69Low83 Ų8392.4 Ų92.441%0.40949%0.488SS..Hα-helixtrans-61.2-40.5173.5-73.4-166.8-51.500111.8I12 N13 E19 I20I12-M16 HydrophobicContact CG2-CE 4.09Å; I12-M16 HydrophobicContact CG2-CG 4.35Å; I12-M16 HydrophobicContact CG2-SD 4.28Å; I12-M16 VanDerWaalsContact O-CB 3.31Å; I12-M16 WeakPolarHBondContact O-CB 3.42Å; I12-M16 VanDerWaalsContact O-CG 3.23Å; I12-M16 WeakPolarHBondContact O-CG 3.41Å; I12-M16 PolarHBondContact O-N 3.3Å; N13-M16 WeakPolarHBondContact OD1-CE 3.47Å; M16-E19 PolarHBondContact O-N 3.49Å; M16-I20 WeakPolarHBondContact O-CB 3.4Å; M16-I20 WeakPolarHBondContact O-CD1 3.25Å; M16-I20 WeakPolarHBondContact O-CG1 3.49Å; M16-I20 PolarHBondContact O-N 2.93Å
17G65.7Low70Confident36 Ų3688.3 Ų88.337%0.37147%0.47SS..Hα-helixtrans-60.8-46.4175.900000112.8N13 Q14 S15 I20 E21N13-G17 PolarHBondContact O-N 2.88Å; Q14-G17 PolarHBondContact O-N 3.36Å; S15-G17 VanDerWaalsContact C-N 3.33Å; S15-G17 PolarHBondContact O-N 3.42Å; G17-I20 PolarHBondContact O-N 2.95Å; G17-E21 WeakPolarHBondContact O-CB 3.25Å; G17-E21 PolarHBondContact O-N 3.35Å
18V64.7Low71.2Confident89 Ų8984.7 Ų84.754%0.53946%0.461SS..Hα-helixtrans-65.3-40.8176.7174.10000111.4Q14 S15 E21 S22Q14-V18 WeakPolarHBondContact O-CG2 3.25Å; Q14-V18 PolarHBondContact O-N 3.18Å; S15-V18 PolarHBondContact O-N 3.3Å; V18-E21 PolarHBondContact O-N 3.01Å; V18-S22 WeakPolarHBondContact O-CB 3.49Å; V18-S22 PolarHBondContact O-N 3.45Å
19E68.3Low72.2Confident130 Ų13085.2 Ų85.261%0.60746%0.464SS*.Hα-helixtrans-63.5-41.9175.3-75.9179.7-176.800112.1S15 M16 S23S15-E19 WeakPolarHBondContact O-CB 3.46Å; S15-E19 WeakPolarHBondContact O-CG 3.35Å; S15-E19 PolarHBondContact O-N 3.47Å; M16-E19 PolarHBondContact O-N 3.49Å; E19-S23 WeakPolarHBondContact O-CB 3.41Å; E19-S23 PolarHBondContact O-N 3.26Å
20I65.5Low73.3Confident75 Ų7581.9 Ų81.939%0.38545%0.449SS..Hα-helixtrans-64.5-45.1176.8-72.5164.8000110.9M16 G17 S24 V282M16-I20 WeakPolarHBondContact O-CB 3.4Å; M16-I20 WeakPolarHBondContact O-CD1 3.25Å; M16-I20 WeakPolarHBondContact O-CG1 3.49Å; M16-I20 PolarHBondContact O-N 2.93Å; G17-I20 PolarHBondContact O-N 2.95Å; I20-S24 VanDerWaalsContact O-CB 3.32Å; I20-S24 WeakPolarHBondContact O-CB 3.28Å; I20-S24 PolarHBondContact O-N 2.93Å; I20-V282 HydrophobicContact CG2-CG1 4.24Å; I20-V282 HydrophobicContact CG2-CG2 4.06Å
21E70.6Confident74.5Confident137 Ų13778 Ų7864%0.6443%0.431SS*.Hα-helixtrans-67.6-41.9179.3-172.1172.5-165.700112G17 V18 S24 T25G17-E21 WeakPolarHBondContact O-CB 3.25Å; G17-E21 PolarHBondContact O-N 3.35Å; V18-E21 PolarHBondContact O-N 3.01Å; E21-S24 PolarHBondContact O-N 3.49Å; E21-T25 PolarHBondContact O-N 2.8Å; E21-T25 PolarHBondContact O-OG1 3.4Å
22S68.1Low75.6Confident70 Ų7075.1 Ų75.149%0.4943%0.43SS..Hα-helixtrans-63-48174.4-172.50000111.4V18 S24 T25 V26V18-S22 WeakPolarHBondContact O-CB 3.49Å; V18-S22 PolarHBondContact O-N 3.45Å; S22-S24 VanDerWaalsContact C-N 3.31Å; S22-S24 PolarHBondContact O-N 2.92Å; S22-T25 PolarHBondContact O-N 3.35Å; S22-T25 VanDerWaalsContact O-N 3.16Å; S22-V26 WeakPolarHBondContact O-CG2 3.38Å; S22-V26 PolarHBondContact O-N 2.93Å
23S74.3Confident76.9Confident46 Ų4674.6 Ų74.632%0.32243%0.432SS..Hα-helixtrans-58.4-43.3176.4-177.90000111.7E19 T25 V26 M27 H286E19-S23 WeakPolarHBondContact O-CB 3.41Å; E19-S23 PolarHBondContact O-N 3.26Å; S23-T25 PolarHBondContact O-N 3.26Å; S23-V26 PolarHBondContact O-N 2.92Å; S23-M27 WeakPolarHBondContact O-CG 3.46Å; S23-M27 PolarHBondContact O-N 3.43Å; S23-H286 PolarHBondContact O-NE2 3.04Å; S23-H286 PolarHBondContact OG-CD2 3.46Å; S23-H286 PolarHBondContact OG-NE2 3.46Å
24S78.5Confident78.4Confident56 Ų5672.9 Ų72.939%0.39242%0.422SS..Hα-helixtrans-63-40.9176.8-176.90000112.2I20 E21 S22 M27 T28I20-S24 VanDerWaalsContact O-CB 3.32Å; I20-S24 WeakPolarHBondContact O-CB 3.28Å; I20-S24 PolarHBondContact O-N 2.93Å; E21-S24 PolarHBondContact O-N 3.49Å; S22-S24 VanDerWaalsContact C-N 3.31Å; S22-S24 PolarHBondContact O-N 2.92Å; S24-M27 PolarHBondContact O-N 3.18Å; S24-T28 WeakPolarHBondContact O-CB 3.26Å; S24-T28 PolarHBondContact O-N 3.3Å; S24-T28 PolarHBondContact O-OG1 3.38Å
25T84.7Confident79.8Confident79 Ų7967.6 Ų67.649%0.48540%0.397SS..Hα-helixtrans-65.1-46.5177.1-57.30000111.3E21 S22 S23 M27 T28 L29E21-T25 PolarHBondContact O-N 2.8Å; E21-T25 PolarHBondContact O-OG1 3.4Å; S22-T25 PolarHBondContact O-N 3.35Å; S22-T25 VanDerWaalsContact O-N 3.16Å; S23-T25 PolarHBondContact O-N 3.26Å; T25-M27 PolarHBondContact O-N 3.14Å; T25-T28 WeakPolarHBondContact O-CB 3.43Å; T25-T28 PolarHBondContact O-N 2.87Å; T25-L29 WeakPolarHBondContact O-CG 3.32Å; T25-L29 PolarHBondContact O-N 2.76Å
26V86.7Confident81.4Confident73 Ų7367.7 Ų67.744%0.44240%0.396SS..Hα-helixtrans-60.2-46.4176.9173.20000110.9S22 S23 T28 L29 I30S22-V26 WeakPolarHBondContact O-CG2 3.38Å; S22-V26 PolarHBondContact O-N 2.93Å; S23-V26 PolarHBondContact O-N 2.92Å; V26-T28 VanDerWaalsContact C-N 3.33Å; V26-T28 PolarHBondContact O-N 3.5Å; V26-L29 PolarHBondContact O-N 2.89Å; V26-I30 HydrophobicContact CG1-CD1 3.87Å; V26-I30 HydrophobicContact CG1-CG1 4.43Å; V26-I30 VanDerWaalsContact O-CG1 3.3Å; V26-I30 WeakPolarHBondContact O-CG1 3.27Å; V26-I30 PolarHBondContact O-N 3.27Å
27M86.3Confident83Confident36 Ų3667.3 Ų67.318%0.17740%0.395CS..Hα-helixtrans-62.8-39.6176.8-74.6-52.2164.600112.7S23 S24 T25 L29 I30 V31 H286 L290S23-M27 WeakPolarHBondContact O-CG 3.46Å; S23-M27 PolarHBondContact O-N 3.43Å; S24-M27 PolarHBondContact O-N 3.18Å; T25-M27 PolarHBondContact O-N 3.14Å; M27-L29 VanDerWaalsContact C-N 3.31Å; M27-L29 PolarHBondContact O-N 3.36Å; M27-I30 PolarHBondContact O-N 2.75Å; M27-I30 HydrophobicContact SD-CD1 3.98Å; M27-V31 WeakPolarHBondContact O-CB 3.31Å; M27-V31 VanDerWaalsContact O-CG2 3.26Å; M27-V31 WeakPolarHBondContact O-CG2 3.43Å; M27-V31 PolarHBondContact O-N 3.01Å; M27-H286 WeakPolarHBondContact CG-CD2 3.46Å; M27-H286 WeakPolarHBondContact CG-NE2 3.33Å; M27-L290 HydrophobicContact CE-CD1 4.04Å; M27-L290 HydrophobicContact CE-CG 4.5Å; M27-L290 HydrophobicContact SD-CD2 4.23Å; M27-L290 HydrophobicContact SD-CG 4.45Å
28T87.5Confident84.4Confident57 Ų5766.2 Ų66.235%0.3538%0.381SS..Hα-helixtrans-59.6-44176.1-57.90000110.8S24 T25 V26 V31 A32S24-T28 WeakPolarHBondContact O-CB 3.26Å; S24-T28 PolarHBondContact O-N 3.3Å; S24-T28 PolarHBondContact O-OG1 3.38Å; T25-T28 WeakPolarHBondContact O-CB 3.43Å; T25-T28 PolarHBondContact O-N 2.87Å; V26-T28 VanDerWaalsContact C-N 3.33Å; V26-T28 PolarHBondContact O-N 3.5Å; T28-V31 PolarHBondContact O-N 3.36Å; T28-A32 VanDerWaalsContact O-CB 3.3Å; T28-A32 WeakPolarHBondContact O-CB 3.44Å; T28-A32 PolarHBondContact O-N 3.31Å
29L90.2Very high86Confident110 Ų11063.9 Ų63.958%0.57637%0.365SS*.Hα-helixtrans-63.7-43.6175.6-69.5174.8000112.2T25 V26 M27 V31 A32 V33T25-L29 WeakPolarHBondContact O-CG 3.32Å; T25-L29 PolarHBondContact O-N 2.76Å; V26-L29 PolarHBondContact O-N 2.89Å; M27-L29 VanDerWaalsContact C-N 3.31Å; M27-L29 PolarHBondContact O-N 3.36Å; L29-V31 VanDerWaalsContact C-N 3.33Å; L29-V31 PolarHBondContact O-N 3.31Å; L29-A32 PolarHBondContact O-N 2.92Å; L29-V33 WeakPolarHBondContact O-CG2 3.42Å; L29-V33 PolarHBondContact O-N 3.43Å; L29-V33 VanDerWaalsContact O-N 3.1Å
30I91.5Very high87.3Confident57 Ų5762.2 Ų62.229%0.29236%0.359SS..Hα-helixtrans-59.9-46.4176.2-65.7168.1000109.9V26 M27 A32 V33 I34 M293V26-I30 HydrophobicContact CG1-CD1 3.87Å; V26-I30 HydrophobicContact CG1-CG1 4.43Å; V26-I30 VanDerWaalsContact O-CG1 3.3Å; V26-I30 WeakPolarHBondContact O-CG1 3.27Å; V26-I30 PolarHBondContact O-N 3.27Å; M27-I30 PolarHBondContact O-N 2.75Å; M27-I30 HydrophobicContact SD-CD1 3.98Å; I30-A32 PolarHBondContact O-N 3.14Å; I30-V33 PolarHBondContact O-N 3.32Å; I30-I34 HydrophobicContact CG2-CG1 3.91Å; I30-I34 WeakPolarHBondContact O-CB 3.42Å; I30-I34 VanDerWaalsContact O-CG1 3.27Å; I30-I34 WeakPolarHBondContact O-CG1 3.39Å; I30-I34 PolarHBondContact O-N 3.33Å; I30-M293 HydrophobicContact CG2-CE 3.7Å; I30-M293 HydrophobicContact CG2-SD 4.08Å
31V91.9Very high88.9Confident12 Ų1263.7 Ų63.77%0.07336%0.363CS..Hα-helixtrans-61-46.3178.4168.90000111M27 T28 L29 V33 Y35 P86 I289 M293M27-V31 WeakPolarHBondContact O-CB 3.31Å; M27-V31 VanDerWaalsContact O-CG2 3.26Å; M27-V31 WeakPolarHBondContact O-CG2 3.43Å; M27-V31 PolarHBondContact O-N 3.01Å; T28-V31 PolarHBondContact O-N 3.36Å; L29-V31 VanDerWaalsContact C-N 3.33Å; L29-V31 PolarHBondContact O-N 3.31Å; V31-V33 PolarHBondContact O-N 3.44Å; V31-Y35 HydrophobicContact CB-CD2 4.21Å; V31-Y35 HydrophobicContact CB-CE2 4.47Å; V31-Y35 HydrophobicContact CG1-CD2 3.74Å; V31-Y35 HydrophobicContact CG1-CE2 4.1Å; V31-Y35 HydrophobicContact CG2-CD2 4.34Å; V31-Y35 HydrophobicContact CG2-CE2 4.12Å; V31-Y35 PolarHBondContact O-N 2.68Å; V31-P86 HydrophobicContact CG1-CB 3.66Å; V31-I289 HydrophobicContact CG2-CG2 3.44Å; V31-I289 VanDerWaalsContact CG2-CG2 3.44Å; V31-M293 HydrophobicContact CG2-CE 4.19Å
32A91.9Very high90.1Very high65 Ų6557.1 Ų57.154%0.53733%0.332SS..Hα-helixtrans-64.1-25-178.900000113.7T28 L29 I30 P36T28-A32 VanDerWaalsContact O-CB 3.3Å; T28-A32 WeakPolarHBondContact O-CB 3.44Å; T28-A32 PolarHBondContact O-N 3.31Å; L29-A32 PolarHBondContact O-N 2.92Å; I30-A32 PolarHBondContact O-N 3.14Å; A32-P36 WeakPolarHBondContact O-CD 3.32Å; A32-P36 VanDerWaalsContact O-CG 3.27Å; A32-P36 WeakPolarHBondContact O-CG 3.4Å
33V94.2Very high91.5Very high85 Ų8555.1 Ų55.152%0.51532%0.317SS..Hα-helixtrans-95.2-49177.8175.70000111.6L29 I30 V31 L37L29-V33 WeakPolarHBondContact O-CG2 3.42Å; L29-V33 PolarHBondContact O-N 3.43Å; L29-V33 VanDerWaalsContact O-N 3.1Å; I30-V33 PolarHBondContact O-N 3.32Å; V31-V33 PolarHBondContact O-N 3.44Å; V33-L37 HydrophobicContact CG1-CD1 4.06Å; V33-L37 VanDerWaalsContact O-CG 3.3Å; V33-L37 WeakPolarHBondContact O-CG 3.23Å; V33-L37 PolarHBondContact O-N 2.92Å
34I95.3Very high92.6Very high63 Ų6356.8 Ų56.832%0.32333%0.325SS..Hα-helixtrans-76.7-41.6-168-58.9-62.1000112.4I30 L37 I38 M293I30-I34 HydrophobicContact CG2-CG1 3.91Å; I30-I34 WeakPolarHBondContact O-CB 3.42Å; I30-I34 VanDerWaalsContact O-CG1 3.27Å; I30-I34 WeakPolarHBondContact O-CG1 3.39Å; I30-I34 PolarHBondContact O-N 3.33Å; I34-L37 PolarHBondContact O-N 3.49Å; I34-I38 HydrophobicContact CG2-CD1 3.8Å; I34-I38 HydrophobicContact CG2-CG1 4.18Å; I34-I38 WeakPolarHBondContact O-CG1 3.3Å; I34-I38 PolarHBondContact O-N 2.94Å; I34-M293 HydrophobicContact CB-CE 4.17Å; I34-M293 HydrophobicContact CB-SD 3.86Å; I34-M293 HydrophobicContact CG1-SD 4.24Å; I34-M293 HydrophobicContact CG2-CE 4.36Å; I34-M293 HydrophobicContact CG2-CG 3.75Å; I34-M293 HydrophobicContact CG2-SD 3.51Å; I34-M293 VanDerWaalsContact CG2-SD 3.51Å
35Y94.9Very high93.5Very high5 Ų554.7 Ų54.72%0.0231%0.312CS..Hα-helixtrans-62.3-45.8179.8-84.1-89.3000112.7V31 L37 I38 I39 A82 P86 H292 M293 M296V31-Y35 HydrophobicContact CB-CD2 4.21Å; V31-Y35 HydrophobicContact CB-CE2 4.47Å; V31-Y35 HydrophobicContact CG1-CD2 3.74Å; V31-Y35 HydrophobicContact CG1-CE2 4.1Å; V31-Y35 HydrophobicContact CG2-CD2 4.34Å; V31-Y35 HydrophobicContact CG2-CE2 4.12Å; V31-Y35 PolarHBondContact O-N 2.68Å; Y35-L37 VanDerWaalsContact C-N 3.29Å; Y35-L37 PolarHBondContact O-N 3.12Å; Y35-I38 PolarHBondContact O-N 2.75Å; Y35-I39 VanDerWaalsContact O-CG1 3.26Å; Y35-I39 WeakPolarHBondContact O-CG1 3.3Å; Y35-I39 PolarHBondContact O-N 3.44Å; Y35-A82 WeakPolarHBondContact CD1-O 3.47Å; Y35-P86 HydrophobicContact CD1-CG 3.89Å; Y35-P86 HydrophobicContact CD2-CB 4.28Å; Y35-P86 HydrophobicContact CD2-CG 4.32Å; Y35-P86 HydrophobicContact CE1-CG 4.02Å; Y35-P86 HydrophobicContact CE2-CB 4.19Å; Y35-P86 HydrophobicContact CE2-CG 4.44Å; Y35-P86 HydrophobicContact CG-CB 4.49Å; Y35-P86 HydrophobicContact CG-CG 4.03Å; Y35-H292 AromaticContact CE1-ND1 3.69Å; Y35-H292 AromaticContact CZ-ND1 3.69Å; Y35-H292 PolarHBondContact OH-ND1 3.15Å; Y35-M293 HydrophobicContact CD2-CE 4.04Å; Y35-M293 HydrophobicContact CE2-CB 4.29Å; Y35-M293 HydrophobicContact CE2-CE 3.69Å; Y35-M293 HydrophobicContact CE2-CG 4.41Å; Y35-M296 HydrophobicContact CE1-CG 4.29Å
36P95.3Very high94.1Very high58 Ų5850.9 Ų50.938%0.37729%0.289SS..Hα-helixtrans-58-39.8173.4-3039.3000113.3A32 I39 I40A32-P36 WeakPolarHBondContact O-CD 3.32Å; A32-P36 VanDerWaalsContact O-CG 3.27Å; A32-P36 WeakPolarHBondContact O-CG 3.4Å; P36-I39 PolarHBondContact O-N 2.93Å; P36-I40 WeakPolarHBondContact O-CB 3.16Å; P36-I40 WeakPolarHBondContact O-CD1 3.45Å; P36-I40 WeakPolarHBondContact O-CG1 3.48Å; P36-I40 PolarHBondContact O-N 3.33Å
37L96.3Very high94.6Very high74 Ų7449.9 Ų49.939%0.38729%0.285SS..Hα-helixtrans-63.5-45.4175.1-67.8174.4000111.7V33 I34 Y35 I39 I40 F41V33-L37 HydrophobicContact CG1-CD1 4.06Å; V33-L37 VanDerWaalsContact O-CG 3.3Å; V33-L37 WeakPolarHBondContact O-CG 3.23Å; V33-L37 PolarHBondContact O-N 2.92Å; I34-L37 PolarHBondContact O-N 3.49Å; Y35-L37 VanDerWaalsContact C-N 3.29Å; Y35-L37 PolarHBondContact O-N 3.12Å; L37-I39 VanDerWaalsContact C-N 3.33Å; L37-I39 PolarHBondContact O-N 3.43Å; L37-I40 PolarHBondContact O-N 2.89Å; L37-F41 HydrophobicContact CB-CD2 4.24Å; L37-F41 HydrophobicContact CB-CE2 4.26Å; L37-F41 HydrophobicContact CD2-CE2 4.05Å; L37-F41 WeakPolarHBondContact O-CB 3.26Å; L37-F41 WeakPolarHBondContact O-CD2 3.36Å; L37-F41 PolarHBondContact O-N 3.43Å
38I96.5Very high95.1Very high13 Ų1349.4 Ų49.47%0.06728%0.283CS..Hα-helixtrans-56.8-49175-70.5171.3000110.1I34 Y35 I40 S42 M293 M296 V300I34-I38 HydrophobicContact CG2-CD1 3.8Å; I34-I38 HydrophobicContact CG2-CG1 4.18Å; I34-I38 WeakPolarHBondContact O-CG1 3.3Å; I34-I38 PolarHBondContact O-N 2.94Å; Y35-I38 PolarHBondContact O-N 2.75Å; I38-I40 PolarHBondContact O-N 3.11Å; I38-S42 WeakPolarHBondContact O-CB 3.36Å; I38-S42 PolarHBondContact O-N 3.34Å; I38-M293 HydrophobicContact CD1-CG 4Å; I38-M296 HydrophobicContact CD1-CB 4.41Å; I38-M296 HydrophobicContact CG2-CB 4.14Å; I38-V300 HydrophobicContact CB-CG2 4.37Å; I38-V300 HydrophobicContact CG1-CG2 4.48Å; I38-V300 HydrophobicContact CG2-CG2 4.06Å
39I96.8Very high95.6Very high40 Ų4046.7 Ų46.721%0.20527%0.266CS..Hα-helixtrans-60.3-48-179.9-67164.2000110.4Y35 P36 L37 T43 A82 P83Y35-I39 VanDerWaalsContact O-CG1 3.26Å; Y35-I39 WeakPolarHBondContact O-CG1 3.3Å; Y35-I39 PolarHBondContact O-N 3.44Å; P36-I39 PolarHBondContact O-N 2.93Å; L37-I39 VanDerWaalsContact C-N 3.33Å; L37-I39 PolarHBondContact O-N 3.43Å; I39-T43 WeakPolarHBondContact O-CB 3.14Å; I39-T43 PolarHBondContact O-N 2.95Å; I39-T43 PolarHBondContact O-OG1 3.49Å; I39-A82 HydrophobicContact CD1-CB 4.15Å; I39-A82 HydrophobicContact CG1-CB 3.66Å; I39-P83 HydrophobicContact CD1-CB 4.08Å
40I97.2Very high96Very high96 Ų9643.4 Ų43.449%0.49225%0.249SC..Hα-helixtrans-63-54.8-179-69.6164.7000110.7P36 L37 I38 S42 T43 V44P36-I40 WeakPolarHBondContact O-CB 3.16Å; P36-I40 WeakPolarHBondContact O-CD1 3.45Å; P36-I40 WeakPolarHBondContact O-CG1 3.48Å; P36-I40 PolarHBondContact O-N 3.33Å; L37-I40 PolarHBondContact O-N 2.89Å; I38-I40 PolarHBondContact O-N 3.11Å; I40-S42 PolarHBondContact O-N 2.87Å; I40-T43 PolarHBondContact O-N 2.88Å; I40-V44 HydrophobicContact CG2-CG2 4.47Å; I40-V44 WeakPolarHBondContact O-CB 3.37Å; I40-V44 VanDerWaalsContact O-CG2 3.27Å; I40-V44 WeakPolarHBondContact O-CG2 3.43Å; I40-V44 PolarHBondContact O-N 3.18Å
41F97.3Very high96.2Very high105 Ų10544.3 Ų44.346%0.46125%0.254SS..Hα-helixtrans-66.2-41.3-176.1-73.1-62.6000112.2L37 G45 V300 F304L37-F41 HydrophobicContact CB-CD2 4.24Å; L37-F41 HydrophobicContact CB-CE2 4.26Å; L37-F41 HydrophobicContact CD2-CE2 4.05Å; L37-F41 WeakPolarHBondContact O-CB 3.26Å; L37-F41 WeakPolarHBondContact O-CD2 3.36Å; L37-F41 PolarHBondContact O-N 3.43Å; F41-G45 PolarHBondContact O-N 2.96Å; F41-V300 HydrophobicContact CB-CG1 3.76Å; F41-V300 HydrophobicContact CB-CG2 4.29Å; F41-F304 HydrophobicContact CD1-CZ 4.4Å
42S97.3Very high96.4Very high0 Ų043.7 Ų43.70%025%0.25CS..Hα-helixtrans-64-48.3176-179.80000111.1I38 I40 N46 S78 A299I38-S42 WeakPolarHBondContact O-CB 3.36Å; I38-S42 PolarHBondContact O-N 3.34Å; I40-S42 PolarHBondContact O-N 2.87Å; S42-N46 VanDerWaalsContact O-CB 3.23Å; S42-N46 WeakPolarHBondContact O-CB 3.39Å; S42-N46 PolarHBondContact O-N 3.48Å; S42-N46 PolarHBondContact O-ND2 3.44Å; S42-N46 PolarHBondContact OG-ND2 3.43Å; S42-S78 VanDerWaalsContact CB-OG 3.32Å; S42-S78 WeakPolarHBondContact CB-OG 3.37Å; S42-S78 PolarHBondContact OG-OG 3.29Å; S42-A299 VanDerWaalsContact OG-CB 3.32Å; S42-A299 WeakPolarHBondContact OG-CB 3.49Å
43T97.6Very high96.6Very high28 Ų2840.8 Ų40.817%0.17223%0.226CC..Hα-helixtrans-62.8-50.1-178.2-59.20000111.4I39 I40 S47 L75 F79I39-T43 WeakPolarHBondContact O-CB 3.14Å; I39-T43 PolarHBondContact O-N 2.95Å; I39-T43 PolarHBondContact O-OG1 3.49Å; I40-T43 PolarHBondContact O-N 2.88Å; T43-S47 WeakPolarHBondContact O-CB 3.28Å; T43-S47 PolarHBondContact O-N 3.04Å; T43-S47 PolarHBondContact O-OG 2.69Å; T43-L75 HydrophobicContact CG2-CD2 4.18Å; T43-F79 HydrophobicContact CG2-CE1 3.83Å; T43-F79 HydrophobicContact CG2-CE2 4.49Å; T43-F79 HydrophobicContact CG2-CZ 3.52Å
44V97.1Very high96.6Very high81 Ų8140.2 Ų40.249%0.49122%0.222SC..Hα-helixtrans-63.2-50.4-179.8172.60000110.4I40 S47 I48I40-V44 HydrophobicContact CG2-CG2 4.47Å; I40-V44 WeakPolarHBondContact O-CB 3.37Å; I40-V44 VanDerWaalsContact O-CG2 3.27Å; I40-V44 WeakPolarHBondContact O-CG2 3.43Å; I40-V44 PolarHBondContact O-N 3.18Å; V44-S47 PolarHBondContact O-N 3.5Å; V44-I48 HydrophobicContact CG1-CD1 3.78Å; V44-I48 WeakPolarHBondContact O-CD1 3.36Å; V44-I48 VanDerWaalsContact O-CG1 3.24Å; V44-I48 WeakPolarHBondContact O-CG1 3.44Å; V44-I48 PolarHBondContact O-N 3.41Å
45G97.1Very high96.5Very high11 Ų1144.8 Ų44.811%0.11324%0.236CC..Hα-helixtrans-63.5-48.6-176.300000112.9F41 S47 I48 V49F41-G45 PolarHBondContact O-N 2.96Å; G45-S47 VanDerWaalsContact C-N 3.34Å; G45-S47 PolarHBondContact O-N 2.99Å; G45-I48 PolarHBondContact O-N 2.93Å; G45-V49 WeakPolarHBondContact O-CG2 3.32Å; G45-V49 PolarHBondContact O-N 2.98Å
46N97.8Very high96.4Very high0 Ų045.4 Ų45.40%024%0.241CC..Hα-helixtrans-69.7-32.1-179.4-71.6-59.6000112.1S42 V49 I50 A71 L75 A299S42-N46 VanDerWaalsContact O-CB 3.23Å; S42-N46 WeakPolarHBondContact O-CB 3.39Å; S42-N46 PolarHBondContact O-N 3.48Å; S42-N46 PolarHBondContact O-ND2 3.44Å; S42-N46 PolarHBondContact OG-ND2 3.43Å; N46-V49 PolarHBondContact O-N 3.36Å; N46-I50 WeakPolarHBondContact O-CG1 3.33Å; N46-I50 PolarHBondContact O-N 2.91Å; N46-I50 VanDerWaalsContact O-N 3.08Å; N46-A71 HydrophobicContact CB-CB 3.96Å; N46-L75 HydrophobicContact CB-CD2 3.86Å; N46-L75 HydrophobicContact CB-CG 3.88Å; N46-A299 PolarHBondContact ND2-O 2.87Å
47S97.5Very high96.3Very high51 Ų5147.8 Ų47.836%0.35725%0.254SS..Hα-helixtrans-63.1-42170.8-61.90000112T43 V44 G45 V49 I50 L51T43-S47 WeakPolarHBondContact O-CB 3.28Å; T43-S47 PolarHBondContact O-N 3.04Å; T43-S47 PolarHBondContact O-OG 2.69Å; V44-S47 PolarHBondContact O-N 3.5Å; G45-S47 VanDerWaalsContact C-N 3.34Å; G45-S47 PolarHBondContact O-N 2.99Å; S47-V49 VanDerWaalsContact C-N 3.34Å; S47-V49 PolarHBondContact O-N 3.05Å; S47-I50 PolarHBondContact O-N 2.86Å; S47-L51 WeakPolarHBondContact O-CB 3.42Å; S47-L51 PolarHBondContact O-N 3.23Å
48I96.6Very high96.1Very high26 Ų2648 Ų4813%0.13327%0.267CS..Hα-helixtrans-63.7-41.1176.3-66.7162.7000110.6V44 G45 I50 L51 T52 F317 I320 F321V44-I48 HydrophobicContact CG1-CD1 3.78Å; V44-I48 WeakPolarHBondContact O-CD1 3.36Å; V44-I48 VanDerWaalsContact O-CG1 3.24Å; V44-I48 WeakPolarHBondContact O-CG1 3.44Å; V44-I48 PolarHBondContact O-N 3.41Å; G45-I48 PolarHBondContact O-N 2.93Å; I48-I50 PolarHBondContact O-N 3.44Å; I48-L51 PolarHBondContact O-N 3.46Å; I48-T52 WeakPolarHBondContact O-CB 3.34Å; I48-T52 PolarHBondContact O-N 3.31Å; I48-T52 PolarHBondContact O-OG1 3.16Å; I48-T52 VanDerWaalsContact O-OG1 3.1Å; I48-F317 HydrophobicContact CG2-CD1 3.46Å; I48-F317 VanDerWaalsContact CG2-CD1 3.46Å; I48-F317 HydrophobicContact CG2-CE1 3.52Å; I48-F317 HydrophobicContact CG2-CG 4.03Å; I48-F317 HydrophobicContact CG2-CZ 4.13Å; I48-I320 HydrophobicContact CG2-CD1 4.32Å; I48-F321 HydrophobicContact CD1-CE1 4.38Å; I48-F321 HydrophobicContact CD1-CE2 4.32Å; I48-F321 HydrophobicContact CD1-CZ 3.61Å
49V97.5Very high96Very high0 Ų047.6 Ų47.60%027%0.265CS..Hα-helixtrans-57.5-50.4176171.20000111G45 N46 S47 L51 T52 V53 I67 A71 P303 Y306 F313 F317G45-V49 WeakPolarHBondContact O-CG2 3.32Å; G45-V49 PolarHBondContact O-N 2.98Å; N46-V49 PolarHBondContact O-N 3.36Å; S47-V49 VanDerWaalsContact C-N 3.34Å; S47-V49 PolarHBondContact O-N 3.05Å; V49-L51 VanDerWaalsContact C-N 3.34Å; V49-L51 PolarHBondContact O-N 3.25Å; V49-T52 PolarHBondContact O-N 3.26Å; V49-V53 WeakPolarHBondContact O-CG2 3.14Å; V49-V53 PolarHBondContact O-N 3.02Å; V49-I67 HydrophobicContact CG1-CG2 3.67Å; V49-A71 HydrophobicContact CB-CB 4.11Å; V49-A71 HydrophobicContact CG1-CB 3.86Å; V49-P303 HydrophobicContact CG2-CB 4.37Å; V49-P303 HydrophobicContact CG2-CG 4.21Å; V49-Y306 HydrophobicContact CG1-CD2 4.46Å; V49-Y306 HydrophobicContact CG1-CE2 4.26Å; V49-Y306 HydrophobicContact CG2-CD2 3.61Å; V49-Y306 HydrophobicContact CG2-CE2 3.95Å; V49-F313 HydrophobicContact CG1-CE1 4.19Å; V49-F317 HydrophobicContact CG2-CZ 3.94Å
50I97.7Very high95.9Very high41 Ų4151 Ų5121%0.2128%0.275CS..Hα-helixtrans-61.9-44.3177.8-64.2171.7000110.3N46 S47 I48 T52 V53 T54 A71 A72 L75N46-I50 WeakPolarHBondContact O-CG1 3.33Å; N46-I50 PolarHBondContact O-N 2.91Å; N46-I50 VanDerWaalsContact O-N 3.08Å; S47-I50 PolarHBondContact O-N 2.86Å; I48-I50 PolarHBondContact O-N 3.44Å; I50-T52 VanDerWaalsContact C-N 3.35Å; I50-T52 PolarHBondContact O-N 3.12Å; I50-V53 PolarHBondContact O-N 2.91Å; I50-T54 HydrophobicContact CG2-CG2 4.08Å; I50-T54 WeakPolarHBondContact O-CB 3.46Å; I50-T54 VanDerWaalsContact O-CG2 3.27Å; I50-T54 WeakPolarHBondContact O-CG2 3.37Å; I50-T54 PolarHBondContact O-N 3.45Å; I50-T54 PolarHBondContact O-OG1 3.05Å; I50-A71 HydrophobicContact CD1-CB 4.19Å; I50-A71 HydrophobicContact CG1-CB 3.8Å; I50-A72 HydrophobicContact CD1-CB 4.26Å; I50-L75 HydrophobicContact CD1-CD1 3.55Å
51L96.5Very high95.7Very high76 Ų7649.5 Ų49.540%0.39827%0.271SS..Hα-helixtrans-60.9-42.5178.4-178.461.3000112S47 I48 V49 V53 T54 R55 I320S47-L51 WeakPolarHBondContact O-CB 3.42Å; S47-L51 PolarHBondContact O-N 3.23Å; I48-L51 PolarHBondContact O-N 3.46Å; V49-L51 VanDerWaalsContact C-N 3.34Å; V49-L51 PolarHBondContact O-N 3.25Å; L51-V53 PolarHBondContact O-N 3.39Å; L51-T54 WeakPolarHBondContact CA-OG1 3.44Å; L51-T54 PolarHBondContact O-N 2.94Å; L51-T54 PolarHBondContact O-OG1 3.27Å; L51-R55 HydrophobicContact CD1-CB 4.45Å; L51-R55 WeakPolarHBondContact O-CB 3.42Å; L51-R55 PolarHBondContact O-N 3.34Å; L51-I320 HydrophobicContact CD2-CD1 4.15Å; L51-I320 HydrophobicContact CD2-CG2 4.1Å; L51-I320 HydrophobicContact CG-CD1 4.2Å
52T95.9Very high95.6Very high0 Ų045.6 Ų45.60%025%0.254CS..Hα-helixtrans-59.6-46.3177.1-70.70000112I48 V49 I50 S56 M59 F313 E316 F317 I320I48-T52 WeakPolarHBondContact O-CB 3.34Å; I48-T52 PolarHBondContact O-N 3.31Å; I48-T52 PolarHBondContact O-OG1 3.16Å; I48-T52 VanDerWaalsContact O-OG1 3.1Å; V49-T52 PolarHBondContact O-N 3.26Å; I50-T52 VanDerWaalsContact C-N 3.35Å; I50-T52 PolarHBondContact O-N 3.12Å; T52-S56 PolarHBondContact O-N 3.39Å; T52-M59 HydrophobicContact CG2-CE 3.68Å; T52-M59 HydrophobicContact CG2-CG 4.08Å; T52-F313 HydrophobicContact CG2-CD1 3.72Å; T52-F313 HydrophobicContact CG2-CE1 3.86Å; T52-E316 HydrophobicContact CG2-CB 3.46Å; T52-E316 VanDerWaalsContact CG2-CB 3.46Å; T52-E316 HydrophobicContact CG2-CG 3.92Å; T52-F317 HydrophobicContact CG2-CE1 4.39Å; T52-F317 VanDerWaalsContact OG1-CD1 3.27Å; T52-F317 WeakPolarHBondContact OG1-CD1 3.31Å; T52-F317 VanDerWaalsContact OG1-CE1 3.28Å; T52-F317 WeakPolarHBondContact OG1-CE1 3.39Å; T52-I320 VanDerWaalsContact OG1-CD1 3.31Å; T52-I320 WeakPolarHBondContact OG1-CD1 3.32Å
53V96.2Very high95.4Very high3 Ų345.9 Ų45.92%0.01826%0.256CS..Hα-helixtrans-71.8-38.9-179.1179.50000111.5V49 I50 L51 R60 N64 L65 F313V49-V53 WeakPolarHBondContact O-CG2 3.14Å; V49-V53 PolarHBondContact O-N 3.02Å; I50-V53 PolarHBondContact O-N 2.91Å; L51-V53 PolarHBondContact O-N 3.39Å; V53-R60 WeakPolarHBondContact O-CG 3.24Å; V53-N64 HydrophobicContact CG1-CB 4.37Å; V53-N64 HydrophobicContact CG2-CB 4.07Å; V53-L65 HydrophobicContact CG1-CD2 4.15Å; V53-F313 HydrophobicContact CG2-CE1 4.04Å; V53-F313 HydrophobicContact CG2-CZ 3.95Å
54T94.8Very high95.3Very high73 Ų7345.2 Ų45.245%0.44825%0.252SS..Hα-helixtrans-74.4-37.9-178.653.60000112.5I50 L51 R60I50-T54 HydrophobicContact CG2-CG2 4.08Å; I50-T54 WeakPolarHBondContact O-CB 3.46Å; I50-T54 VanDerWaalsContact O-CG2 3.27Å; I50-T54 WeakPolarHBondContact O-CG2 3.37Å; I50-T54 PolarHBondContact O-N 3.45Å; I50-T54 PolarHBondContact O-OG1 3.05Å; L51-T54 WeakPolarHBondContact CA-OG1 3.44Å; L51-T54 PolarHBondContact O-N 2.94Å; L51-T54 PolarHBondContact O-OG1 3.27Å; T54-R60 PolarHBondContact O-NE 2.91Å; T54-R60 PolarHBondContact O-NH2 3.26Å
55R93.7Very high95.3Very high160 Ų16043.6 Ų43.660%0.60424%0.24SC*.Hα-helixtrans-77-43.8-177.9-175.4-177.1169.8111.4-1.4113.3L51L51-R55 HydrophobicContact CD1-CB 4.45Å; L51-R55 WeakPolarHBondContact O-CB 3.42Å; L51-R55 PolarHBondContact O-N 3.34Å
56S91.9Very high95.3Very high17 Ų1743.1 Ų43.112%0.11923%0.234CC..  trans-95.1114.5-173.5-177.50000110.8T52 A58 M59 E316T52-S56 PolarHBondContact O-N 3.39Å; S56-A58 PolarHBondContact O-N 3.47Å; S56-M59 WeakPolarHBondContact O-CB 3.45Å; S56-M59 PolarHBondContact O-N 3.28Å; S56-E316 WeakPolarHBondContact CB-OE1 3.49Å; S56-E316 PolarHBondContact OG-OE1 3.37Å
57T92.3Very high95.3Very high109 Ų10943.1 Ų43.167%0.66924%0.235SC*.G310 helixtrans-60-34.5177.149.60000111.9M59 R60T57-M59 PolarHBondContact O-N 2.87Å; T57-R60 PolarHBondContact O-N 3.48Å; T57-R60 VanDerWaalsContact O-N 3.17Å
58A92.9Very high95.3Very high79 Ų7941.7 Ų41.765%0.65322%0.224SC*.G310 helixtrans-61.7-23.8174.500000113S56S56-A58 PolarHBondContact O-N 3.47Å
59M93.9Very high95.3Very high4 Ų441 Ų412%0.0222%0.221CC..G310 helixtrans-90.2-7.7179.7-64.9-63.1-79.100113.7T52 S56 T57 T61 N64 N312 F313 E316T52-M59 HydrophobicContact CG2-CE 3.68Å; T52-M59 HydrophobicContact CG2-CG 4.08Å; S56-M59 WeakPolarHBondContact O-CB 3.45Å; S56-M59 PolarHBondContact O-N 3.28Å; T57-M59 PolarHBondContact O-N 2.87Å; M59-T61 PolarHBondContact O-N 3.42Å; M59-N64 WeakPolarHBondContact O-CB 3.45Å; M59-N64 PolarHBondContact O-ND2 3.24Å; M59-N312 HydrophobicContact CE-CB 4.19Å; M59-N312 HydrophobicContact SD-CB 3.87Å; M59-F313 HydrophobicContact CE-CB 4.38Å; M59-F313 HydrophobicContact CE-CD1 3.82Å; M59-F313 HydrophobicContact CE-CD2 3.56Å; M59-F313 HydrophobicContact CE-CE1 3.93Å; M59-F313 HydrophobicContact CE-CE2 3.69Å; M59-F313 HydrophobicContact CE-CG 3.65Å; M59-F313 HydrophobicContact CE-CZ 3.88Å; M59-E316 HydrophobicContact CE-CG 4.4Å; M59-E316 HydrophobicContact CG-CG 3.86Å; M59-E316 HydrophobicContact SD-CG 4.14Å
60R94.8Very high95.3Very high110 Ų11041.2 Ų41.242%0.41522%0.222SC..  trans-79.645.6-177.1-62.2178.3-172.1170.20.8113.7V53 T54 T57 Q140V53-R60 WeakPolarHBondContact O-CG 3.24Å; T54-R60 PolarHBondContact O-NE 2.91Å; T54-R60 PolarHBondContact O-NH2 3.26Å; T57-R60 PolarHBondContact O-N 3.48Å; T57-R60 VanDerWaalsContact O-N 3.17Å; R60-Q140 PolarHBondContact O-NE2 2.88Å
61T93.7Very high95.3Very high66 Ų6639.3 Ų39.341%0.40521%0.212SC..  trans-80.8156.2173.9710000111M59 T63 N64 L65M59-T61 PolarHBondContact O-N 3.42Å; T61-T63 VanDerWaalsContact C-N 3.34Å; T61-T63 PolarHBondContact O-N 2.92Å; T61-N64 CarbonylContact O-C 3.56Å; T61-N64 PolarHBondContact O-N 3.38Å; T61-N64 WeakPolarHBondContact OG1-CB 3.44Å; T61-N64 PolarHBondContact OG1-N 3.11Å; T61-N64 PolarHBondContact OG1-ND2 2.95Å; T61-L65 WeakPolarHBondContact O-CG 3.42Å; T61-L65 PolarHBondContact O-N 3.34Å
62I95.2Very high95.4Very high22 Ų2237.4 Ų37.411%0.11321%0.208CC..Hα-helixtrans-52.1-48.8-179.4-57.8-61.2000112.2N64 L65 F66 M138 Q140 C143I62-N64 VanDerWaalsContact C-N 3.3Å; I62-N64 PolarHBondContact O-N 2.88Å; I62-L65 WeakPolarHBondContact O-CB 3.11Å; I62-L65 PolarHBondContact O-N 3.48Å; I62-F66 HydrophobicContact CG2-CD2 4.09Å; I62-F66 HydrophobicContact CG2-CE2 3.69Å; I62-F66 WeakPolarHBondContact O-CD2 3.45Å; I62-F66 PolarHBondContact O-N 2.98Å; I62-F66 VanDerWaalsContact O-N 3.11Å; I62-M138 WeakPolarHBondContact CD1-O 3.48Å; I62-M138 WeakPolarHBondContact CG1-O 3.19Å; I62-M138 HydrophobicContact CG2-CB 4.5Å; I62-M138 HydrophobicContact CG2-SD 3.86Å; I62-Q140 HydrophobicContact CD1-CB 4.44Å; I62-Q140 HydrophobicContact CD1-CG 3.91Å; I62-C143 HydrophobicContact CD1-CB 3.85Å; I62-C143 HydrophobicContact CG2-CB 4.18Å
63T93.7Very high95.4Very high6 Ų637.4 Ų37.44%0.03721%0.208CC..Hα-helixtrans-61.2-39.5177.3-490000112.5T61 L65 F66 I67 I122 D125 R126T61-T63 VanDerWaalsContact C-N 3.34Å; T61-T63 PolarHBondContact O-N 2.92Å; T63-L65 VanDerWaalsContact C-N 3.34Å; T63-F66 PolarHBondContact O-N 2.89Å; T63-I67 HydrophobicContact CG2-CD1 4.17Å; T63-I67 WeakPolarHBondContact O-CG1 3.42Å; T63-I67 PolarHBondContact O-N 3.28Å; T63-I122 HydrophobicContact CG2-CG2 4.02Å; T63-D125 PolarHBondContact OG1-OD2 3.05Å; T63-R126 PolarHBondContact OG1-NE 3.25Å; T63-R126 PolarHBondContact OG1-NH2 3.1Å
64N95Very high95.4Very high15 Ų1537.3 Ų37.38%0.0821%0.207CC..Hα-helixtrans-72-29.9179.6-70.2-6.1000112V53 M59 T61 I62 I67 S68 F313V53-N64 HydrophobicContact CG1-CB 4.37Å; V53-N64 HydrophobicContact CG2-CB 4.07Å; M59-N64 WeakPolarHBondContact O-CB 3.45Å; M59-N64 PolarHBondContact O-ND2 3.24Å; T61-N64 CarbonylContact O-C 3.56Å; T61-N64 PolarHBondContact O-N 3.38Å; T61-N64 WeakPolarHBondContact OG1-CB 3.44Å; T61-N64 PolarHBondContact OG1-N 3.11Å; T61-N64 PolarHBondContact OG1-ND2 2.95Å; I62-N64 VanDerWaalsContact C-N 3.3Å; I62-N64 PolarHBondContact O-N 2.88Å; N64-I67 PolarHBondContact O-N 3.03Å; N64-S68 WeakPolarHBondContact O-CB 3.2Å; N64-S68 PolarHBondContact O-N 3.11Å; N64-F313 WeakPolarHBondContact OD1-CE2 3.28Å
65L97.2Very high95.6Very high46 Ų4634.9 Ų34.924%0.24119%0.192CC..Hα-helixtrans-64-43.2170.4-65.9175.6000110.8V53 T61 I62 T63 S68 N69 Q140V53-L65 HydrophobicContact CG1-CD2 4.15Å; T61-L65 WeakPolarHBondContact O-CG 3.42Å; T61-L65 PolarHBondContact O-N 3.34Å; I62-L65 WeakPolarHBondContact O-CB 3.11Å; I62-L65 PolarHBondContact O-N 3.48Å; T63-L65 VanDerWaalsContact C-N 3.34Å; L65-S68 WeakPolarHBondContact O-CB 3.25Å; L65-S68 PolarHBondContact O-N 3.43Å; L65-N69 PolarHBondContact O-N 3.25Å; L65-Q140 HydrophobicContact CD1-CG 4.12Å
66F97.5Very high95.6Very high1 Ų129.9 Ų29.90%0.00418%0.176CC..Hα-helixtrans-64.8-40172.2-70.9-54.1000112.9I62 T63 S68 N69 L70 T118 A121 I122 M138 I146 I147I62-F66 HydrophobicContact CG2-CD2 4.09Å; I62-F66 HydrophobicContact CG2-CE2 3.69Å; I62-F66 WeakPolarHBondContact O-CD2 3.45Å; I62-F66 PolarHBondContact O-N 2.98Å; I62-F66 VanDerWaalsContact O-N 3.11Å; T63-F66 PolarHBondContact O-N 2.89Å; F66-S68 VanDerWaalsContact C-N 3.3Å; F66-S68 PolarHBondContact O-N 3.42Å; F66-N69 WeakPolarHBondContact O-CB 3.27Å; F66-N69 PolarHBondContact O-N 3.21Å; F66-N69 VanDerWaalsContact O-N 3.13Å; F66-L70 PolarHBondContact O-N 2.98Å; F66-T118 HydrophobicContact CB-CG2 3.86Å; F66-T118 HydrophobicContact CD1-CG2 4.2Å; F66-T118 HydrophobicContact CG-CG2 4.44Å; F66-T118 WeakPolarHBondContact O-CG2 3.4Å; F66-A121 HydrophobicContact CD1-CB 4.32Å; F66-A121 HydrophobicContact CE1-CB 3.89Å; F66-A121 HydrophobicContact CE2-CB 4.25Å; F66-A121 HydrophobicContact CZ-CB 3.86Å; F66-I122 HydrophobicContact CB-CD1 3.8Å; F66-I122 HydrophobicContact CB-CG1 3.39Å; F66-I122 HydrophobicContact CD2-CG1 4.12Å; F66-I122 HydrophobicContact CG-CG1 4Å; F66-M138 HydrophobicContact CE2-SD 4.31Å; F66-M138 HydrophobicContact CZ-SD 4.24Å; F66-I146 HydrophobicContact CE1-CB 4.36Å; F66-I146 HydrophobicContact CE1-CG2 3.85Å; F66-I146 HydrophobicContact CZ-CB 4.37Å; F66-I146 HydrophobicContact CZ-CD1 4.48Å; F66-I146 HydrophobicContact CZ-CG2 4Å; F66-I147 HydrophobicContact CD1-CD1 4.23Å; F66-I147 HydrophobicContact CD1-CG1 3.89Å; F66-I147 HydrophobicContact CE1-CD1 4.41Å; F66-I147 HydrophobicContact CE1-CG1 3.83Å
67I96.3Very high95.7Very high1 Ų129.1 Ų29.11%0.00517%0.171CC..Hα-helixtrans-60-41.6172.8-74.1167.4000110.8V49 T63 N64 N69 L70 A71 I122 M249 Y306 F313V49-I67 HydrophobicContact CG1-CG2 3.67Å; T63-I67 HydrophobicContact CG2-CD1 4.17Å; T63-I67 WeakPolarHBondContact O-CG1 3.42Å; T63-I67 PolarHBondContact O-N 3.28Å; N64-I67 PolarHBondContact O-N 3.03Å; I67-N69 VanDerWaalsContact C-N 3.31Å; I67-N69 PolarHBondContact O-N 2.98Å; I67-L70 WeakPolarHBondContact O-CB 3.39Å; I67-L70 PolarHBondContact O-N 2.75Å; I67-A71 PolarHBondContact O-N 3.14Å; I67-I122 HydrophobicContact CG1-CD1 4.46Å; I67-M249 HydrophobicContact CD1-CE 4.42Å; I67-Y306 HydrophobicContact CD1-CE1 3.96Å; I67-Y306 HydrophobicContact CG1-CE1 4.13Å; I67-Y306 HydrophobicContact CG2-CD2 4.39Å; I67-Y306 HydrophobicContact CG2-CE1 3.93Å; I67-Y306 HydrophobicContact CG2-CE2 3.7Å; I67-Y306 VanDerWaalsContact CG2-CZ 3.45Å; I67-Y306 WeakPolarHBondContact CG2-OH 3.43Å; I67-F313 HydrophobicContact CD1-CE2 4.26Å; I67-F313 HydrophobicContact CG2-CZ 3.98Å
68S97.4Very high95.8Very high20 Ų2024.1 Ų24.114%0.1414%0.14CC..Hα-helixtrans-65-35.3174.8-169.50000112.1N64 L65 F66 A71 A72N64-S68 WeakPolarHBondContact O-CB 3.2Å; N64-S68 PolarHBondContact O-N 3.11Å; L65-S68 WeakPolarHBondContact O-CB 3.25Å; L65-S68 PolarHBondContact O-N 3.43Å; F66-S68 VanDerWaalsContact C-N 3.3Å; F66-S68 PolarHBondContact O-N 3.42Å; S68-A71 PolarHBondContact O-N 2.96Å; S68-A72 PolarHBondContact O-N 2.96Å
69N98.1Very high95.8Very high11 Ų1126.2 Ų26.26%0.05914%0.135CC..Hα-helixtrans-65.3-41.1173.9-172.161000111.8L65 F66 I67 A72 S73 T118 I147 W151L65-N69 PolarHBondContact O-N 3.25Å; F66-N69 WeakPolarHBondContact O-CB 3.27Å; F66-N69 PolarHBondContact O-N 3.21Å; F66-N69 VanDerWaalsContact O-N 3.13Å; I67-N69 VanDerWaalsContact C-N 3.31Å; I67-N69 PolarHBondContact O-N 2.98Å; N69-A72 PolarHBondContact O-N 2.93Å; N69-S73 PolarHBondContact O-N 3.25Å; N69-S73 VanDerWaalsContact O-N 3.08Å; N69-T118 HydrophobicContact CB-CG2 4.37Å; N69-T118 PolarHBondContact ND2-OG1 3.49Å; N69-I147 HydrophobicContact CB-CD1 4.19Å; N69-I147 HydrophobicContact CB-CG1 4.3Å; N69-I147 HydrophobicContact CB-CG2 4.49Å; N69-I147 VanDerWaalsContact OD1-CG2 3.3Å; N69-I147 WeakPolarHBondContact OD1-CG2 3.3Å; N69-W151 PolarHBondContact OD1-NE1 3.31Å
70L96.8Very high95.7Very high5 Ų527.2 Ų27.23%0.02614%0.141CC..Hα-helixtrans-60.6-46.5174.4-173.465.9000111F66 I67 A72 S73 D74 S115 T118 M253F66-L70 PolarHBondContact O-N 2.98Å; I67-L70 WeakPolarHBondContact O-CB 3.39Å; I67-L70 PolarHBondContact O-N 2.75Å; L70-A72 VanDerWaalsContact C-N 3.29Å; L70-A72 PolarHBondContact O-N 3.24Å; L70-S73 WeakPolarHBondContact O-CB 3.01Å; L70-S73 PolarHBondContact O-N 2.8Å; L70-S73 VanDerWaalsContact O-N 3.13Å; L70-D74 PolarHBondContact O-N 3.41Å; L70-S115 VanDerWaalsContact CD1-CA 3.5Å; L70-T118 HydrophobicContact CB-CG2 4.36Å; L70-M253 HydrophobicContact CD2-CE 3.43Å; L70-M253 VanDerWaalsContact CD2-CE 3.43Å
71A97.8Very high95.5Very high1 Ų122 Ų221%0.00812%0.122CC..Hα-helixtrans-59.6-37.6175.500000112.6N46 V49 I50 I67 S68 D74 L75N46-A71 HydrophobicContact CB-CB 3.96Å; V49-A71 HydrophobicContact CB-CB 4.11Å; V49-A71 HydrophobicContact CG1-CB 3.86Å; I50-A71 HydrophobicContact CD1-CB 4.19Å; I50-A71 HydrophobicContact CG1-CB 3.8Å; I67-A71 PolarHBondContact O-N 3.14Å; S68-A71 PolarHBondContact O-N 2.96Å; A71-D74 PolarHBondContact O-N 3.33Å; A71-L75 WeakPolarHBondContact O-CG 3.34Å; A71-L75 PolarHBondContact O-N 3.48Å
72A97.6Very high95.4Very high37 Ų3718.9 Ų18.931%0.30610%0.103SC..Hα-helixtrans-65.8-39.1175.800000112.5I50 S68 N69 L70 L75 L76I50-A72 HydrophobicContact CD1-CB 4.26Å; S68-A72 PolarHBondContact O-N 2.96Å; N69-A72 PolarHBondContact O-N 2.93Å; L70-A72 VanDerWaalsContact C-N 3.29Å; L70-A72 PolarHBondContact O-N 3.24Å; A72-L75 PolarHBondContact O-N 3.21Å; A72-L76 PolarHBondContact O-N 3.35Å; A72-L76 VanDerWaalsContact O-N 3.1Å
73S97.2Very high95.2Very high0 Ų019.7 Ų19.70%011%0.109CC..Hα-helixtrans-63.6-44.2173-1760000112.1N69 L70 L75 L76 M77 S111 S115N69-S73 PolarHBondContact O-N 3.25Å; N69-S73 VanDerWaalsContact O-N 3.08Å; L70-S73 WeakPolarHBondContact O-CB 3.01Å; L70-S73 PolarHBondContact O-N 2.8Å; L70-S73 VanDerWaalsContact O-N 3.13Å; S73-L75 VanDerWaalsContact C-N 3.34Å; S73-L75 PolarHBondContact O-N 3.07Å; S73-L76 WeakPolarHBondContact O-CB 3.48Å; S73-L76 PolarHBondContact O-N 3.21Å; S73-M77 PolarHBondContact O-N 3.31Å; S73-M77 VanDerWaalsContact O-N 3.1Å; S73-S111 VanDerWaalsContact OG-CA 3.3Å; S73-S111 WeakPolarHBondContact OG-CA 3.46Å; S73-S111 PolarHBondContact OG-O 3.37Å; S73-S115 PolarHBondContact OG-OG 2.89Å
74D96.6Very high95.1Very high1 Ų120.5 Ų20.51%0.00511%0.114CC..Hα-helixtrans-64-37177.2-75.8-22.3000112.3L70 A71 M77 S78 A299 N302L70-D74 PolarHBondContact O-N 3.41Å; A71-D74 PolarHBondContact O-N 3.33Å; D74-M77 PolarHBondContact O-N 2.82Å; D74-M77 WeakPolarHBondContact OD1-CE 3.17Å; D74-S78 WeakPolarHBondContact O-CB 3.27Å; D74-S78 PolarHBondContact O-N 3.04Å; D74-S78 PolarHBondContact O-OG 3.25Å; D74-A299 HydrophobicContact CB-CB 3.87Å; D74-N302 PolarHBondContact OD2-ND2 3.44Å
75L97.2Very high94.9Very high22 Ų2220 Ų2012%0.11511%0.111CC..Hα-helixtrans-63.3-42.8172.2-73.7-179000111.9T43 N46 I50 A71 A72 S73 M77 S78 F79T43-L75 HydrophobicContact CG2-CD2 4.18Å; N46-L75 HydrophobicContact CB-CD2 3.86Å; N46-L75 HydrophobicContact CB-CG 3.88Å; I50-L75 HydrophobicContact CD1-CD1 3.55Å; A71-L75 WeakPolarHBondContact O-CG 3.34Å; A71-L75 PolarHBondContact O-N 3.48Å; A72-L75 PolarHBondContact O-N 3.21Å; S73-L75 VanDerWaalsContact C-N 3.34Å; S73-L75 PolarHBondContact O-N 3.07Å; L75-M77 VanDerWaalsContact C-N 3.31Å; L75-M77 PolarHBondContact O-N 2.79Å; L75-S78 PolarHBondContact O-N 3.23Å; L75-S78 VanDerWaalsContact O-N 3.11Å; L75-F79 HydrophobicContact CB-CD2 4.34Å; L75-F79 HydrophobicContact CB-CE2 4.14Å; L75-F79 HydrophobicContact CD2-CE2 4.19Å; L75-F79 WeakPolarHBondContact O-CD2 3.35Å; L75-F79 PolarHBondContact O-N 2.95Å
76L95.3Very high94.5Very high54 Ų5418.2 Ų18.228%0.28310%0.103SC..Hα-helixtrans-58.2-43.9175.9177.462.9000111.3A72 S73 V80 T107 W151A72-L76 PolarHBondContact O-N 3.35Å; A72-L76 VanDerWaalsContact O-N 3.1Å; S73-L76 WeakPolarHBondContact O-CB 3.48Å; S73-L76 PolarHBondContact O-N 3.21Å; L76-V80 HydrophobicContact CD1-CG2 4.09Å; L76-V80 PolarHBondContact O-N 2.97Å; L76-T107 HydrophobicContact CD1-CG2 3.91Å; L76-T107 HydrophobicContact CD2-CG2 4.04Å; L76-T107 HydrophobicContact CG-CG2 3.65Å; L76-W151 HydrophobicContact CD2-CH2 4.01Å; L76-W151 HydrophobicContact CD2-CZ3 3.89Å
77M92.4Very high94.1Very high2 Ų222.6 Ų22.61%0.0113%0.125CC..Hα-helixtrans-63.4-41.6173.6-66-159.4-67.600112.6S73 D74 L75 F79 V80 A81 A82 S111 W261 M296S73-M77 PolarHBondContact O-N 3.31Å; S73-M77 VanDerWaalsContact O-N 3.1Å; D74-M77 PolarHBondContact O-N 2.82Å; D74-M77 WeakPolarHBondContact OD1-CE 3.17Å; L75-M77 VanDerWaalsContact C-N 3.31Å; L75-M77 PolarHBondContact O-N 2.79Å; M77-F79 VanDerWaalsContact C-N 3.31Å; M77-F79 PolarHBondContact O-N 3.25Å; M77-V80 PolarHBondContact O-N 2.94Å; M77-A81 PolarHBondContact O-N 3.08Å; M77-A82 PolarHBondContact O-N 3.37Å; M77-S111 VanDerWaalsContact CG-OG 3.25Å; M77-S111 WeakPolarHBondContact CG-OG 3.46Å; M77-S111 WeakPolarHBondContact SD-CB 3.46Å; M77-W261 HydrophobicContact CE-CZ2 4.02Å; M77-W261 HydrophobicContact SD-CH2 4Å; M77-W261 HydrophobicContact SD-CZ2 3.65Å; M77-M296 HydrophobicContact SD-CE 4.42Å
78S94.8Very high93.6Very high3 Ų323.9 Ų23.92%0.02113%0.133CC..Hα-helixtrans-66.2-33.3-176.7-56.40000112.6S42 D74 L75 P83S42-S78 VanDerWaalsContact CB-OG 3.32Å; S42-S78 WeakPolarHBondContact CB-OG 3.37Å; S42-S78 PolarHBondContact OG-OG 3.29Å; D74-S78 WeakPolarHBondContact O-CB 3.27Å; D74-S78 PolarHBondContact O-N 3.04Å; D74-S78 PolarHBondContact O-OG 3.25Å; L75-S78 PolarHBondContact O-N 3.23Å; L75-S78 VanDerWaalsContact O-N 3.11Å; S78-P83 WeakPolarHBondContact O-CD 3.3Å
79F93.7Very high92.8Very high123 Ų12325.7 Ų25.754%0.53914%0.139SC..Hα-helixtrans-87.2-24.7179.6-68.7-53.8000114.2T43 L75 M77 P83T43-F79 HydrophobicContact CG2-CE1 3.83Å; T43-F79 HydrophobicContact CG2-CE2 4.49Å; T43-F79 HydrophobicContact CG2-CZ 3.52Å; L75-F79 HydrophobicContact CB-CD2 4.34Å; L75-F79 HydrophobicContact CB-CE2 4.14Å; L75-F79 HydrophobicContact CD2-CE2 4.19Å; L75-F79 WeakPolarHBondContact O-CD2 3.35Å; L75-F79 PolarHBondContact O-N 2.95Å; M77-F79 VanDerWaalsContact C-N 3.31Å; M77-F79 PolarHBondContact O-N 3.25Å; F79-P83 VanDerWaalsContact O-CG 3.26Å; F79-P83 WeakPolarHBondContact O-CG 3.5Å
80V92.1Very high92Very high26 Ų2629 Ų2916%0.15815%0.153CC..THydrogen-bonded Turntrans-111.2-67-175.1-175.60000111.1L76 M77 P83 V84 L104 T107L76-V80 HydrophobicContact CD1-CG2 4.09Å; L76-V80 PolarHBondContact O-N 2.97Å; M77-V80 PolarHBondContact O-N 2.94Å; V80-P83 WeakPolarHBondContact O-CD 3.39Å; V80-V84 WeakPolarHBondContact O-CB 3.28Å; V80-V84 WeakPolarHBondContact O-CG2 3.47Å; V80-V84 PolarHBondContact O-N 3.47Å; V80-V84 VanDerWaalsContact O-N 3.07Å; V80-L104 HydrophobicContact CG1-CD1 4.38Å; V80-T107 HydrophobicContact CB-CG2 3.86Å; V80-T107 HydrophobicContact CG1-CG2 3.96Å; V80-T107 HydrophobicContact CG2-CG2 4.24Å
81A90.2Very high91.3Very high0 Ų030.9 Ų30.90%016%0.163CC..Hα-helixtrans-68-46.9-171.900000112.5M77 T85 L104 M108 M296M77-A81 PolarHBondContact O-N 3.08Å; A81-T85 VanDerWaalsContact O-CB 3.28Å; A81-T85 WeakPolarHBondContact O-CB 3.42Å; A81-T85 PolarHBondContact O-N 3.33Å; A81-T85 PolarHBondContact O-OG1 3.4Å; A81-L104 HydrophobicContact CB-CD1 4.44Å; A81-M108 HydrophobicContact CB-CG 3.66Å; A81-M108 HydrophobicContact CB-SD 4.27Å; A81-M296 HydrophobicContact CB-SD 4.1Å
82A91.1Very high90.3Very high1 Ų139.3 Ų39.31%0.00820%0.199CC..Hα-helixtrans-60-43.3-176.300000114.1Y35 I39 M77 P86 M296Y35-A82 WeakPolarHBondContact CD1-O 3.47Å; I39-A82 HydrophobicContact CD1-CB 4.15Å; I39-A82 HydrophobicContact CG1-CB 3.66Å; M77-A82 PolarHBondContact O-N 3.37Å; A82-P86 WeakPolarHBondContact O-CD 3.16Å; A82-P86 WeakPolarHBondContact O-CG 3.47Å; A82-M296 HydrophobicContact CB-SD 4.38Å
83P91.8Very high89.7Confident38 Ų3839.5 Ų39.525%0.24720%0.195CC..Hα-helixtrans-82.4-41.417527.4-33.5000113.3I39 S78 F79 V80 P86 I87I39-P83 HydrophobicContact CD1-CB 4.08Å; S78-P83 WeakPolarHBondContact O-CD 3.3Å; F79-P83 VanDerWaalsContact O-CG 3.26Å; F79-P83 WeakPolarHBondContact O-CG 3.5Å; V80-P83 WeakPolarHBondContact O-CD 3.39Å; P83-P86 WeakPolarHBondContact O-CD 3.4Å; P83-P86 WeakPolarHBondContact O-CG 3.27Å; P83-I87 VanDerWaalsContact O-CD1 3.24Å; P83-I87 WeakPolarHBondContact O-CD1 3.4Å; P83-I87 WeakPolarHBondContact O-CG1 3.44Å; P83-I87 PolarHBondContact O-N 3.43Å
84V91.2Very high89.3Confident23 Ų2340.8 Ų40.814%0.13920%0.2CC..Hα-helixtrans-74.4-39.4-170.1-178.70000111.8V80 I87 V88 L96 L104V80-V84 WeakPolarHBondContact O-CB 3.28Å; V80-V84 WeakPolarHBondContact O-CG2 3.47Å; V80-V84 PolarHBondContact O-N 3.47Å; V80-V84 VanDerWaalsContact O-N 3.07Å; V84-I87 PolarHBondContact O-N 3.37Å; V84-V88 HydrophobicContact CG1-CG2 3.95Å; V84-V88 WeakPolarHBondContact O-CB 3.28Å; V84-V88 VanDerWaalsContact O-CG2 3.31Å; V84-V88 WeakPolarHBondContact O-CG2 3.32Å; V84-V88 PolarHBondContact O-N 3.01Å; V84-L96 HydrophobicContact CG1-CD1 3.97Å; V84-L104 HydrophobicContact CB-CD1 4.02Å; V84-L104 HydrophobicContact CG1-CD1 4.16Å; V84-L104 HydrophobicContact CG1-CD2 4.06Å
85T90.2Very high89Confident4 Ų447.9 Ų47.93%0.02523%0.231CC..Hα-helixtrans-59.1-52.6-179.1-58.80000113.5A81 I87 V88 F89 F288 H292A81-T85 VanDerWaalsContact O-CB 3.28Å; A81-T85 WeakPolarHBondContact O-CB 3.42Å; A81-T85 PolarHBondContact O-N 3.33Å; A81-T85 PolarHBondContact O-OG1 3.4Å; T85-I87 VanDerWaalsContact C-N 3.3Å; T85-I87 PolarHBondContact O-N 3.4Å; T85-V88 PolarHBondContact O-N 3.43Å; T85-F89 HydrophobicContact CG2-CD2 4.26Å; T85-F89 PolarHBondContact O-N 2.92Å; T85-F288 HydrophobicContact CG2-CE1 3.86Å; T85-F288 HydrophobicContact CG2-CZ 4.17Å; T85-H292 PolarHBondContact OG1-NE2 2.91Å
86P88.6Confident88.7Confident10 Ų1048.9 Ų48.97%0.06524%0.236CC..Hα-helixtrans-64.8-34178.424.6-34000112.6V31 Y35 A82 P83 F89 H90V31-P86 HydrophobicContact CG1-CB 3.66Å; Y35-P86 HydrophobicContact CD1-CG 3.89Å; Y35-P86 HydrophobicContact CD2-CB 4.28Å; Y35-P86 HydrophobicContact CD2-CG 4.32Å; Y35-P86 HydrophobicContact CE1-CG 4.02Å; Y35-P86 HydrophobicContact CE2-CB 4.19Å; Y35-P86 HydrophobicContact CE2-CG 4.44Å; Y35-P86 HydrophobicContact CG-CB 4.49Å; Y35-P86 HydrophobicContact CG-CG 4.03Å; A82-P86 WeakPolarHBondContact O-CD 3.16Å; A82-P86 WeakPolarHBondContact O-CG 3.47Å; P83-P86 WeakPolarHBondContact O-CD 3.4Å; P83-P86 WeakPolarHBondContact O-CG 3.27Å; P86-F89 PolarHBondContact O-N 2.89Å; P86-H90 PolarHBondContact O-N 3.46Å; P86-H90 PolarHBondContact O-ND1 2.85Å
87I88.9Confident88.6Confident92 Ų9249.5 Ų49.547%0.47224%0.243SC..Hα-helixtrans-60.3-49.7173.5-69.6168.9000110P83 V84 T85 F89 H90 M91P83-I87 VanDerWaalsContact O-CD1 3.24Å; P83-I87 WeakPolarHBondContact O-CD1 3.4Å; P83-I87 WeakPolarHBondContact O-CG1 3.44Å; P83-I87 PolarHBondContact O-N 3.43Å; V84-I87 PolarHBondContact O-N 3.37Å; T85-I87 VanDerWaalsContact C-N 3.3Å; T85-I87 PolarHBondContact O-N 3.4Å; I87-F89 VanDerWaalsContact C-N 3.34Å; I87-F89 PolarHBondContact O-N 3.4Å; I87-H90 PolarHBondContact O-N 3.32Å; I87-M91 HydrophobicContact CG2-CE 3.88Å; I87-M91 VanDerWaalsContact O-CB 3.25Å; I87-M91 WeakPolarHBondContact O-CB 3.47Å; I87-M91 PolarHBondContact O-N 3.35Å
88V86.1Confident88.6Confident29 Ų2953.2 Ų53.218%0.17627%0.266CS..Hα-helixtrans-60.8-43.5177.9167.20000111.1V84 T85 H90 M91 W94 L96 L104V84-V88 HydrophobicContact CG1-CG2 3.95Å; V84-V88 WeakPolarHBondContact O-CB 3.28Å; V84-V88 VanDerWaalsContact O-CG2 3.31Å; V84-V88 WeakPolarHBondContact O-CG2 3.32Å; V84-V88 PolarHBondContact O-N 3.01Å; T85-V88 PolarHBondContact O-N 3.43Å; V88-H90 PolarHBondContact O-N 3.31Å; V88-M91 WeakPolarHBondContact O-CB 3.36Å; V88-M91 PolarHBondContact O-N 2.68Å; V88-M91 VanDerWaalsContact O-N 3.15Å; V88-W94 HydrophobicContact CB-CZ3 4.25Å; V88-W94 HydrophobicContact CG1-CE3 4.03Å; V88-W94 HydrophobicContact CG1-CZ3 3.62Å; V88-W94 HydrophobicContact CG2-CE3 4.3Å; V88-W94 HydrophobicContact CG2-CH2 3.98Å; V88-W94 HydrophobicContact CG2-CZ3 3.51Å; V88-L96 HydrophobicContact CG2-CD1 3.66Å; V88-L104 HydrophobicContact CG2-CD2 4.47Å
89F81Confident88.5Confident58 Ų5859.1 Ų59.125%0.25429%0.292SS..Hα-helixtrans-65.8-36.7-179.5-101.9-113000112.7T85 P86 I87 M91 H285 F288 I289T85-F89 HydrophobicContact CG2-CD2 4.26Å; T85-F89 PolarHBondContact O-N 2.92Å; P86-F89 PolarHBondContact O-N 2.89Å; I87-F89 VanDerWaalsContact C-N 3.34Å; I87-F89 PolarHBondContact O-N 3.4Å; F89-M91 VanDerWaalsContact C-N 3.28Å; F89-H285 AromaticContact CD1-CE1 3.21Å; F89-H285 WeakPolarHBondContact CD1-CE1 3.2Å; F89-H285 AromaticContact CD1-ND1 3.29Å; F89-H285 VanDerWaalsContact CD1-ND1 3.29Å; F89-H285 WeakPolarHBondContact CD1-ND1 3.48Å; F89-H285 AromaticContact CD1-NE2 3.92Å; F89-H285 AromaticContact CE1-ND1 3.7Å; F89-H285 AromaticContact CG-CE1 3.9Å; F89-H285 PolarHBondContact O-CE1 2.9Å; F89-H285 VanDerWaalsContact O-CE1 3.24Å; F89-F288 AromaticContact CD1-CD1 3.64Å; F89-F288 HydrophobicContact CD1-CD1 3.64Å; F89-F288 HydrophobicContact CD1-CE1 4.09Å; F89-F288 HydrophobicContact CD2-CD1 4.13Å; F89-F288 AromaticContact CD2-CE1 3.71Å; F89-F288 HydrophobicContact CD2-CE1 3.71Å; F89-F288 HydrophobicContact CE1-CB 3.96Å; F89-F288 AromaticContact CE1-CD1 3.1Å; F89-F288 HydrophobicContact CE1-CD1 3.1Å; F89-F288 AromaticContact CE1-CE1 3.69Å; F89-F288 HydrophobicContact CE1-CE1 3.69Å; F89-F288 AromaticContact CE1-CG 3.62Å; F89-F288 HydrophobicContact CE1-CG 3.62Å; F89-F288 AromaticContact CE2-CD1 3.59Å; F89-F288 HydrophobicContact CE2-CD1 3.59Å; F89-F288 AromaticContact CE2-CE1 3.2Å; F89-F288 HydrophobicContact CE2-CE1 3.2Å; F89-F288 HydrophobicContact CE2-CE2 4.48Å; F89-F288 HydrophobicContact CE2-CG 4.37Å; F89-F288 AromaticContact CE2-CZ 3.71Å; F89-F288 HydrophobicContact CE2-CZ 3.71Å; F89-F288 HydrophobicContact CG-CD1 4.18Å; F89-F288 HydrophobicContact CG-CE1 4.16Å; F89-F288 HydrophobicContact CZ-CB 4.29Å; F89-F288 AromaticContact CZ-CD1 3.07Å; F89-F288 HydrophobicContact CZ-CD1 3.07Å; F89-F288 HydrophobicContact CZ-CD2 4.08Å; F89-F288 AromaticContact CZ-CE1 3.23Å; F89-F288 HydrophobicContact CZ-CE1 3.23Å; F89-F288 HydrophobicContact CZ-CE2 4.2Å; F89-F288 AromaticContact CZ-CG 3.53Å; F89-F288 HydrophobicContact CZ-CG 3.53Å; F89-F288 AromaticContact CZ-CZ 3.81Å; F89-F288 HydrophobicContact CZ-CZ 3.81Å; F89-I289 HydrophobicContact CB-CD1 3.78Å; F89-I289 HydrophobicContact CD1-CD1 3.79Å; F89-I289 HydrophobicContact CD1-CG1 3.92Å; F89-I289 HydrophobicContact CG-CD1 3.87Å; F89-I289 HydrophobicContact CG-CG1 4.5Å
90H81.6Confident88.4Confident79 Ų7954.7 Ų54.737%0.36627%0.273SS..Hα-helixtrans-82.5-8.1175.4-68.771.1000113P86 I87 V88 K92P86-H90 PolarHBondContact O-N 3.46Å; P86-H90 PolarHBondContact O-ND1 2.85Å; I87-H90 PolarHBondContact O-N 3.32Å; V88-H90 PolarHBondContact O-N 3.31Å; H90-K92 PolarHBondContact O-N 2.94Å
91M82.6Confident88.5Confident45 Ų4553.5 Ų53.522%0.22227%0.266CS..  trans-83113.6178.5-166-177.3-70.400109.4I87 V88 F89 N93 K95 L96I87-M91 HydrophobicContact CG2-CE 3.88Å; I87-M91 VanDerWaalsContact O-CB 3.25Å; I87-M91 WeakPolarHBondContact O-CB 3.47Å; I87-M91 PolarHBondContact O-N 3.35Å; V88-M91 WeakPolarHBondContact O-CB 3.36Å; V88-M91 PolarHBondContact O-N 2.68Å; V88-M91 VanDerWaalsContact O-N 3.15Å; F89-M91 VanDerWaalsContact C-N 3.28Å; M91-N93 VanDerWaalsContact C-N 3.27Å; M91-N93 WeakPolarHBondContact CG-O 3.39Å; M91-N93 PolarHBondContact O-N 2.93Å; M91-K95 HydrophobicContact CE-CB 4.39Å; M91-K95 HydrophobicContact SD-CB 3.71Å; M91-K95 HydrophobicContact SD-CG 4.15Å; M91-K95 PolarHBondContact SD-N 3.43Å; M91-L96 HydrophobicContact CE-CD1 4.45Å; M91-L96 HydrophobicContact CE-CD2 4.34Å; M91-L96 HydrophobicContact CE-CG 3.98Å
92K76.2Confident88.7Confident178 Ų17857.1 Ų57.177%0.77428%0.282SS*.SBendtrans-55.2-42.3-179.4-65.6-173.3176.4-173.80113H90 E175H90-K92 PolarHBondContact O-N 2.94Å; K92-E175 VanDerWaalsContact O-OE2 3.14Å
93N84.8Confident88.7Confident42 Ų4260.5 Ų60.523%0.22530%0.3CS..SBendtrans-134.9142.6179.361.9-35.7000111.4M91 K95 E175 P176M91-N93 VanDerWaalsContact C-N 3.27Å; M91-N93 WeakPolarHBondContact CG-O 3.39Å; M91-N93 PolarHBondContact O-N 2.93Å; N93-K95 WeakPolarHBondContact O-CG 3.33Å; N93-K95 PolarHBondContact O-N 3.42Å; N93-K95 WeakPolarHBondContact OD1-CE 3.3Å; N93-E175 HydrophobicContact CB-CB 3.76Å; N93-E175 HydrophobicContact CB-CG 4.34Å; N93-P176 CarbonylContact C-O 3.52Å
94W89Confident88.7Confident27 Ų2759.5 Ų59.510%0.10229%0.292CS..  trans-62.8108.7-176.8-174.7-86.3000112.3V88 L96 L100 C101 P176 C178V88-W94 HydrophobicContact CB-CZ3 4.25Å; V88-W94 HydrophobicContact CG1-CE3 4.03Å; V88-W94 HydrophobicContact CG1-CZ3 3.62Å; V88-W94 HydrophobicContact CG2-CE3 4.3Å; V88-W94 HydrophobicContact CG2-CH2 3.98Å; V88-W94 HydrophobicContact CG2-CZ3 3.51Å; W94-L96 HydrophobicContact CH2-CB 4.3Å; W94-L96 HydrophobicContact CH2-CD1 4.29Å; W94-L96 HydrophobicContact CZ2-CB 3.63Å; W94-L96 HydrophobicContact CZ2-CD1 4.44Å; W94-L96 PolarHBondContact NE1-O 3.45Å; W94-L100 HydrophobicContact CZ2-CB 4.22Å; W94-C101 VanDerWaalsContact CH2-CA 3.49Å; W94-C101 HydrophobicContact CH2-CB 3.86Å; W94-C101 HydrophobicContact CZ2-CB 3.37Å; W94-C101 VanDerWaalsContact CZ2-N 3.26Å; W94-P176 WeakPolarHBondContact CB-O 3.42Å; W94-P176 PolarHBondContact N-O 3.48Å; W94-C178 HydrophobicContact CD2-CB 3.6Å; W94-C178 HydrophobicContact CE3-CB 3.25Å; W94-C178 HydrophobicContact CG-CB 4.33Å; W94-C178 HydrophobicContact CH2-CB 4.02Å; W94-C178 HydrophobicContact CZ2-CB 4.35Å; W94-C178 HydrophobicContact CZ3-CB 3.44Å; W94-C178 VanDerWaalsContact CZ3-CB 3.44Å
95K90.4Very high88.8Confident150 Ų15059.4 Ų59.465%0.65229%0.292SS*.  trans-109.4-5177.9-64.3175.9-168.4-179.70114M91 N93M91-K95 HydrophobicContact CE-CB 4.39Å; M91-K95 HydrophobicContact SD-CB 3.71Å; M91-K95 HydrophobicContact SD-CG 4.15Å; M91-K95 PolarHBondContact SD-N 3.43Å; N93-K95 WeakPolarHBondContact O-CG 3.33Å; N93-K95 PolarHBondContact O-N 3.42Å; N93-K95 WeakPolarHBondContact OD1-CE 3.3Å
96L90.7Very high89Confident43 Ų4360.3 Ų60.323%0.22530%0.297CS..SBendtrans-80156.5-178.8-68.2177.3000111.1V84 V88 M91 W94 L100V84-L96 HydrophobicContact CG1-CD1 3.97Å; V88-L96 HydrophobicContact CG2-CD1 3.66Å; M91-L96 HydrophobicContact CE-CD1 4.45Å; M91-L96 HydrophobicContact CE-CD2 4.34Å; M91-L96 HydrophobicContact CE-CG 3.98Å; W94-L96 HydrophobicContact CH2-CB 4.3Å; W94-L96 HydrophobicContact CH2-CD1 4.29Å; W94-L96 HydrophobicContact CZ2-CB 3.63Å; W94-L96 HydrophobicContact CZ2-CD1 4.44Å; W94-L96 PolarHBondContact NE1-O 3.45Å; L96-L100 HydrophobicContact CB-CB 4.37Å; L96-L100 HydrophobicContact CB-CD1 4.09Å; L96-L100 HydrophobicContact CD1-CD1 4.08Å; L96-L100 HydrophobicContact CD2-CD1 4.12Å; L96-L100 HydrophobicContact CG-CD1 4.32Å
97P92.5Very high89.3Confident66 Ų6660.2 Ų60.243%0.42930%0.297SS..  trans-56148173.7-28.735.9000113.5F99 L100P97-F99 HydrophobicContact CB-CD1 3.4Å; P97-F99 VanDerWaalsContact CB-CD1 3.4Å; P97-F99 HydrophobicContact CB-CE1 3.36Å; P97-F99 HydrophobicContact CB-CG 4.45Å; P97-F99 HydrophobicContact CB-CZ 4.39Å; P97-F99 HydrophobicContact CG-CD1 4.31Å; P97-F99 HydrophobicContact CG-CE1 3.76Å; P97-F99 PolarHBondContact O-N 3.5Å; P97-F99 VanDerWaalsContact O-N 3.1Å; P97-L100 PolarHBondContact O-N 3.4Å
98T92.7Very high89.4Confident81 Ų8157.9 Ų57.950%0.49728%0.284SS..Hα-helixtrans-54.6-32.5179.3-49.40000113.5L100 C101 K102 I167T98-L100 VanDerWaalsContact C-N 3.28Å; T98-L100 PolarHBondContact O-N 2.97Å; T98-C101 WeakPolarHBondContact O-CB 3.49Å; T98-C101 PolarHBondContact O-N 2.91Å; T98-K102 PolarHBondContact O-N 3.26Å; T98-I167 HydrophobicContact CG2-CD1 4.17Å
99F93.4Very high89.8Confident127 Ų12756.9 Ų56.956%0.55728%0.28SS*.Hα-helixtrans-63.7-34.617880.8-96.6000111.9P97 C101 K102 L103P97-F99 HydrophobicContact CB-CD1 3.4Å; P97-F99 VanDerWaalsContact CB-CD1 3.4Å; P97-F99 HydrophobicContact CB-CE1 3.36Å; P97-F99 HydrophobicContact CB-CG 4.45Å; P97-F99 HydrophobicContact CB-CZ 4.39Å; P97-F99 HydrophobicContact CG-CD1 4.31Å; P97-F99 HydrophobicContact CG-CE1 3.76Å; P97-F99 PolarHBondContact O-N 3.5Å; P97-F99 VanDerWaalsContact O-N 3.1Å; F99-C101 VanDerWaalsContact C-N 3.34Å; F99-K102 PolarHBondContact O-N 2.89Å; F99-L103 HydrophobicContact CD2-CD2 4.35Å; F99-L103 HydrophobicContact CE2-CD2 4.45Å; F99-L103 WeakPolarHBondContact O-CB 2.94Å; F99-L103 PolarHBondContact O-N 2.9Å
100L92.2Very high90.5Very high29 Ų2954.4 Ų54.415%0.15227%0.27CS..Hα-helixtrans-69-33.6176.8-75.1177.7000111.9W94 L96 P97 T98 K102 L103 L104W94-L100 HydrophobicContact CZ2-CB 4.22Å; L96-L100 HydrophobicContact CB-CB 4.37Å; L96-L100 HydrophobicContact CB-CD1 4.09Å; L96-L100 HydrophobicContact CD1-CD1 4.08Å; L96-L100 HydrophobicContact CD2-CD1 4.12Å; L96-L100 HydrophobicContact CG-CD1 4.32Å; P97-L100 PolarHBondContact O-N 3.4Å; T98-L100 VanDerWaalsContact C-N 3.28Å; T98-L100 PolarHBondContact O-N 2.97Å; L100-K102 PolarHBondContact O-N 3.25Å; L100-L103 HydrophobicContact CD2-CD2 4.38Å; L100-L103 PolarHBondContact O-N 3.35Å; L100-L104 VanDerWaalsContact O-CB 3.3Å; L100-L104 WeakPolarHBondContact O-CB 3.02Å; L100-L104 PolarHBondContact O-N 2.89Å
101C93Very high91.2Very high1 Ų150.7 Ų50.71%0.00725%0.252CS..Hα-helixtrans-60-37.5175.4176.70000110.9W94 T98 F99 P105 T165 I167 C178W94-C101 VanDerWaalsContact CH2-CA 3.49Å; W94-C101 HydrophobicContact CH2-CB 3.86Å; W94-C101 HydrophobicContact CZ2-CB 3.37Å; W94-C101 VanDerWaalsContact CZ2-N 3.26Å; T98-C101 WeakPolarHBondContact O-CB 3.49Å; T98-C101 PolarHBondContact O-N 2.91Å; F99-C101 VanDerWaalsContact C-N 3.34Å; C101-P105 VanDerWaalsContact O-CD 3.32Å; C101-P105 WeakPolarHBondContact O-CD 3.43Å; C101-T165 VanDerWaalsContact O-CG2 3.26Å; C101-T165 WeakPolarHBondContact O-CG2 3.04Å; C101-T165 VanDerWaalsContact SG-CG2 3.58Å; C101-I167 HydrophobicContact CB-CG1 4.21Å; C101-C178 WeakPolarHBondContact CA-SG 3.29Å; C101-C178 HydrophobicContact CB-CB 3.93Å; C101-C178 WeakPolarHBondContact CB-SG 3.3Å; C101-C178 PolarHBondContact O-SG 3.33Å; C101-C178 VanDerWaalsContact O-SG 3.37Å; C101-C178 WeakPolarHBondContact SG-CB 3.33Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 3.41Å
102K94.4Very high91.7Very high76 Ų7648.6 Ų48.633%0.3324%0.242SC..Hα-helixtrans-84.9-38.6177.5-63-174.2165.4-63.70113.2T98 F99 L100 P105 V106 G162 I163 T165T98-K102 PolarHBondContact O-N 3.26Å; F99-K102 PolarHBondContact O-N 2.89Å; L100-K102 PolarHBondContact O-N 3.25Å; K102-P105 WeakPolarHBondContact O-CD 3.35Å; K102-V106 VanDerWaalsContact O-CG2 3.26Å; K102-V106 WeakPolarHBondContact O-CG2 3.38Å; K102-G162 WeakPolarHBondContact CG-O 3.4Å; K102-G162 PolarHBondContact NZ-O 3.03Å; K102-I163 PolarHBondContact NZ-O 3.23Å; K102-T165 PolarHBondContact NZ-O 2.95Å
103L92.1Very high92.7Very high73 Ų7340.3 Ų40.338%0.38221%0.206SC..Hα-helixtrans-71.3-41.3-173.6-177.764.3000111.9F99 L100 V106 T107F99-L103 HydrophobicContact CD2-CD2 4.35Å; F99-L103 HydrophobicContact CE2-CD2 4.45Å; F99-L103 WeakPolarHBondContact O-CB 2.94Å; F99-L103 PolarHBondContact O-N 2.9Å; L100-L103 HydrophobicContact CD2-CD2 4.38Å; L100-L103 PolarHBondContact O-N 3.35Å; L103-V106 PolarHBondContact O-N 3.4Å; L103-T107 WeakPolarHBondContact CD1-OG1 3.48Å; L103-T107 WeakPolarHBondContact O-CB 3.42Å; L103-T107 PolarHBondContact O-N 3.41Å; L103-T107 PolarHBondContact O-OG1 3.33Å; L103-T107 VanDerWaalsContact O-OG1 3.09Å
104L92Very high93.3Very high16 Ų1638.3 Ų38.38%0.08420%0.195CC..Hα-helixtrans-55.5-54.8-174.7-175.864000113.4V80 A81 V84 V88 L100 V106 T107 M108V80-L104 HydrophobicContact CG1-CD1 4.38Å; A81-L104 HydrophobicContact CB-CD1 4.44Å; V84-L104 HydrophobicContact CB-CD1 4.02Å; V84-L104 HydrophobicContact CG1-CD1 4.16Å; V84-L104 HydrophobicContact CG1-CD2 4.06Å; V88-L104 HydrophobicContact CG2-CD2 4.47Å; L100-L104 VanDerWaalsContact O-CB 3.3Å; L100-L104 WeakPolarHBondContact O-CB 3.02Å; L100-L104 PolarHBondContact O-N 2.89Å; L104-V106 VanDerWaalsContact C-N 3.33Å; L104-V106 PolarHBondContact O-N 2.89Å; L104-T107 PolarHBondContact O-N 3.46Å; L104-M108 HydrophobicContact CG-CE 4.18Å; L104-M108 WeakPolarHBondContact O-CG 3.18Å; L104-M108 PolarHBondContact O-N 3.46Å; L104-M108 VanDerWaalsContact O-N 3.08Å
105P92.6Very high93.6Very high22 Ų2237 Ų3714%0.14319%0.191CC..Hα-helixtrans-68-33.1-18030.2-38000112.3C101 K102 M108 G109 L161C101-P105 VanDerWaalsContact O-CD 3.32Å; C101-P105 WeakPolarHBondContact O-CD 3.43Å; K102-P105 WeakPolarHBondContact O-CD 3.35Å; P105-M108 HydrophobicContact CB-CE 4.48Å; P105-M108 PolarHBondContact O-N 3.32Å; P105-G109 PolarHBondContact O-N 3.37Å; P105-L161 HydrophobicContact CB-CB 4.1Å
106V94.8Very high93.8Very high22 Ų2230.2 Ų30.213%0.13316%0.162CC..Hα-helixtrans-64.2-47.5174.4176.80000110.9K102 L103 L104 M108 G109 V110 G162K102-V106 VanDerWaalsContact O-CG2 3.26Å; K102-V106 WeakPolarHBondContact O-CG2 3.38Å; L103-V106 PolarHBondContact O-N 3.4Å; L104-V106 VanDerWaalsContact C-N 3.33Å; L104-V106 PolarHBondContact O-N 2.89Å; V106-M108 VanDerWaalsContact C-N 3.31Å; V106-M108 PolarHBondContact O-N 2.92Å; V106-G109 PolarHBondContact O-N 2.94Å; V106-V110 HydrophobicContact CG1-CG2 4.03Å; V106-V110 WeakPolarHBondContact O-CB 3.42Å; V106-V110 WeakPolarHBondContact O-CG2 3.19Å; V106-V110 PolarHBondContact O-N 3.48Å; V106-G162 VanDerWaalsContact CG2-CA 3.41Å; V106-G162 VanDerWaalsContact CG2-N 3.32Å
107T93.6Very high94.1Very high9 Ų930.2 Ų30.26%0.05516%0.162CC..Hα-helixtrans-62.4-39.6180-64.60000111.7L76 V80 L103 L104 S111L76-T107 HydrophobicContact CD1-CG2 3.91Å; L76-T107 HydrophobicContact CD2-CG2 4.04Å; L76-T107 HydrophobicContact CG-CG2 3.65Å; V80-T107 HydrophobicContact CB-CG2 3.86Å; V80-T107 HydrophobicContact CG1-CG2 3.96Å; V80-T107 HydrophobicContact CG2-CG2 4.24Å; L103-T107 WeakPolarHBondContact CD1-OG1 3.48Å; L103-T107 WeakPolarHBondContact O-CB 3.42Å; L103-T107 PolarHBondContact O-N 3.41Å; L103-T107 PolarHBondContact O-OG1 3.33Å; L103-T107 VanDerWaalsContact O-OG1 3.09Å; L104-T107 PolarHBondContact O-N 3.46Å; T107-S111 WeakPolarHBondContact O-CB 3.47Å; T107-S111 PolarHBondContact O-N 3.21Å; T107-S111 PolarHBondContact O-OG 3.11Å
108M92.5Very high94.3Very high42 Ų4227.1 Ų27.121%0.20714%0.142CC..Hα-helixtrans-61.4-54.3172.7-71.9-171.4-65.700110.8A81 L104 P105 V106 V110 S111 V112A81-M108 HydrophobicContact CB-CG 3.66Å; A81-M108 HydrophobicContact CB-SD 4.27Å; L104-M108 HydrophobicContact CG-CE 4.18Å; L104-M108 WeakPolarHBondContact O-CG 3.18Å; L104-M108 PolarHBondContact O-N 3.46Å; L104-M108 VanDerWaalsContact O-N 3.08Å; P105-M108 HydrophobicContact CB-CE 4.48Å; P105-M108 PolarHBondContact O-N 3.32Å; V106-M108 VanDerWaalsContact C-N 3.31Å; V106-M108 PolarHBondContact O-N 2.92Å; M108-V110 PolarHBondContact O-N 3.45Å; M108-S111 PolarHBondContact O-N 3.49Å; M108-V112 VanDerWaalsContact O-CG2 3.25Å; M108-V112 WeakPolarHBondContact O-CG2 3.45Å; M108-V112 PolarHBondContact O-N 3.44Å; M108-V112 VanDerWaalsContact O-N 3.11Å
109G94Very high94.5Very high8 Ų823.7 Ų23.78%0.08212%0.121CC..Hα-helixtrans-54.3-51.3178.100000112.4P105 V106 S111 V112 Y113P105-G109 PolarHBondContact O-N 3.37Å; V106-G109 PolarHBondContact O-N 2.94Å; G109-S111 VanDerWaalsContact C-N 3.33Å; G109-S111 PolarHBondContact O-N 3.25Å; G109-V112 PolarHBondContact O-N 3.34Å; G109-Y113 VanDerWaalsContact O-CD2 3.24Å; G109-Y113 WeakPolarHBondContact O-CD2 3.31Å; G109-Y113 PolarHBondContact O-N 3.37Å
110V96.5Very high94.6Very high7 Ų718.6 Ų18.64%0.04210%0.1CC..Hα-helixtrans-56-48.8-179.9169.80000110.9V106 M108 V112 Y113 V114 W151 V155 S158V106-V110 HydrophobicContact CG1-CG2 4.03Å; V106-V110 WeakPolarHBondContact O-CB 3.42Å; V106-V110 WeakPolarHBondContact O-CG2 3.19Å; V106-V110 PolarHBondContact O-N 3.48Å; M108-V110 PolarHBondContact O-N 3.45Å; V110-V112 VanDerWaalsContact C-N 3.31Å; V110-V112 PolarHBondContact O-N 2.78Å; V110-Y113 PolarHBondContact O-N 2.88Å; V110-V114 HydrophobicContact CG1-CG2 4.07Å; V110-V114 WeakPolarHBondContact O-CB 3.32Å; V110-V114 VanDerWaalsContact O-CG2 3.22Å; V110-V114 WeakPolarHBondContact O-CG2 3.49Å; V110-V114 PolarHBondContact O-N 3.31Å; V110-W151 HydrophobicContact CG1-CE3 3.92Å; V110-W151 HydrophobicContact CG1-CZ3 3.76Å; V110-V155 HydrophobicContact CG1-CG2 4.27Å; V110-V155 HydrophobicContact CG2-CB 4.37Å; V110-V155 HydrophobicContact CG2-CG2 3.86Å; V110-S158 PolarHBondContact N-OG 3.3Å; V110-S158 VanDerWaalsContact N-OG 3.1Å
111S95Very high94.9Very high0 Ų018 Ų180%010%0.1CC..Hα-helixtrans-66.5-35.9-174.8-54.70000112.3S73 M77 T107 M108 G109 S115S73-S111 VanDerWaalsContact OG-CA 3.3Å; S73-S111 WeakPolarHBondContact OG-CA 3.46Å; S73-S111 PolarHBondContact OG-O 3.37Å; M77-S111 VanDerWaalsContact CG-OG 3.25Å; M77-S111 WeakPolarHBondContact CG-OG 3.46Å; M77-S111 WeakPolarHBondContact SD-CB 3.46Å; T107-S111 WeakPolarHBondContact O-CB 3.47Å; T107-S111 PolarHBondContact O-N 3.21Å; T107-S111 PolarHBondContact O-OG 3.11Å; M108-S111 PolarHBondContact O-N 3.49Å; G109-S111 VanDerWaalsContact C-N 3.33Å; G109-S111 PolarHBondContact O-N 3.25Å; S111-S115 WeakPolarHBondContact O-CB 3.1Å; S111-S115 PolarHBondContact O-N 2.99Å; S111-S115 PolarHBondContact O-OG 3.46Å
112V93.8Very high95Very high2 Ų218.1 Ų18.11%0.01210%0.1CC..Hα-helixtrans-70.9-45177.5-171.40000110.7M108 G109 V110 S115 T116 Q199 F257 W261M108-V112 VanDerWaalsContact O-CG2 3.25Å; M108-V112 WeakPolarHBondContact O-CG2 3.45Å; M108-V112 PolarHBondContact O-N 3.44Å; M108-V112 VanDerWaalsContact O-N 3.11Å; G109-V112 PolarHBondContact O-N 3.34Å; V110-V112 VanDerWaalsContact C-N 3.31Å; V110-V112 PolarHBondContact O-N 2.78Å; V112-S115 PolarHBondContact O-N 2.83Å; V112-T116 WeakPolarHBondContact O-CB 3.3Å; V112-T116 PolarHBondContact O-N 3Å; V112-T116 PolarHBondContact O-OG1 3.48Å; V112-Q199 HydrophobicContact CG1-CG 3.72Å; V112-F257 HydrophobicContact CG1-CE1 4.48Å; V112-F257 HydrophobicContact CG1-CZ 3.77Å; V112-W261 HydrophobicContact CB-CZ3 4.5Å; V112-W261 HydrophobicContact CG1-CD2 4.32Å; V112-W261 HydrophobicContact CG1-CE3 4.24Å; V112-W261 HydrophobicContact CG2-CD2 4.11Å; V112-W261 HydrophobicContact CG2-CE3 3.71Å; V112-W261 HydrophobicContact CG2-CH2 3.08Å; V112-W261 HydrophobicContact CG2-CZ2 3.52Å; V112-W261 HydrophobicContact CG2-CZ3 3.19Å
113Y96.1Very high95.2Very high3 Ų314.5 Ų14.51%0.0128%0.084CC..Hα-helixtrans-61.3-45.1174.9-84.2-68.5000112.3G109 V110 S115 T116 L117 S154 I157 T195 L198 Q199G109-Y113 VanDerWaalsContact O-CD2 3.24Å; G109-Y113 WeakPolarHBondContact O-CD2 3.31Å; G109-Y113 PolarHBondContact O-N 3.37Å; V110-Y113 PolarHBondContact O-N 2.88Å; Y113-S115 VanDerWaalsContact C-N 3.29Å; Y113-S115 PolarHBondContact O-N 2.87Å; Y113-T116 PolarHBondContact O-N 3.16Å; Y113-L117 VanDerWaalsContact O-CB 3.29Å; Y113-L117 WeakPolarHBondContact O-CB 3.47Å; Y113-L117 VanDerWaalsContact O-CG 3.25Å; Y113-L117 WeakPolarHBondContact O-CG 3.32Å; Y113-L117 PolarHBondContact O-N 3.33Å; Y113-S154 WeakPolarHBondContact CB-OG 3.24Å; Y113-I157 HydrophobicContact CD2-CG2 4.37Å; Y113-I157 HydrophobicContact CE1-CD1 4.38Å; Y113-I157 HydrophobicContact CE1-CG2 4.08Å; Y113-I157 HydrophobicContact CE2-CB 4.27Å; Y113-I157 HydrophobicContact CE2-CG2 3.58Å; Y113-I157 VanDerWaalsContact OH-CG2 3.26Å; Y113-I157 WeakPolarHBondContact OH-CG2 3.42Å; Y113-T195 HydrophobicContact CE2-CG2 4.27Å; Y113-T195 VanDerWaalsContact OH-CA 3.31Å; Y113-T195 WeakPolarHBondContact OH-CA 3.3Å; Y113-T195 WeakPolarHBondContact OH-CB 3.3Å; Y113-T195 WeakPolarHBondContact OH-CG2 3.23Å; Y113-T195 PolarHBondContact OH-OG1 3.34Å; Y113-L198 HydrophobicContact CE1-CB 4.24Å; Y113-Q199 HydrophobicContact CD1-CB 4.41Å; Y113-Q199 HydrophobicContact CD1-CG 4.41Å; Y113-Q199 HydrophobicContact CE1-CB 3.88Å; Y113-Q199 HydrophobicContact CE1-CG 4.3Å
114V97.4Very high95.3Very high0 Ų012.8 Ų12.80%08%0.081CC..Hα-helixtrans-58.7-44.7176.3170.90000110V110 T118 V150 W151 S154V110-V114 HydrophobicContact CG1-CG2 4.07Å; V110-V114 WeakPolarHBondContact O-CB 3.32Å; V110-V114 VanDerWaalsContact O-CG2 3.22Å; V110-V114 WeakPolarHBondContact O-CG2 3.49Å; V110-V114 PolarHBondContact O-N 3.31Å; V114-T118 WeakPolarHBondContact O-CB 3.08Å; V114-T118 PolarHBondContact O-N 3.32Å; V114-T118 PolarHBondContact O-OG1 3.17Å; V114-V150 HydrophobicContact CB-CG1 4.24Å; V114-V150 HydrophobicContact CG1-CG1 4.13Å; V114-V150 HydrophobicContact CG2-CG1 4.18Å; V114-W151 HydrophobicContact CG1-CZ2 4.07Å; V114-W151 HydrophobicContact CG2-CD2 3.79Å; V114-W151 HydrophobicContact CG2-CE3 3.78Å; V114-W151 HydrophobicContact CG2-CG 4.3Å; V114-W151 HydrophobicContact CG2-CH2 4.38Å; V114-W151 HydrophobicContact CG2-CZ2 4.39Å; V114-W151 HydrophobicContact CG2-CZ3 4.08Å; V114-S154 WeakPolarHBondContact CG2-OG 3.37Å; V114-S154 PolarHBondContact N-OG 2.89Å
115S95.3Very high95.5Very high1 Ų112.2 Ų12.21%0.0078%0.078CC..Hα-helixtrans-62.6-47.7-179.7-59.40000112.4L70 S73 S111 V112 Y113 S119L70-S115 VanDerWaalsContact CD1-CA 3.5Å; S73-S115 PolarHBondContact OG-OG 2.89Å; S111-S115 WeakPolarHBondContact O-CB 3.1Å; S111-S115 PolarHBondContact O-N 2.99Å; S111-S115 PolarHBondContact O-OG 3.46Å; V112-S115 PolarHBondContact O-N 2.83Å; Y113-S115 VanDerWaalsContact C-N 3.29Å; Y113-S115 PolarHBondContact O-N 2.87Å; S115-S119 WeakPolarHBondContact O-CB 3.19Å; S115-S119 PolarHBondContact O-N 2.94Å; S115-S119 PolarHBondContact O-OG 3.5Å
116T95.1Very high95.6Very high6 Ų613 Ų134%0.0378%0.078CC..Hα-helixtrans-64.6-49.5178.7-69.30000112.4V112 Y113 S119 T120 Q199 P203 F257V112-T116 WeakPolarHBondContact O-CB 3.3Å; V112-T116 PolarHBondContact O-N 3Å; V112-T116 PolarHBondContact O-OG1 3.48Å; Y113-T116 PolarHBondContact O-N 3.16Å; T116-S119 WeakPolarHBondContact O-CB 3.35Å; T116-S119 PolarHBondContact O-N 3.35Å; T116-T120 PolarHBondContact O-N 3.23Å; T116-T120 PolarHBondContact O-OG1 3.43Å; T116-Q199 WeakPolarHBondContact CG2-O 3.48Å; T116-Q199 PolarHBondContact OG1-O 3.39Å; T116-P203 HydrophobicContact CG2-CB 3.23Å; T116-P203 HydrophobicContact CG2-CG 3.28Å; T116-F257 WeakPolarHBondContact OG1-CE1 3.22Å
117L96.7Very high95.6Very high44 Ų4414.9 Ų14.923%0.238%0.083CC..Hα-helixtrans-68.4-36.9-178.5-67174.7000111.2Y113 T120 A121 V150 I153Y113-L117 VanDerWaalsContact O-CB 3.29Å; Y113-L117 WeakPolarHBondContact O-CB 3.47Å; Y113-L117 VanDerWaalsContact O-CG 3.25Å; Y113-L117 WeakPolarHBondContact O-CG 3.32Å; Y113-L117 PolarHBondContact O-N 3.33Å; L117-T120 WeakPolarHBondContact O-CB 3.35Å; L117-T120 PolarHBondContact O-N 3.03Å; L117-A121 PolarHBondContact O-N 3.18Å; L117-V150 HydrophobicContact CB-CB 4.48Å; L117-V150 HydrophobicContact CB-CG1 3.84Å; L117-V150 HydrophobicContact CB-CG2 3.91Å; L117-V150 HydrophobicContact CD1-CG1 4.33Å; L117-I153 HydrophobicContact CD1-CG2 4.18Å
118T97.6Very high95.7Very high1 Ų117 Ų171%0.0069%0.094CC..Hα-helixtrans-63.3-43.2172.4-60.10000111.2F66 N69 L70 V114 T120 A121 I122F66-T118 HydrophobicContact CB-CG2 3.86Å; F66-T118 HydrophobicContact CD1-CG2 4.2Å; F66-T118 HydrophobicContact CG-CG2 4.44Å; F66-T118 WeakPolarHBondContact O-CG2 3.4Å; N69-T118 HydrophobicContact CB-CG2 4.37Å; N69-T118 PolarHBondContact ND2-OG1 3.49Å; L70-T118 HydrophobicContact CB-CG2 4.36Å; V114-T118 WeakPolarHBondContact O-CB 3.08Å; V114-T118 PolarHBondContact O-N 3.32Å; V114-T118 PolarHBondContact O-OG1 3.17Å; T118-T120 VanDerWaalsContact C-N 3.28Å; T118-T120 PolarHBondContact O-N 3.48Å; T118-A121 WeakPolarHBondContact O-CB 3.18Å; T118-A121 PolarHBondContact O-N 3.1Å; T118-I122 HydrophobicContact CG2-CD1 4.12Å; T118-I122 VanDerWaalsContact O-CG1 3.32Å; T118-I122 WeakPolarHBondContact O-CG1 3.46Å; T118-I122 PolarHBondContact O-N 2.82Å
119S95.9Very high95.7Very high8 Ų816.8 Ų16.86%0.05610%0.095CC..Hα-helixtrans-61.7-38.5175.6-63.30000112.1S115 T116 I122 A123S115-S119 WeakPolarHBondContact O-CB 3.19Å; S115-S119 PolarHBondContact O-N 2.94Å; S115-S119 PolarHBondContact O-OG 3.5Å; T116-S119 WeakPolarHBondContact O-CB 3.35Å; T116-S119 PolarHBondContact O-N 3.35Å; S119-I122 PolarHBondContact O-N 3.04Å; S119-A123 WeakPolarHBondContact O-CB 3.44Å; S119-A123 PolarHBondContact O-N 3.32Å
120T97Very high95.7Very high20 Ų2016.7 Ų16.712%0.1239%0.092CC..Hα-helixtrans-64.3-44.6174.4-53.50000111.2T116 L117 T118 I122 A123 A124 I206T116-T120 PolarHBondContact O-N 3.23Å; T116-T120 PolarHBondContact O-OG1 3.43Å; L117-T120 WeakPolarHBondContact O-CB 3.35Å; L117-T120 PolarHBondContact O-N 3.03Å; T118-T120 VanDerWaalsContact C-N 3.28Å; T118-T120 PolarHBondContact O-N 3.48Å; T120-I122 PolarHBondContact O-N 3.43Å; T120-A123 PolarHBondContact O-N 3.27Å; T120-A124 WeakPolarHBondContact O-CB 3.49Å; T120-A124 PolarHBondContact O-N 2.87Å; T120-I206 HydrophobicContact CG2-CB 4.2Å; T120-I206 HydrophobicContact CG2-CD1 4.38Å; T120-I206 HydrophobicContact CG2-CG2 3.7Å
121A97.1Very high95.6Very high18 Ų1817.9 Ų17.915%0.14910%0.099CC..Hα-helixtrans-62.2-40.5176.100000112.2F66 L117 T118 A124 D125 I146F66-A121 HydrophobicContact CD1-CB 4.32Å; F66-A121 HydrophobicContact CE1-CB 3.89Å; F66-A121 HydrophobicContact CE2-CB 4.25Å; F66-A121 HydrophobicContact CZ-CB 3.86Å; L117-A121 PolarHBondContact O-N 3.18Å; T118-A121 WeakPolarHBondContact O-CB 3.18Å; T118-A121 PolarHBondContact O-N 3.1Å; A121-A124 PolarHBondContact O-N 3.25Å; A121-D125 WeakPolarHBondContact O-CB 3.5Å; A121-D125 PolarHBondContact O-N 3.17Å; A121-I146 HydrophobicContact CB-CG2 4.23Å
122I96.7Very high95.6Very high2 Ų221.6 Ų21.61%0.0112%0.117CC..Hα-helixtrans-61.7-47.5173.8-66.9161.9000110.6T63 F66 I67 T118 S119 T120 A124 D125 R126 L250T63-I122 HydrophobicContact CG2-CG2 4.02Å; F66-I122 HydrophobicContact CB-CD1 3.8Å; F66-I122 HydrophobicContact CB-CG1 3.39Å; F66-I122 HydrophobicContact CD2-CG1 4.12Å; F66-I122 HydrophobicContact CG-CG1 4Å; I67-I122 HydrophobicContact CG1-CD1 4.46Å; T118-I122 HydrophobicContact CG2-CD1 4.12Å; T118-I122 VanDerWaalsContact O-CG1 3.32Å; T118-I122 WeakPolarHBondContact O-CG1 3.46Å; T118-I122 PolarHBondContact O-N 2.82Å; S119-I122 PolarHBondContact O-N 3.04Å; T120-I122 PolarHBondContact O-N 3.43Å; I122-A124 VanDerWaalsContact C-N 3.32Å; I122-A124 PolarHBondContact O-N 3.16Å; I122-D125 PolarHBondContact O-N 3.38Å; I122-R126 HydrophobicContact CG2-CG 4.31Å; I122-R126 VanDerWaalsContact O-CG 3.32Å; I122-R126 WeakPolarHBondContact O-CG 3.35Å; I122-R126 PolarHBondContact O-N 2.84Å; I122-L250 HydrophobicContact CG2-CD1 3.65Å; I122-L250 HydrophobicContact CG2-CD2 3.73Å; I122-L250 HydrophobicContact CG2-CG 4.27Å
123A96.8Very high95.3Very high0 Ų024.7 Ų24.70%014%0.137CC..Hα-helixtrans-61.3-41.8179.700000111.7S119 T120 R126 Y127 I207 C210 Y211S119-A123 WeakPolarHBondContact O-CB 3.44Å; S119-A123 PolarHBondContact O-N 3.32Å; T120-A123 PolarHBondContact O-N 3.27Å; A123-R126 PolarHBondContact O-N 3.49Å; A123-Y127 WeakPolarHBondContact O-CB 3.45Å; A123-Y127 PolarHBondContact O-N 3.39Å; A123-I207 HydrophobicContact CB-CB 4.29Å; A123-I207 HydrophobicContact CB-CG1 4.02Å; A123-I207 HydrophobicContact CB-CG2 4.14Å; A123-C210 HydrophobicContact CB-CB 3.84Å; A123-Y211 HydrophobicContact CB-CE1 3.99Å; A123-Y211 HydrophobicContact CB-CE2 4.12Å
124A95.8Very high95Very high37 Ų3734.5 Ų34.531%0.30618%0.18SC..Hα-helixtrans-64.2-44.4174.800000112.2T120 A121 I122 R126 Y127 L128T120-A124 WeakPolarHBondContact O-CB 3.49Å; T120-A124 PolarHBondContact O-N 2.87Å; A121-A124 PolarHBondContact O-N 3.25Å; I122-A124 VanDerWaalsContact C-N 3.32Å; I122-A124 PolarHBondContact O-N 3.16Å; A124-R126 PolarHBondContact O-N 3.45Å; A124-Y127 WeakPolarHBondContact O-CB 3.36Å; A124-Y127 PolarHBondContact O-N 3.37Å; A124-L128 VanDerWaalsContact O-CG 3.3Å; A124-L128 WeakPolarHBondContact O-CG 3.08Å; A124-L128 PolarHBondContact O-N 2.88Å
125D94.9Very high94.6Very high5 Ų542 Ų423%0.02721%0.208CC..Hα-helixtrans-58.6-47.9174.6166.971.9000111.5T63 A121 I122 Y127 L128 V129T63-D125 PolarHBondContact OG1-OD2 3.05Å; A121-D125 WeakPolarHBondContact O-CB 3.5Å; A121-D125 PolarHBondContact O-N 3.17Å; I122-D125 PolarHBondContact O-N 3.38Å; D125-Y127 VanDerWaalsContact C-N 3.32Å; D125-Y127 PolarHBondContact O-N 3.05Å; D125-L128 PolarHBondContact O-N 2.86Å; D125-V129 WeakPolarHBondContact O-CB 3.21Å; D125-V129 WeakPolarHBondContact O-CG2 3.46Å; D125-V129 PolarHBondContact O-N 3.28Å
126R95Very high94.2Very high38 Ų3848.2 Ų48.214%0.14325%0.246CC..Hα-helixtrans-61-42176.5-66.1-59.486.5-174.4-2.8111.7T63 I122 A123 A124 I130 Y211 V214 L250T63-R126 PolarHBondContact OG1-NE 3.25Å; T63-R126 PolarHBondContact OG1-NH2 3.1Å; I122-R126 HydrophobicContact CG2-CG 4.31Å; I122-R126 VanDerWaalsContact O-CG 3.32Å; I122-R126 WeakPolarHBondContact O-CG 3.35Å; I122-R126 PolarHBondContact O-N 2.84Å; A123-R126 PolarHBondContact O-N 3.49Å; A124-R126 PolarHBondContact O-N 3.45Å; R126-I130 HydrophobicContact CB-CD1 4.5Å; R126-I130 VanDerWaalsContact O-CB 3.25Å; R126-I130 WeakPolarHBondContact O-CB 3.29Å; R126-I130 WeakPolarHBondContact O-CG1 3.39Å; R126-I130 PolarHBondContact O-N 3.13Å; R126-Y211 HydrophobicContact CB-CE1 4.47Å; R126-Y211 HydrophobicContact CG-CE1 4.43Å; R126-V214 HydrophobicContact CB-CG2 4.34Å; R126-L250 HydrophobicContact CG-CD1 3.74Å
127Y95.8Very high94Very high62 Ų6257.5 Ų57.524%0.24328%0.281CS..Hα-helixtrans-58.6-51.4175176.3-94.1000111.3A123 A124 D125 V131 H132 R213A123-Y127 WeakPolarHBondContact O-CB 3.45Å; A123-Y127 PolarHBondContact O-N 3.39Å; A124-Y127 WeakPolarHBondContact O-CB 3.36Å; A124-Y127 PolarHBondContact O-N 3.37Å; D125-Y127 VanDerWaalsContact C-N 3.32Å; D125-Y127 PolarHBondContact O-N 3.05Å; Y127-V131 HydrophobicContact CD2-CB 4.26Å; Y127-V131 HydrophobicContact CD2-CG2 3.66Å; Y127-V131 HydrophobicContact CE2-CB 4.12Å; Y127-V131 HydrophobicContact CE2-CG1 4.11Å; Y127-V131 HydrophobicContact CE2-CG2 3.81Å; Y127-V131 HydrophobicContact CG-CG2 4.32Å; Y127-V131 WeakPolarHBondContact O-CA 3.4Å; Y127-V131 WeakPolarHBondContact O-CB 3.28Å; Y127-V131 WeakPolarHBondContact O-CG2 3.36Å; Y127-V131 PolarHBondContact O-N 3.29Å; Y127-H132 AromaticContact CE1-CD2 3.73Å; Y127-H132 AromaticContact CE1-NE2 3.55Å; Y127-H132 AromaticContact CZ-NE2 3.65Å; Y127-H132 PolarHBondContact OH-NE2 3.48Å; Y127-R213 HydrophobicContact CD2-CB 3.88Å; Y127-R213 HydrophobicContact CE2-CB 3.69Å; Y127-R213 HydrophobicContact CE2-CG 3.97Å
128L94.6Very high93.8Very high54 Ų5457.4 Ų57.428%0.28328%0.279SS..Hα-helixtrans-61.2-49.4-179.9-68174000111.9A124 D125 I130 H132 R135A124-L128 VanDerWaalsContact O-CG 3.3Å; A124-L128 WeakPolarHBondContact O-CG 3.08Å; A124-L128 PolarHBondContact O-N 2.88Å; D125-L128 PolarHBondContact O-N 2.86Å; L128-I130 PolarHBondContact O-N 2.87Å; L128-H132 CarbonylContact O-C 3.38Å; L128-H132 WeakPolarHBondContact O-CA 3.45Å; L128-H132 WeakPolarHBondContact O-CB 3.37Å; L128-H132 PolarHBondContact O-N 2.94Å; L128-H132 VanDerWaalsContact O-N 3.11Å; L128-R135 VanDerWaalsContact CD2-NH1 3.32Å
129V93.7Very high93.6Very high37 Ų3759.8 Ų59.822%0.22430%0.296CS..Hα-helixtrans-68.3-36.4-175.7172.60000112.5D125D125-V129 WeakPolarHBondContact O-CB 3.21Å; D125-V129 WeakPolarHBondContact O-CG2 3.46Å; D125-V129 PolarHBondContact O-N 3.28Å
130I93.5Very high93.5Very high5 Ų564.8 Ų64.83%0.02632%0.319CS..Hα-helixtrans-91.8-45.4-173.9-62.9171.1000111.4R126 L128 V214 V217 L218 R221R126-I130 HydrophobicContact CB-CD1 4.5Å; R126-I130 VanDerWaalsContact O-CB 3.25Å; R126-I130 WeakPolarHBondContact O-CB 3.29Å; R126-I130 WeakPolarHBondContact O-CG1 3.39Å; R126-I130 PolarHBondContact O-N 3.13Å; L128-I130 PolarHBondContact O-N 2.87Å; I130-V214 HydrophobicContact CB-CG1 4.42Å; I130-V214 HydrophobicContact CD1-CG1 3.56Å; I130-V214 HydrophobicContact CG2-CG1 4.26Å; I130-V217 HydrophobicContact CG2-CB 4.47Å; I130-V217 HydrophobicContact CG2-CG1 4.07Å; I130-L218 HydrophobicContact CD1-CD1 4.38Å; I130-L218 HydrophobicContact CG2-CD2 3.9Å; I130-L218 HydrophobicContact CG2-CG 4.01Å; I130-R221 VanDerWaalsContact O-CZ 3.25Å; I130-R221 PolarHBondContact O-NH1 3.23Å; I130-R221 VanDerWaalsContact O-NH1 3.11Å; I130-R221 PolarHBondContact O-NH2 2.87Å
131V95Very high93.5Very high32 Ų3268.2 Ų68.219%0.19434%0.344CS..Hα-helixtrans-79.1-34.7-175.7-1760000111.3Y127 P133 R213 V214 V217Y127-V131 HydrophobicContact CD2-CB 4.26Å; Y127-V131 HydrophobicContact CD2-CG2 3.66Å; Y127-V131 HydrophobicContact CE2-CB 4.12Å; Y127-V131 HydrophobicContact CE2-CG1 4.11Å; Y127-V131 HydrophobicContact CE2-CG2 3.81Å; Y127-V131 HydrophobicContact CG-CG2 4.32Å; Y127-V131 WeakPolarHBondContact O-CA 3.4Å; Y127-V131 WeakPolarHBondContact O-CB 3.28Å; Y127-V131 WeakPolarHBondContact O-CG2 3.36Å; Y127-V131 PolarHBondContact O-N 3.29Å; V131-P133 VanDerWaalsContact C-CD 3.5Å; V131-P133 VanDerWaalsContact O-CD 3.25Å; V131-P133 WeakPolarHBondContact O-CD 3.43Å; V131-R213 HydrophobicContact CG2-CB 4.41Å; V131-V214 HydrophobicContact CG2-CG2 4.31Å; V131-V217 HydrophobicContact CB-CG2 4.48Å; V131-V217 HydrophobicContact CG1-CG2 4.25Å; V131-V217 HydrophobicContact CG2-CG2 4.02Å
132H93.5Very high93.5Very high78 Ų7871.4 Ų71.436%0.36136%0.357SS..  trans-119.970.2-177.1-58.8-70.4000111.9Y127 L128 F134 R135Y127-H132 AromaticContact CE1-CD2 3.73Å; Y127-H132 AromaticContact CE1-NE2 3.55Å; Y127-H132 AromaticContact CZ-NE2 3.65Å; Y127-H132 PolarHBondContact OH-NE2 3.48Å; L128-H132 CarbonylContact O-C 3.38Å; L128-H132 WeakPolarHBondContact O-CA 3.45Å; L128-H132 WeakPolarHBondContact O-CB 3.37Å; L128-H132 PolarHBondContact O-N 2.94Å; L128-H132 VanDerWaalsContact O-N 3.11Å; H132-F134 PolarHBondContact O-N 3.4Å; H132-F134 VanDerWaalsContact O-N 3.11Å; H132-R135 HydrophobicContact CB-CB 4.1Å; H132-R135 WeakPolarHBondContact O-CB 3.47Å; H132-R135 PolarHBondContact O-N 2.9Å
133P88Confident93.5Very high67 Ų6771.3 Ų71.344%0.43536%0.357SS..THydrogen-bonded Turntrans-63.4-22-171.127.1-36.5000114.7V131V131-P133 VanDerWaalsContact C-CD 3.5Å; V131-P133 VanDerWaalsContact O-CD 3.25Å; V131-P133 WeakPolarHBondContact O-CD 3.43Å
134F89.5Confident93.5Very high209 Ų20973.2 Ų73.292%0.91738%0.376SS*.THydrogen-bonded Turntrans-90.6-2.6178.9-55.2-64.3000113.7H132H132-F134 PolarHBondContact O-N 3.4Å; H132-F134 VanDerWaalsContact O-N 3.11Å
135R88.9Confident93.6Very high158 Ų15877.5 Ų77.560%0.59639%0.393SS*.SBendtrans-79144.5174.3-163.9174.9-177.4171.92109.6L128 H132 R137L128-R135 VanDerWaalsContact CD2-NH1 3.32Å; H132-R135 HydrophobicContact CB-CB 4.1Å; H132-R135 WeakPolarHBondContact O-CB 3.47Å; H132-R135 PolarHBondContact O-N 2.9Å; R135-R137 PolarHBondContact O-N 3.27Å
136T88.2Confident93.8Very high131 Ų13179.9 Ų79.980%0.80441%0.406SS*.PPolyproline II helixtrans-56.8133.7174.850.40000110.6
137R89.1Confident94Very high201 Ų20179.7 Ų79.776%0.75841%0.407SS*.PPolyproline II helixtrans-73.4147177.4-65.1-175179.8178.81.9109.8R135 S139R135-R137 PolarHBondContact O-N 3.27Å; R137-S139 PolarHBondContact O-N 3.47Å
138M93Very high94.1Very high42 Ų4279.5 Ų79.521%0.20742%0.418CS..PPolyproline II helixtrans-58.5129.2174.2-173.2-174.5-65.200110I62 F66 I142 C143 I146I62-M138 WeakPolarHBondContact CD1-O 3.48Å; I62-M138 WeakPolarHBondContact CG1-O 3.19Å; I62-M138 HydrophobicContact CG2-CB 4.5Å; I62-M138 HydrophobicContact CG2-SD 3.86Å; F66-M138 HydrophobicContact CE2-SD 4.31Å; F66-M138 HydrophobicContact CZ-SD 4.24Å; M138-I142 HydrophobicContact CG-CB 3.83Å; M138-I142 HydrophobicContact CG-CG2 3.69Å; M138-I142 HydrophobicContact SD-CG2 4.17Å; M138-C143 HydrophobicContact SD-CB 3.94Å; M138-I146 HydrophobicContact CE-CD1 3.45Å; M138-I146 VanDerWaalsContact CE-CD1 3.45Å; M138-I146 HydrophobicContact SD-CD1 3.69Å
139S94.5Very high94.3Very high52 Ų5278.1 Ų78.136%0.36442%0.417SS..PPolyproline II helixtrans-75158.2173.170.80000110.9R137 S141 I142 C143R137-S139 PolarHBondContact O-N 3.47Å; S139-S141 PolarHBondContact O-N 2.89Å; S139-I142 PolarHBondContact O-N 3.2Å; S139-I142 WeakPolarHBondContact OG-CG1 3.32Å; S139-I142 PolarHBondContact OG-N 3.33Å; S139-C143 PolarHBondContact O-N 3.04Å
140Q93.9Very high94.5Very high113 Ų11377 Ų7753%0.52841%0.41SS..Hα-helixtrans-61-32.2176.1-73.2-177.9-21.400112.3R60 I62 L65 C143 G144R60-Q140 PolarHBondContact O-NE2 2.88Å; I62-Q140 HydrophobicContact CD1-CB 4.44Å; I62-Q140 HydrophobicContact CD1-CG 3.91Å; L65-Q140 HydrophobicContact CD1-CG 4.12Å; Q140-C143 WeakPolarHBondContact O-CB 3.34Å; Q140-C143 PolarHBondContact O-N 3.37Å; Q140-G144 PolarHBondContact O-N 2.81Å
141S96Very high94.7Very high92 Ų9280 Ų8064%0.64342%0.421SS*.Hα-helixtrans-63.6-44.5175.4-49.50000112.1S139 C143 G144 L145S139-S141 PolarHBondContact O-N 2.89Å; S141-C143 VanDerWaalsContact C-N 3.35Å; S141-G144 PolarHBondContact O-N 2.95Å; S141-L145 WeakPolarHBondContact O-CG 3.23Å; S141-L145 PolarHBondContact O-N 3.05Å
142I96.5Very high94.9Very high85 Ų8583.5 Ų83.544%0.43644%0.438SS..Hα-helixtrans-64.7-42.1176.1-65.2167.8000110.2M138 S139 G144 L145 I146M138-I142 HydrophobicContact CG-CB 3.83Å; M138-I142 HydrophobicContact CG-CG2 3.69Å; M138-I142 HydrophobicContact SD-CG2 4.17Å; S139-I142 PolarHBondContact O-N 3.2Å; S139-I142 WeakPolarHBondContact OG-CG1 3.32Å; S139-I142 PolarHBondContact OG-N 3.33Å; I142-G144 VanDerWaalsContact C-N 3.31Å; I142-G144 PolarHBondContact O-N 2.93Å; I142-L145 PolarHBondContact O-N 3.27Å; I142-I146 HydrophobicContact CG2-CD1 3.97Å; I142-I146 HydrophobicContact CG2-CG1 4.43Å; I142-I146 WeakPolarHBondContact O-CG1 3.4Å; I142-I146 PolarHBondContact O-N 3.29Å
143C97.4Very high95.1Very high0 Ų083.8 Ų83.80%044%0.442CS..Hα-helixtrans-57.8-43.2174.5-178.10000112I62 M138 S139 Q140 S141 I146 I147I62-C143 HydrophobicContact CD1-CB 3.85Å; I62-C143 HydrophobicContact CG2-CB 4.18Å; M138-C143 HydrophobicContact SD-CB 3.94Å; S139-C143 PolarHBondContact O-N 3.04Å; Q140-C143 WeakPolarHBondContact O-CB 3.34Å; Q140-C143 PolarHBondContact O-N 3.37Å; S141-C143 VanDerWaalsContact C-N 3.35Å; C143-I146 PolarHBondContact O-N 2.96Å; C143-I147 WeakPolarHBondContact O-CG1 3.4Å; C143-I147 PolarHBondContact O-N 3.27Å
144G97.5Very high95.6Very high39 Ų3980.6 Ų80.640%0.40242%0.421SS..Hα-helixtrans-62-42.3175.800000113Q140 S141 I142 I147 A148Q140-G144 PolarHBondContact O-N 2.81Å; S141-G144 PolarHBondContact O-N 2.95Å; I142-G144 VanDerWaalsContact C-N 3.31Å; I142-G144 PolarHBondContact O-N 2.93Å; G144-I147 PolarHBondContact O-N 2.84Å; G144-A148 PolarHBondContact O-N 2.89Å
145L98.1Very high95.9Very high128 Ų12873.2 Ų73.267%0.6739%0.393SS*.Hα-helixtrans-63.4-40.7174.7-70173.6000112.2S141 I142 A148 G149S141-L145 WeakPolarHBondContact O-CG 3.23Å; S141-L145 PolarHBondContact O-N 3.05Å; I142-L145 PolarHBondContact O-N 3.27Å; L145-A148 PolarHBondContact O-N 3.34Å; L145-G149 PolarHBondContact O-N 3.21Å
146I98.2Very high96.3Very high55 Ų5570.4 Ų70.428%0.28239%0.389SS..Hα-helixtrans-63.1-46.2175.4-68168.7000110.2F66 A121 M138 I142 C143 A148 G149 V150F66-I146 HydrophobicContact CE1-CB 4.36Å; F66-I146 HydrophobicContact CE1-CG2 3.85Å; F66-I146 HydrophobicContact CZ-CB 4.37Å; F66-I146 HydrophobicContact CZ-CD1 4.48Å; F66-I146 HydrophobicContact CZ-CG2 4Å; A121-I146 HydrophobicContact CB-CG2 4.23Å; M138-I146 HydrophobicContact CE-CD1 3.45Å; M138-I146 VanDerWaalsContact CE-CD1 3.45Å; M138-I146 HydrophobicContact SD-CD1 3.69Å; I142-I146 HydrophobicContact CG2-CD1 3.97Å; I142-I146 HydrophobicContact CG2-CG1 4.43Å; I142-I146 WeakPolarHBondContact O-CG1 3.4Å; I142-I146 PolarHBondContact O-N 3.29Å; C143-I146 PolarHBondContact O-N 2.96Å; I146-A148 PolarHBondContact O-N 3.43Å; I146-G149 PolarHBondContact O-N 3.5Å; I146-V150 HydrophobicContact CG2-CG2 4.3Å; I146-V150 WeakPolarHBondContact O-CB 3.32Å; I146-V150 VanDerWaalsContact O-CG2 3.3Å; I146-V150 WeakPolarHBondContact O-CG2 3.09Å; I146-V150 PolarHBondContact O-N 3.44Å
147I98.5Very high96.7Very high33 Ų3366.4 Ų66.417%0.16936%0.363CS..Hα-helixtrans-58.3-49.7177-71.9168.7000110.5F66 N69 C143 G144 G149 V150 W151F66-I147 HydrophobicContact CD1-CD1 4.23Å; F66-I147 HydrophobicContact CD1-CG1 3.89Å; F66-I147 HydrophobicContact CE1-CD1 4.41Å; F66-I147 HydrophobicContact CE1-CG1 3.83Å; N69-I147 HydrophobicContact CB-CD1 4.19Å; N69-I147 HydrophobicContact CB-CG1 4.3Å; N69-I147 HydrophobicContact CB-CG2 4.49Å; N69-I147 VanDerWaalsContact OD1-CG2 3.3Å; N69-I147 WeakPolarHBondContact OD1-CG2 3.3Å; C143-I147 WeakPolarHBondContact O-CG1 3.4Å; C143-I147 PolarHBondContact O-N 3.27Å; G144-I147 PolarHBondContact O-N 2.84Å; I147-G149 VanDerWaalsContact C-N 3.32Å; I147-G149 PolarHBondContact O-N 3.39Å; I147-V150 WeakPolarHBondContact O-CB 3.4Å; I147-V150 PolarHBondContact O-N 2.64Å; I147-W151 VanDerWaalsContact O-CD1 3.24Å; I147-W151 PolarHBondContact O-N 2.95Å
148A98.4Very high97Very high59 Ų5956.9 Ų56.949%0.48833%0.326SS..Hα-helixtrans-59.6-42.4177.900000112.2G144 L145 I146 W151 L152G144-A148 PolarHBondContact O-N 2.89Å; L145-A148 PolarHBondContact O-N 3.34Å; I146-A148 PolarHBondContact O-N 3.43Å; A148-W151 PolarHBondContact O-N 3.02Å; A148-L152 WeakPolarHBondContact O-CB 3.27Å; A148-L152 PolarHBondContact O-N 3.13Å
149G98.4Very high97.2Very high25 Ų2558 Ų5826%0.25833%0.333SS..Hα-helixtrans-62.4-41.9174.900000112.8L145 I146 I147 W151 L152 I153L145-G149 PolarHBondContact O-N 3.21Å; I146-G149 PolarHBondContact O-N 3.5Å; I147-G149 VanDerWaalsContact C-N 3.32Å; I147-G149 PolarHBondContact O-N 3.39Å; G149-W151 PolarHBondContact O-N 3.21Å; G149-L152 PolarHBondContact O-N 2.95Å; G149-I153 WeakPolarHBondContact O-CB 3.02Å; G149-I153 WeakPolarHBondContact O-CD1 3.32Å; G149-I153 VanDerWaalsContact O-CG1 3.22Å; G149-I153 WeakPolarHBondContact O-CG1 3.13Å; G149-I153 PolarHBondContact O-N 3.36Å
150V98.4Very high97.2Very high12 Ų1257.1 Ų57.17%0.07333%0.326CS..Hα-helixtrans-58.9-47.9175.8164.20000110.8V114 L117 I146 I147 S154V114-V150 HydrophobicContact CB-CG1 4.24Å; V114-V150 HydrophobicContact CG1-CG1 4.13Å; V114-V150 HydrophobicContact CG2-CG1 4.18Å; L117-V150 HydrophobicContact CB-CB 4.48Å; L117-V150 HydrophobicContact CB-CG1 3.84Å; L117-V150 HydrophobicContact CB-CG2 3.91Å; L117-V150 HydrophobicContact CD1-CG1 4.33Å; I146-V150 HydrophobicContact CG2-CG2 4.3Å; I146-V150 WeakPolarHBondContact O-CB 3.32Å; I146-V150 VanDerWaalsContact O-CG2 3.3Å; I146-V150 WeakPolarHBondContact O-CG2 3.09Å; I146-V150 PolarHBondContact O-N 3.44Å; I147-V150 WeakPolarHBondContact O-CB 3.4Å; I147-V150 PolarHBondContact O-N 2.64Å; V150-S154 VanDerWaalsContact O-CB 3.23Å; V150-S154 WeakPolarHBondContact O-CB 3.16Å; V150-S154 PolarHBondContact O-N 3.45Å; V150-S154 PolarHBondContact O-OG 3.33Å
151W98.5Very high97.2Very high68 Ų6853.1 Ų53.126%0.25831%0.308SS..Hα-helixtrans-61.8-47.4176.7-8098.2000112.1N69 L76 V110 V114 I147 A148 G149 S154 V155N69-W151 PolarHBondContact OD1-NE1 3.31Å; L76-W151 HydrophobicContact CD2-CH2 4.01Å; L76-W151 HydrophobicContact CD2-CZ3 3.89Å; V110-W151 HydrophobicContact CG1-CE3 3.92Å; V110-W151 HydrophobicContact CG1-CZ3 3.76Å; V114-W151 HydrophobicContact CG1-CZ2 4.07Å; V114-W151 HydrophobicContact CG2-CD2 3.79Å; V114-W151 HydrophobicContact CG2-CE3 3.78Å; V114-W151 HydrophobicContact CG2-CG 4.3Å; V114-W151 HydrophobicContact CG2-CH2 4.38Å; V114-W151 HydrophobicContact CG2-CZ2 4.39Å; V114-W151 HydrophobicContact CG2-CZ3 4.08Å; I147-W151 VanDerWaalsContact O-CD1 3.24Å; I147-W151 PolarHBondContact O-N 2.95Å; A148-W151 PolarHBondContact O-N 3.02Å; G149-W151 PolarHBondContact O-N 3.21Å; W151-S154 PolarHBondContact O-N 3Å; W151-V155 WeakPolarHBondContact O-CG2 3.4Å; W151-V155 PolarHBondContact O-N 2.94Å
152L98.2Very high97.1Very high106 Ų10649.1 Ų49.156%0.55528%0.281SS*.Hα-helixtrans-59.5-50.7179.5178.962.9000111.8A148 G149 S154 V155 L156A148-L152 WeakPolarHBondContact O-CB 3.27Å; A148-L152 PolarHBondContact O-N 3.13Å; G149-L152 PolarHBondContact O-N 2.95Å; L152-S154 VanDerWaalsContact C-N 3.33Å; L152-S154 PolarHBondContact O-N 3.13Å; L152-V155 PolarHBondContact O-N 3.28Å; L152-L156 HydrophobicContact CD1-CD1 4.19Å; L152-L156 HydrophobicContact CD1-CG 4.3Å; L152-L156 HydrophobicContact CG-CD1 4.1Å; L152-L156 VanDerWaalsContact O-CG 3.3Å; L152-L156 WeakPolarHBondContact O-CG 3.46Å; L152-L156 PolarHBondContact O-N 3.47Å
153I97.4Very high97.1Very high84 Ų8450 Ų5043%0.43129%0.286SS..Hα-helixtrans-60.9-44.1178.9-68.8166.1000110.3L117 G149 V155 L156 I157L117-I153 HydrophobicContact CD1-CG2 4.18Å; G149-I153 WeakPolarHBondContact O-CB 3.02Å; G149-I153 WeakPolarHBondContact O-CD1 3.32Å; G149-I153 VanDerWaalsContact O-CG1 3.22Å; G149-I153 WeakPolarHBondContact O-CG1 3.13Å; G149-I153 PolarHBondContact O-N 3.36Å; I153-V155 PolarHBondContact O-N 3.14Å; I153-L156 PolarHBondContact O-N 3.33Å; I153-I157 HydrophobicContact CG2-CD1 3.56Å; I153-I157 HydrophobicContact CG2-CG1 4.28Å; I153-I157 VanDerWaalsContact O-CG1 3.31Å; I153-I157 WeakPolarHBondContact O-CG1 3.46Å; I153-I157 PolarHBondContact O-N 3.13Å
154S97.9Very high97Very high0 Ų053.9 Ų53.90%030%0.301CS..Hα-helixtrans-62.3-42.1179.7-57.80000112.1Y113 V114 V150 W151 L152 S158Y113-S154 WeakPolarHBondContact CB-OG 3.24Å; V114-S154 WeakPolarHBondContact CG2-OG 3.37Å; V114-S154 PolarHBondContact N-OG 2.89Å; V150-S154 VanDerWaalsContact O-CB 3.23Å; V150-S154 WeakPolarHBondContact O-CB 3.16Å; V150-S154 PolarHBondContact O-N 3.45Å; V150-S154 PolarHBondContact O-OG 3.33Å; W151-S154 PolarHBondContact O-N 3Å; L152-S154 VanDerWaalsContact C-N 3.33Å; L152-S154 PolarHBondContact O-N 3.13Å; S154-S158 VanDerWaalsContact O-CB 3.24Å; S154-S158 WeakPolarHBondContact O-CB 3.19Å; S154-S158 PolarHBondContact O-N 3.44Å; S154-S158 VanDerWaalsContact O-N 3.12Å; S154-S158 PolarHBondContact O-OG 2.97Å
155V97.4Very high96.8Very high54 Ų5452.4 Ų52.433%0.32728%0.284SS..Hα-helixtrans-61.1-55.4173.3171.30000109.8V110 W151 L152 I153 I157 S158 L159V110-V155 HydrophobicContact CG1-CG2 4.27Å; V110-V155 HydrophobicContact CG2-CB 4.37Å; V110-V155 HydrophobicContact CG2-CG2 3.86Å; W151-V155 WeakPolarHBondContact O-CG2 3.4Å; W151-V155 PolarHBondContact O-N 2.94Å; L152-V155 PolarHBondContact O-N 3.28Å; I153-V155 PolarHBondContact O-N 3.14Å; V155-I157 VanDerWaalsContact C-N 3.33Å; V155-I157 PolarHBondContact O-N 2.91Å; V155-S158 CarbonylContact O-C 3.55Å; V155-S158 PolarHBondContact O-N 3.27Å; V155-L159 HydrophobicContact CG1-CD2 4.17Å; V155-L159 HydrophobicContact CG1-CG 4.14Å; V155-L159 WeakPolarHBondContact O-CG 3.27Å; V155-L159 PolarHBondContact O-N 2.93Å
156L97.3Very high96.6Very high99 Ų9951.2 Ų51.252%0.51827%0.273SS..Hα-helixtrans-55.5-44.8-176.7-72.4175.9000112.9L152 I153 S158 L159L152-L156 HydrophobicContact CD1-CD1 4.19Å; L152-L156 HydrophobicContact CD1-CG 4.3Å; L152-L156 HydrophobicContact CG-CD1 4.1Å; L152-L156 VanDerWaalsContact O-CG 3.3Å; L152-L156 WeakPolarHBondContact O-CG 3.46Å; L152-L156 PolarHBondContact O-N 3.47Å; I153-L156 PolarHBondContact O-N 3.33Å; L156-S158 VanDerWaalsContact C-N 3.31Å; L156-S158 PolarHBondContact O-N 2.97Å; L156-L159 HydrophobicContact CD2-CD1 4.03Å
157I95.9Very high96.4Very high48 Ų4851.5 Ų51.525%0.24628%0.275CS..Hα-helixtrans-69.4-31.5179.2-62.3171.6000111.4Y113 I153 V155 P160 Y191Y113-I157 HydrophobicContact CD2-CG2 4.37Å; Y113-I157 HydrophobicContact CE1-CD1 4.38Å; Y113-I157 HydrophobicContact CE1-CG2 4.08Å; Y113-I157 HydrophobicContact CE2-CB 4.27Å; Y113-I157 HydrophobicContact CE2-CG2 3.58Å; Y113-I157 VanDerWaalsContact OH-CG2 3.26Å; Y113-I157 WeakPolarHBondContact OH-CG2 3.42Å; I153-I157 HydrophobicContact CG2-CD1 3.56Å; I153-I157 HydrophobicContact CG2-CG1 4.28Å; I153-I157 VanDerWaalsContact O-CG1 3.31Å; I153-I157 WeakPolarHBondContact O-CG1 3.46Å; I153-I157 PolarHBondContact O-N 3.13Å; V155-I157 VanDerWaalsContact C-N 3.33Å; V155-I157 PolarHBondContact O-N 2.91Å; I157-P160 WeakPolarHBondContact O-CD 3.41Å; I157-Y191 PolarHBondContact O-OH 3.34Å
158S96Very high96Very high0 Ų050.7 Ų50.70%027%0.274CS..Hα-helixtrans-87.2-14.8-179-52.90000114V110 S154 V155 L156 P160 L161V110-S158 PolarHBondContact N-OG 3.3Å; V110-S158 VanDerWaalsContact N-OG 3.1Å; S154-S158 VanDerWaalsContact O-CB 3.24Å; S154-S158 WeakPolarHBondContact O-CB 3.19Å; S154-S158 PolarHBondContact O-N 3.44Å; S154-S158 VanDerWaalsContact O-N 3.12Å; S154-S158 PolarHBondContact O-OG 2.97Å; V155-S158 CarbonylContact O-C 3.55Å; V155-S158 PolarHBondContact O-N 3.27Å; L156-S158 VanDerWaalsContact C-N 3.31Å; L156-S158 PolarHBondContact O-N 2.97Å; S158-P160 VanDerWaalsContact C-CD 3.43Å; S158-L161 VanDerWaalsContact O-CB 3.31Å; S158-L161 WeakPolarHBondContact O-CB 3.27Å; S158-L161 PolarHBondContact O-N 3.34Å; S158-L161 VanDerWaalsContact O-N 3.15Å
159L95.8Very high95.6Very high67 Ų6752.5 Ų52.535%0.35128%0.275SS..Hα-helixtrans-54.2-41.4-179.8-79.7177.5000114.3V155 L156 L161 G162 I163V155-L159 HydrophobicContact CG1-CD2 4.17Å; V155-L159 HydrophobicContact CG1-CG 4.14Å; V155-L159 WeakPolarHBondContact O-CG 3.27Å; V155-L159 PolarHBondContact O-N 2.93Å; L156-L159 HydrophobicContact CD2-CD1 4.03Å; L159-L161 PolarHBondContact O-N 2.95Å; L159-L161 VanDerWaalsContact O-N 3.17Å; L159-G162 PolarHBondContact O-N 2.96Å; L159-I163 HydrophobicContact CB-CD1 4.34Å; L159-I163 WeakPolarHBondContact O-CG1 3.41Å; L159-I163 PolarHBondContact O-N 3.4Å
160P95.4Very high94.8Very high32 Ų3252 Ų5221%0.20827%0.266CS..Hα-helixtrans-52.8-36.3177.3-29.838.2000113.6I157 S158 G162 I163 Y164 W182 Y191I157-P160 WeakPolarHBondContact O-CD 3.41Å; S158-P160 VanDerWaalsContact C-CD 3.43Å; P160-G162 VanDerWaalsContact C-N 3.29Å; P160-G162 PolarHBondContact O-N 3.39Å; P160-I163 PolarHBondContact O-N 3.43Å; P160-Y164 HydrophobicContact CB-CD2 4.05Å; P160-Y164 HydrophobicContact CB-CE2 4.11Å; P160-Y164 VanDerWaalsContact O-CD2 3.24Å; P160-Y164 WeakPolarHBondContact O-CD2 3.18Å; P160-Y164 PolarHBondContact O-N 3.17Å; P160-W182 HydrophobicContact CB-CH2 3.91Å; P160-W182 HydrophobicContact CB-CZ3 4.23Å; P160-Y191 HydrophobicContact CB-CD2 4.3Å; P160-Y191 HydrophobicContact CB-CE2 3.85Å; P160-Y191 HydrophobicContact CG-CE2 3.9Å
161L93.9Very high93.8Very high29 Ų2956.8 Ų56.815%0.15230%0.298CS..Hα-helixtrans-58.4-39.6176.3-65.9172.2000112P105 S158 L159 T165 Y191P105-L161 HydrophobicContact CB-CB 4.1Å; S158-L161 VanDerWaalsContact O-CB 3.31Å; S158-L161 WeakPolarHBondContact O-CB 3.27Å; S158-L161 PolarHBondContact O-N 3.34Å; S158-L161 VanDerWaalsContact O-N 3.15Å; L159-L161 PolarHBondContact O-N 2.95Å; L159-L161 VanDerWaalsContact O-N 3.17Å; L161-T165 WeakPolarHBondContact O-CB 3.37Å; L161-T165 PolarHBondContact O-N 2.67Å; L161-T165 PolarHBondContact O-OG1 3.24Å; L161-Y191 HydrophobicContact CD1-CE1 4.4Å; L161-Y191 HydrophobicContact CD2-CD1 4.3Å; L161-Y191 HydrophobicContact CD2-CE1 3.55Å; L161-Y191 HydrophobicContact CG-CE1 3.8Å
162G94.4Very high92.7Very high8 Ų860.4 Ų60.48%0.08231%0.311CS..Hα-helixtrans-82.4-31.4177.900000113.9K102 V106 L159 P160K102-G162 WeakPolarHBondContact CG-O 3.4Å; K102-G162 PolarHBondContact NZ-O 3.03Å; V106-G162 VanDerWaalsContact CG2-CA 3.41Å; V106-G162 VanDerWaalsContact CG2-N 3.32Å; L159-G162 PolarHBondContact O-N 2.96Å; P160-G162 VanDerWaalsContact C-N 3.29Å; P160-G162 PolarHBondContact O-N 3.39Å
163I95.8Very high91.9Very high104 Ų10458.9 Ų58.953%0.53330%0.304SS..Hα-helixtrans-66.8-50.1178-68.5169000109.7K102 L159 P160K102-I163 PolarHBondContact NZ-O 3.23Å; L159-I163 HydrophobicContact CB-CD1 4.34Å; L159-I163 WeakPolarHBondContact O-CG1 3.41Å; L159-I163 PolarHBondContact O-N 3.4Å; P160-I163 PolarHBondContact O-N 3.43Å
164Y95Very high91.3Very high82 Ų8261.2 Ų61.232%0.32232%0.317SS..SBendtrans-87.2-1-174.9-60.3-58.3000114P160 E180 S181 W182 P183P160-Y164 HydrophobicContact CB-CD2 4.05Å; P160-Y164 HydrophobicContact CB-CE2 4.11Å; P160-Y164 VanDerWaalsContact O-CD2 3.24Å; P160-Y164 WeakPolarHBondContact O-CD2 3.18Å; P160-Y164 PolarHBondContact O-N 3.17Å; Y164-E180 CarbonylContact O-C 3.57Å; Y164-S181 WeakPolarHBondContact O-CA 3.49Å; Y164-S181 PolarHBondContact O-N 3.02Å; Y164-W182 HydrophobicContact CD2-CD2 4.01Å; Y164-W182 AromaticContact CD2-CE3 3.38Å; Y164-W182 HydrophobicContact CD2-CE3 3.38Å; Y164-W182 AromaticContact CD2-CH2 3.87Å; Y164-W182 HydrophobicContact CD2-CH2 3.87Å; Y164-W182 HydrophobicContact CD2-CZ2 4.42Å; Y164-W182 AromaticContact CD2-CZ3 3.31Å; Y164-W182 HydrophobicContact CD2-CZ3 3.31Å; Y164-W182 AromaticContact CE2-CE3 3.81Å; Y164-W182 HydrophobicContact CE2-CE3 3.81Å; Y164-W182 HydrophobicContact CE2-CH2 4.49Å; Y164-W182 AromaticContact CE2-CZ3 3.64Å; Y164-W182 HydrophobicContact CE2-CZ3 3.64Å; Y164-W182 HydrophobicContact CG-CD2 4.18Å; Y164-W182 AromaticContact CG-CE3 3.93Å; Y164-W182 HydrophobicContact CG-CE3 3.93Å; Y164-W182 HydrophobicContact CG-CZ3 4.27Å; Y164-P183 HydrophobicContact CE1-CG 3.96Å
165T93.9Very high90.8Very high7 Ų764.3 Ų64.34%0.04333%0.332CS..EExtended strand (participates in β ladder)trans-90.3128.5170.2-63.70000111.2C101 K102 L161 C178C101-T165 VanDerWaalsContact O-CG2 3.26Å; C101-T165 WeakPolarHBondContact O-CG2 3.04Å; C101-T165 VanDerWaalsContact SG-CG2 3.58Å; K102-T165 PolarHBondContact NZ-O 2.95Å; L161-T165 WeakPolarHBondContact O-CB 3.37Å; L161-T165 PolarHBondContact O-N 2.67Å; L161-T165 PolarHBondContact O-OG1 3.24Å; T165-C178 WeakPolarHBondContact CG2-SG 3.36Å
166K93.4Very high90.5Very high103 Ų10364.1 Ų64.145%0.44833%0.332SS..EExtended strand (participates in β ladder)trans-139.8159.7179.973.1-173.7-170-164.50111.5G168 M179 S181K166-G168 PolarHBondContact O-N 3.49Å; K166-M179 PolarHBondContact N-O 2.66Å; K166-M179 PolarHBondContact O-N 2.91Å; K166-M179 VanDerWaalsContact O-O 3.05Å; K166-S181 VanDerWaalsContact CE-CB 3.41Å; K166-S181 VanDerWaalsContact CE-OG 3.26Å; K166-S181 WeakPolarHBondContact CE-OG 3.37Å; K166-S181 PolarHBondContact NZ-OG 3.08Å
167I93.5Very high90.1Very high62 Ų6261.1 Ų61.132%0.31832%0.319SS..EExtended strand (participates in β ladder)trans-78.7119.1168.4-58.7172.2000107.3T98 C101 P176 S177T98-I167 HydrophobicContact CG2-CD1 4.17Å; C101-I167 HydrophobicContact CB-CG1 4.21Å; I167-P176 HydrophobicContact CG2-CB 4.27Å; I167-S177 WeakPolarHBondContact CA-O 3.25Å
168G90.8Very high89.9Confident15 Ų1560.4 Ų60.416%0.15532%0.318CS..EExtended strand (participates in β ladder)trans-123.4-178.9174.300000111K166 P176 S177K166-G168 PolarHBondContact O-N 3.49Å; G168-P176 CarbonylContact O-C 3.6Å; G168-P176 WeakPolarHBondContact O-CA 3.28Å; G168-S177 PolarHBondContact N-O 2.9Å; G168-S177 PolarHBondContact O-N 2.85Å
169I89.5Confident89.5Confident97 Ų9763.8 Ų63.850%0.49734%0.335SS..EExtended strand (participates in β ladder)trans-95.6122.4170-57.8-58000107.4P171 N174 P176I169-P171 WeakPolarHBondContact O-CD 3.35Å; I169-N174 WeakPolarHBondContact CG2-OD1 3.49Å; I169-P176 HydrophobicContact CD1-CG 4.28Å
170D81.9Confident89.2Confident14 Ų1463.6 Ų63.68%0.07533%0.332CS..EExtended strand (participates in β ladder)trans-71.1120.5177-174.8-29.2000109.1R172 N173 N174 E175D170-R172 PolarHBondContact O-N 3.21Å; D170-R172 VanDerWaalsContact O-N 3.1Å; D170-R172 WeakPolarHBondContact OD1-CB 3.08Å; D170-R172 VanDerWaalsContact OD1-CG 3.29Å; D170-R172 WeakPolarHBondContact OD1-CG 3.33Å; D170-R172 IonicContact OD1-CZ 2.77Å; D170-R172 PolarHBondContact OD1-N 3.23Å; D170-R172 IonicContact OD1-NE 3.76Å; D170-R172 PolarHBondContact OD1-NE 2.87Å; D170-R172 IonicContact OD1-NH2 2.69Å; D170-R172 IonicContact OD2-CZ 3.37Å; D170-R172 IonicContact OD2-NE 3.62Å; D170-R172 PolarHBondContact OD2-NE 3.5Å; D170-R172 VanDerWaalsContact OD2-NE 3.13Å; D170-R172 IonicContact OD2-NH2 3.86Å; D170-R172 PolarHBondContact OD2-NH2 2.67Å; D170-N173 WeakPolarHBondContact CB-OD1 3.3Å; D170-N173 PolarHBondContact O-N 2.89Å; D170-N174 VanDerWaalsContact O-CA 3.31Å; D170-N174 WeakPolarHBondContact O-CA 3.19Å; D170-N174 PolarHBondContact O-N 3.2Å; D170-E175 PolarHBondContact N-O 3.32Å
171P78.7Confident89Confident114 Ų11464 Ų6474%0.7434%0.336SS*.THydrogen-bonded Turntrans-65.1-14-177.226.9-34.9000113.5I169I169-P171 WeakPolarHBondContact O-CD 3.35Å
172R73.8Confident88.9Confident143 Ų14364.6 Ų64.654%0.5434%0.336SS..THydrogen-bonded Turntrans-79.5-38.7-177.3-60.3174.1-68.9-168.12.5113.1D170 E279D170-R172 PolarHBondContact O-N 3.21Å; D170-R172 VanDerWaalsContact O-N 3.1Å; D170-R172 WeakPolarHBondContact OD1-CB 3.08Å; D170-R172 VanDerWaalsContact OD1-CG 3.29Å; D170-R172 WeakPolarHBondContact OD1-CG 3.33Å; D170-R172 IonicContact OD1-CZ 2.77Å; D170-R172 PolarHBondContact OD1-N 3.23Å; D170-R172 IonicContact OD1-NE 3.76Å; D170-R172 PolarHBondContact OD1-NE 2.87Å; D170-R172 IonicContact OD1-NH2 2.69Å; D170-R172 IonicContact OD2-CZ 3.37Å; D170-R172 IonicContact OD2-NE 3.62Å; D170-R172 PolarHBondContact OD2-NE 3.5Å; D170-R172 VanDerWaalsContact OD2-NE 3.13Å; D170-R172 IonicContact OD2-NH2 3.86Å; D170-R172 PolarHBondContact OD2-NH2 2.67Å; R172-E279 PolarHBondContact NH1-O 2.91Å
173N81.5Confident88.7Confident75 Ų7567.7 Ų67.740%0.40136%0.355SS..THydrogen-bonded Turntrans-125.7-2.4-176.265.1-0.5000113.6D170 E175D170-N173 WeakPolarHBondContact CB-OD1 3.3Å; D170-N173 PolarHBondContact O-N 2.89Å; N173-E175 HydrophobicContact CB-CG 4.34Å; N173-E175 PolarHBondContact ND2-OE2 2.88Å; N173-E175 PolarHBondContact O-N 3.45Å; N173-E175 PolarHBondContact OD1-N 3.37Å
174N85.7Confident88.5Confident133 Ų13369.1 Ų69.171%0.71136%0.359SS*.THydrogen-bonded Turntrans59.329.9-176.6-160.747.1000113.3I169 D170I169-N174 WeakPolarHBondContact CG2-OD1 3.49Å; D170-N174 VanDerWaalsContact O-CA 3.31Å; D170-N174 WeakPolarHBondContact O-CA 3.19Å; D170-N174 PolarHBondContact O-N 3.2Å
175E87.8Confident88Confident64 Ų6470.6 Ų70.630%0.29938%0.381SS..EExtended strand (participates in β ladder)trans-110.8153.8178.1-60.1-170.9141.700111.7K92 N93 D170 N173 S177K92-E175 VanDerWaalsContact O-OE2 3.14Å; N93-E175 HydrophobicContact CB-CB 3.76Å; N93-E175 HydrophobicContact CB-CG 4.34Å; D170-E175 PolarHBondContact N-O 3.32Å; N173-E175 HydrophobicContact CB-CG 4.34Å; N173-E175 PolarHBondContact ND2-OE2 2.88Å; N173-E175 PolarHBondContact O-N 3.45Å; N173-E175 PolarHBondContact OD1-N 3.37Å; E175-S177 PolarHBondContact O-N 2.88Å
176P90.9Very high87.8Confident50 Ų5075.9 Ų75.933%0.32541%0.408SS..EExtended strand (participates in β ladder)trans-58.8130.9173.5-23.533.2000111.7N93 W94 I167 G168 I169N93-P176 CarbonylContact C-O 3.52Å; W94-P176 WeakPolarHBondContact CB-O 3.42Å; W94-P176 PolarHBondContact N-O 3.48Å; I167-P176 HydrophobicContact CG2-CB 4.27Å; G168-P176 CarbonylContact O-C 3.6Å; G168-P176 WeakPolarHBondContact O-CA 3.28Å; I169-P176 HydrophobicContact CD1-CG 4.28Å
177S88.8Confident87.7Confident37 Ų3772.5 Ų72.526%0.25940%0.398SS..EExtended strand (participates in β ladder)trans-139.8150.4176.7-172.40000111.1I167 G168 E175I167-S177 WeakPolarHBondContact CA-O 3.25Å; G168-S177 PolarHBondContact N-O 2.9Å; G168-S177 PolarHBondContact O-N 2.85Å; E175-S177 PolarHBondContact O-N 2.88Å
178C90.7Very high87.4Confident33 Ų3371.4 Ų71.422%0.22339%0.39CS..EExtended strand (participates in β ladder)trans-87.9110.6174-1790000108.8W94 C101 T165W94-C178 HydrophobicContact CD2-CB 3.6Å; W94-C178 HydrophobicContact CE3-CB 3.25Å; W94-C178 HydrophobicContact CG-CB 4.33Å; W94-C178 HydrophobicContact CH2-CB 4.02Å; W94-C178 HydrophobicContact CZ2-CB 4.35Å; W94-C178 HydrophobicContact CZ3-CB 3.44Å; W94-C178 VanDerWaalsContact CZ3-CB 3.44Å; C101-C178 WeakPolarHBondContact CA-SG 3.29Å; C101-C178 HydrophobicContact CB-CB 3.93Å; C101-C178 WeakPolarHBondContact CB-SG 3.3Å; C101-C178 PolarHBondContact O-SG 3.33Å; C101-C178 VanDerWaalsContact O-SG 3.37Å; C101-C178 WeakPolarHBondContact SG-CB 3.33Å; C101-C178 CovalentContact SG-SG 2.03Å; C101-C178 PolarHBondContact SG-SG 3.41Å; T165-C178 WeakPolarHBondContact CG2-SG 3.36Å
179M88.2Confident87.3Confident71 Ų7172.7 Ų72.735%0.3540%0.396SS..EExtended strand (participates in β ladder)trans-133.3152.9-17160.4-175.5-72.900111.6K166K166-M179 PolarHBondContact N-O 2.66Å; K166-M179 PolarHBondContact O-N 2.91Å; K166-M179 VanDerWaalsContact O-O 3.05Å
180E89.2Confident87.4Confident62 Ų6272.6 Ų72.629%0.2940%0.395SS..EExtended strand (participates in β ladder)trans-74.2142.1172.6-60.9-171.7175.700110.9Y164 W182 R188Y164-E180 CarbonylContact O-C 3.57Å; E180-W182 PolarHBondContact OE2-NE1 2.89Å; E180-R188 WeakPolarHBondContact OE2-CD 3.4Å; E180-R188 IonicContact OE2-NE 3.14Å
181S90.5Very high87.9Confident42 Ų4273.5 Ų73.529%0.29440%0.398SS..  trans-142.370.6-1771730000109.2Y164 K166Y164-S181 WeakPolarHBondContact O-CA 3.49Å; Y164-S181 PolarHBondContact O-N 3.02Å; K166-S181 VanDerWaalsContact CE-CB 3.41Å; K166-S181 VanDerWaalsContact CE-OG 3.26Å; K166-S181 WeakPolarHBondContact CE-OG 3.37Å; K166-S181 PolarHBondContact NZ-OG 3.08Å
182W92.1Very high88.4Confident41 Ų4169.4 Ų69.416%0.15537%0.371CS..  trans-69146.6177.3-66.686.4000111.8P160 Y164 E180 H184 R188 Y191P160-W182 HydrophobicContact CB-CH2 3.91Å; P160-W182 HydrophobicContact CB-CZ3 4.23Å; Y164-W182 HydrophobicContact CD2-CD2 4.01Å; Y164-W182 AromaticContact CD2-CE3 3.38Å; Y164-W182 HydrophobicContact CD2-CE3 3.38Å; Y164-W182 AromaticContact CD2-CH2 3.87Å; Y164-W182 HydrophobicContact CD2-CH2 3.87Å; Y164-W182 HydrophobicContact CD2-CZ2 4.42Å; Y164-W182 AromaticContact CD2-CZ3 3.31Å; Y164-W182 HydrophobicContact CD2-CZ3 3.31Å; Y164-W182 AromaticContact CE2-CE3 3.81Å; Y164-W182 HydrophobicContact CE2-CE3 3.81Å; Y164-W182 HydrophobicContact CE2-CH2 4.49Å; Y164-W182 AromaticContact CE2-CZ3 3.64Å; Y164-W182 HydrophobicContact CE2-CZ3 3.64Å; Y164-W182 HydrophobicContact CG-CD2 4.18Å; Y164-W182 AromaticContact CG-CE3 3.93Å; Y164-W182 HydrophobicContact CG-CE3 3.93Å; Y164-W182 HydrophobicContact CG-CZ3 4.27Å; E180-W182 PolarHBondContact OE2-NE1 2.89Å; W182-H184 VanDerWaalsContact C-N 3.33Å; W182-H184 PolarHBondContact O-N 3.39Å; W182-R188 HydrophobicContact CB-CB 4.41Å; W182-R188 HydrophobicContact CD2-CB 4.13Å; W182-R188 HydrophobicContact CG-CB 3.78Å; W182-Y191 AromaticContact CH2-CD1 3.63Å; W182-Y191 HydrophobicContact CH2-CD1 3.63Å; W182-Y191 AromaticContact CH2-CD2 3.81Å; W182-Y191 HydrophobicContact CH2-CD2 3.81Å; W182-Y191 HydrophobicContact CH2-CE1 4.25Å; W182-Y191 HydrophobicContact CH2-CE2 4.4Å; W182-Y191 AromaticContact CH2-CG 3.37Å; W182-Y191 HydrophobicContact CH2-CG 3.37Å; W182-Y191 AromaticContact CZ2-CD1 3.84Å; W182-Y191 HydrophobicContact CZ2-CD1 3.84Å; W182-Y191 HydrophobicContact CZ2-CE1 4.46Å; W182-Y191 HydrophobicContact CZ2-CG 4.03Å; W182-Y191 HydrophobicContact CZ3-CD2 4.4Å; W182-Y191 HydrophobicContact CZ3-CG 4.14Å
183P91.5Very high89.1Confident73 Ų7366.4 Ų66.447%0.47437%0.368SS..SBendtrans-69.7-29.1-173.826.6-34.6000113.4Y164Y164-P183 HydrophobicContact CE1-CG 3.96Å
184H91.5Very high89.6Confident133 Ų13366.9 Ų66.962%0.61637%0.37SS*.SBendtrans-132.2148.4177.4-54.4-69000109.9W182 L186 S187W182-H184 VanDerWaalsContact C-N 3.33Å; W182-H184 PolarHBondContact O-N 3.39Å; H184-L186 PolarHBondContact O-N 2.92Å; H184-S187 WeakPolarHBondContact O-CB 3.25Å; H184-S187 PolarHBondContact O-N 2.71Å; H184-S187 PolarHBondContact O-OG 2.79Å
185S84.9Confident89.9Confident114 Ų11461.4 Ų61.480%0.79734%0.341SS*.THydrogen-bonded Turntrans-59.1-30.8-177.652.60000113.8P189S185-P189 VanDerWaalsContact O-CD 3.32Å; S185-P189 WeakPolarHBondContact O-CD 3.47Å
186L88.1Confident89.9Confident117 Ų11761.3 Ų61.361%0.61334%0.34SS*.THydrogen-bonded Turntrans-83.2-15.2177.7-65176.2000113.7H184 R188 P189 I190H184-L186 PolarHBondContact O-N 2.92Å; L186-R188 PolarHBondContact O-N 3.33Å; L186-P189 WeakPolarHBondContact O-CD 3.38Å; L186-P189 WeakPolarHBondContact O-CG 3.49Å; L186-I190 HydrophobicContact CB-CD1 3.94Å; L186-I190 VanDerWaalsContact O-CB 3.28Å; L186-I190 WeakPolarHBondContact O-CB 3.48Å; L186-I190 WeakPolarHBondContact O-CD1 3.27Å; L186-I190 WeakPolarHBondContact O-CG1 3.48Å; L186-I190 PolarHBondContact O-N 2.88Å; L186-I190 VanDerWaalsContact O-N 3.08Å
187S92Very high90Very high33 Ų3362.8 Ų62.823%0.23134%0.344CS..Hα-helixtrans-65.5-42.4-174.7-62.30000112.5H184 Y191H184-S187 WeakPolarHBondContact O-CB 3.25Å; H184-S187 PolarHBondContact O-N 2.71Å; H184-S187 PolarHBondContact O-OG 2.79Å; S187-Y191 VanDerWaalsContact O-CB 3.26Å; S187-Y191 WeakPolarHBondContact O-CB 3.39Å; S187-Y191 PolarHBondContact O-N 2.95Å
188R88Confident90.1Very high38 Ų3864.8 Ų64.814%0.14335%0.351CS..Hα-helixtrans-59.2-59.9176.3-178.7174.5155.6-179.10.3112.1E180 W182 L186 I190 Y191 T192 D272 E279E180-R188 WeakPolarHBondContact OE2-CD 3.4Å; E180-R188 IonicContact OE2-NE 3.14Å; W182-R188 HydrophobicContact CB-CB 4.41Å; W182-R188 HydrophobicContact CD2-CB 4.13Å; W182-R188 HydrophobicContact CG-CB 3.78Å; L186-R188 PolarHBondContact O-N 3.33Å; R188-I190 VanDerWaalsContact C-N 3.33Å; R188-I190 PolarHBondContact O-N 2.94Å; R188-Y191 WeakPolarHBondContact O-CB 3.32Å; R188-Y191 PolarHBondContact O-N 3.33Å; R188-Y191 VanDerWaalsContact O-N 3.1Å; R188-T192 PolarHBondContact O-N 3.24Å; R188-T192 PolarHBondContact O-OG1 3.1Å; R188-T192 VanDerWaalsContact O-OG1 3.08Å; R188-D272 IonicContact CZ-OD1 2.98Å; R188-D272 IonicContact NE-OD1 3.91Å; R188-D272 PolarHBondContact NE-OD1 3.25Å; R188-D272 IonicContact NH2-OD1 3.13Å; R188-D272 PolarHBondContact NH2-OD1 3.49Å; R188-E279 IonicContact NH1-OE1 2.81Å; R188-E279 IonicContact NH2-OE1 3.72Å; R188-E279 PolarHBondContact NH2-OE1 3.42Å
189P87.8Confident90.1Very high43 Ų4363.6 Ų63.628%0.27934%0.343SS..Hα-helixtrans-63.5-35.8-178.123.8-34.4000112.9S185 L186 T192 V193S185-P189 VanDerWaalsContact O-CD 3.32Å; S185-P189 WeakPolarHBondContact O-CD 3.47Å; L186-P189 WeakPolarHBondContact O-CD 3.38Å; L186-P189 WeakPolarHBondContact O-CG 3.49Å; P189-T192 PolarHBondContact O-N 3.02Å; P189-V193 VanDerWaalsContact O-CG2 3.31Å; P189-V193 WeakPolarHBondContact O-CG2 3.48Å; P189-V193 PolarHBondContact O-N 3.41Å
190I91.5Very high90.1Very high94 Ų9460.7 Ų60.748%0.48233%0.328SS..Hα-helixtrans-61.7-46.1174.1-70169.4000110.4L186 R188 V193 I194L186-I190 HydrophobicContact CB-CD1 3.94Å; L186-I190 VanDerWaalsContact O-CB 3.28Å; L186-I190 WeakPolarHBondContact O-CB 3.48Å; L186-I190 WeakPolarHBondContact O-CD1 3.27Å; L186-I190 WeakPolarHBondContact O-CG1 3.48Å; L186-I190 PolarHBondContact O-N 2.88Å; L186-I190 VanDerWaalsContact O-N 3.08Å; R188-I190 VanDerWaalsContact C-N 3.33Å; R188-I190 PolarHBondContact O-N 2.94Å; I190-V193 PolarHBondContact O-N 2.97Å; I190-I194 HydrophobicContact CG2-CD1 3.65Å; I190-I194 HydrophobicContact CG2-CG1 4.36Å; I190-I194 WeakPolarHBondContact O-CB 3.23Å; I190-I194 VanDerWaalsContact O-CG1 3.3Å; I190-I194 WeakPolarHBondContact O-CG1 3.25Å; I190-I194 PolarHBondContact O-N 3.25Å
191Y92.3Very high90.2Very high33 Ų3360.6 Ų60.613%0.12933%0.332CS..Hα-helixtrans-62.3-43177.3-178.8-93.8000111.9I157 P160 L161 W182 S187 R188 I194 T195I157-Y191 PolarHBondContact O-OH 3.34Å; P160-Y191 HydrophobicContact CB-CD2 4.3Å; P160-Y191 HydrophobicContact CB-CE2 3.85Å; P160-Y191 HydrophobicContact CG-CE2 3.9Å; L161-Y191 HydrophobicContact CD1-CE1 4.4Å; L161-Y191 HydrophobicContact CD2-CD1 4.3Å; L161-Y191 HydrophobicContact CD2-CE1 3.55Å; L161-Y191 HydrophobicContact CG-CE1 3.8Å; W182-Y191 AromaticContact CH2-CD1 3.63Å; W182-Y191 HydrophobicContact CH2-CD1 3.63Å; W182-Y191 AromaticContact CH2-CD2 3.81Å; W182-Y191 HydrophobicContact CH2-CD2 3.81Å; W182-Y191 HydrophobicContact CH2-CE1 4.25Å; W182-Y191 HydrophobicContact CH2-CE2 4.4Å; W182-Y191 AromaticContact CH2-CG 3.37Å; W182-Y191 HydrophobicContact CH2-CG 3.37Å; W182-Y191 AromaticContact CZ2-CD1 3.84Å; W182-Y191 HydrophobicContact CZ2-CD1 3.84Å; W182-Y191 HydrophobicContact CZ2-CE1 4.46Å; W182-Y191 HydrophobicContact CZ2-CG 4.03Å; W182-Y191 HydrophobicContact CZ3-CD2 4.4Å; W182-Y191 HydrophobicContact CZ3-CG 4.14Å; S187-Y191 VanDerWaalsContact O-CB 3.26Å; S187-Y191 WeakPolarHBondContact O-CB 3.39Å; S187-Y191 PolarHBondContact O-N 2.95Å; R188-Y191 WeakPolarHBondContact O-CB 3.32Å; R188-Y191 PolarHBondContact O-N 3.33Å; R188-Y191 VanDerWaalsContact O-N 3.1Å; Y191-I194 PolarHBondContact O-N 3.43Å; Y191-T195 WeakPolarHBondContact CE1-OG1 3.34Å; Y191-T195 WeakPolarHBondContact O-CB 3.31Å; Y191-T195 PolarHBondContact O-N 2.89Å; Y191-T195 PolarHBondContact O-OG1 2.9Å
192T88.9Confident90.3Very high29 Ų2960.2 Ų60.218%0.17833%0.331CS..Hα-helixtrans-58.2-48.4175.5-57.20000111.3R188 P189 T195 F196 I269 D272R188-T192 PolarHBondContact O-N 3.24Å; R188-T192 PolarHBondContact O-OG1 3.1Å; R188-T192 VanDerWaalsContact O-OG1 3.08Å; P189-T192 PolarHBondContact O-N 3.02Å; T192-T195 PolarHBondContact O-N 2.81Å; T192-F196 WeakPolarHBondContact O-CB 3.45Å; T192-F196 PolarHBondContact O-N 3.49Å; T192-I269 HydrophobicContact CG2-CG1 3.97Å; T192-D272 VanDerWaalsContact CB-OD2 3.24Å; T192-D272 WeakPolarHBondContact CB-OD2 3.21Å; T192-D272 WeakPolarHBondContact CG2-OD2 3.49Å; T192-D272 PolarHBondContact OG1-OD2 3.08Å
193V89.7Confident90.4Very high80 Ų8058.6 Ų58.649%0.48533%0.326SS..Hα-helixtrans-65.9-45.9-179.9171.80000111.7P189 I190 T195 F196 I197P189-V193 VanDerWaalsContact O-CG2 3.31Å; P189-V193 WeakPolarHBondContact O-CG2 3.48Å; P189-V193 PolarHBondContact O-N 3.41Å; I190-V193 PolarHBondContact O-N 2.97Å; V193-T195 VanDerWaalsContact C-N 3.32Å; V193-T195 PolarHBondContact O-N 3.07Å; V193-F196 PolarHBondContact O-N 3.27Å; V193-I197 HydrophobicContact CG1-CD1 4Å; V193-I197 WeakPolarHBondContact O-CG1 3.16Å; V193-I197 PolarHBondContact O-N 2.86Å
194I92Very high90.5Very high85 Ų8556.7 Ų56.744%0.43631%0.314SS..Hα-helixtrans-60.5-45.6176.9-70.5171.9000110.1I190 Y191 F196 I197 L198I190-I194 HydrophobicContact CG2-CD1 3.65Å; I190-I194 HydrophobicContact CG2-CG1 4.36Å; I190-I194 WeakPolarHBondContact O-CB 3.23Å; I190-I194 VanDerWaalsContact O-CG1 3.3Å; I190-I194 WeakPolarHBondContact O-CG1 3.25Å; I190-I194 PolarHBondContact O-N 3.25Å; Y191-I194 PolarHBondContact O-N 3.43Å; I194-F196 PolarHBondContact O-N 3.17Å; I194-I197 PolarHBondContact O-N 3.32Å; I194-L198 HydrophobicContact CG2-CD1 3.68Å; I194-L198 HydrophobicContact CG2-CG 4.19Å; I194-L198 WeakPolarHBondContact O-CB 3.31Å; I194-L198 WeakPolarHBondContact O-CG 3.46Å; I194-L198 PolarHBondContact O-N 3.22Å
195T91.1Very high90.7Very high18 Ų1855.3 Ų55.311%0.1131%0.31CS..Hα-helixtrans-59.9-46.4177.6-69.40000110.9Y113 Y191 T192 V193 I197 L198 Q199Y113-T195 HydrophobicContact CE2-CG2 4.27Å; Y113-T195 VanDerWaalsContact OH-CA 3.31Å; Y113-T195 WeakPolarHBondContact OH-CA 3.3Å; Y113-T195 WeakPolarHBondContact OH-CB 3.3Å; Y113-T195 WeakPolarHBondContact OH-CG2 3.23Å; Y113-T195 PolarHBondContact OH-OG1 3.34Å; Y191-T195 WeakPolarHBondContact CE1-OG1 3.34Å; Y191-T195 WeakPolarHBondContact O-CB 3.31Å; Y191-T195 PolarHBondContact O-N 2.89Å; Y191-T195 PolarHBondContact O-OG1 2.9Å; T192-T195 PolarHBondContact O-N 2.81Å; V193-T195 VanDerWaalsContact C-N 3.32Å; V193-T195 PolarHBondContact O-N 3.07Å; T195-I197 VanDerWaalsContact C-N 3.32Å; T195-I197 PolarHBondContact O-N 2.93Å; T195-L198 PolarHBondContact O-N 3.4Å; T195-Q199 WeakPolarHBondContact O-CA 3.48Å; T195-Q199 WeakPolarHBondContact O-CB 3.41Å; T195-Q199 PolarHBondContact O-N 3.26Å
196F88.8Confident91.2Very high62 Ų6253.8 Ų53.827%0.27229%0.293SS..Hα-helixtrans-58.3-43176.8-177.3-101.6000112.6T192 V193 I194 F200 V201 N265 I269T192-F196 WeakPolarHBondContact O-CB 3.45Å; T192-F196 PolarHBondContact O-N 3.49Å; V193-F196 PolarHBondContact O-N 3.27Å; I194-F196 PolarHBondContact O-N 3.17Å; F196-F200 AromaticContact CD2-CD2 3.79Å; F196-F200 HydrophobicContact CD2-CD2 3.79Å; F196-F200 HydrophobicContact CD2-CE2 4.44Å; F196-F200 HydrophobicContact CD2-CG 4.48Å; F196-F200 HydrophobicContact CE2-CB 4.43Å; F196-F200 HydrophobicContact CE2-CD2 4.08Å; F196-F200 HydrophobicContact CE2-CG 4.38Å; F196-F200 WeakPolarHBondContact O-CB 3.23Å; F196-F200 PolarHBondContact O-N 2.81Å; F196-V201 HydrophobicContact CD1-CG2 4.04Å; F196-V201 HydrophobicContact CE1-CG2 3.75Å; F196-V201 PolarHBondContact O-N 3.37Å; F196-N265 HydrophobicContact CD2-CB 4.3Å; F196-N265 HydrophobicContact CE2-CB 4.46Å; F196-I269 HydrophobicContact CD2-CD1 3.93Å; F196-I269 HydrophobicContact CE2-CD1 4.24Å; F196-I269 HydrophobicContact CG-CD1 4.1Å
197I92.3Very high91.6Very high80 Ų8048.6 Ų48.641%0.4127%0.265SS..Iπ-helixtrans-65.9-49.5178-67167.4000111.2V193 I194 T195 V201 A202V193-I197 HydrophobicContact CG1-CD1 4Å; V193-I197 WeakPolarHBondContact O-CG1 3.16Å; V193-I197 PolarHBondContact O-N 2.86Å; I194-I197 PolarHBondContact O-N 3.32Å; T195-I197 VanDerWaalsContact C-N 3.32Å; T195-I197 PolarHBondContact O-N 2.93Å; I197-V201 PolarHBondContact O-N 3.36Å; I197-V201 VanDerWaalsContact O-N 3.17Å; I197-A202 PolarHBondContact O-N 2.97Å
198L92Very high91.8Very high79 Ų7950.5 Ų50.541%0.41428%0.279SS..Iπ-helixtrans-72.2-28.6-176.1-67.9-179.1000113.1Y113 I194 T195 P203Y113-L198 HydrophobicContact CE1-CB 4.24Å; I194-L198 HydrophobicContact CG2-CD1 3.68Å; I194-L198 HydrophobicContact CG2-CG 4.19Å; I194-L198 WeakPolarHBondContact O-CB 3.31Å; I194-L198 WeakPolarHBondContact O-CG 3.46Å; I194-L198 PolarHBondContact O-N 3.22Å; T195-L198 PolarHBondContact O-N 3.4Å; L198-P203 WeakPolarHBondContact O-CD 3.4Å; L198-P203 WeakPolarHBondContact O-CG 3.37Å
199Q89.7Confident92.2Very high9 Ų953.7 Ų53.74%0.04230%0.298CS..Iπ-helixtrans-93.7-29.2-176.3-167.8-180-67.100113.1V112 Y113 T116 T195V112-Q199 HydrophobicContact CG1-CG 3.72Å; Y113-Q199 HydrophobicContact CD1-CB 4.41Å; Y113-Q199 HydrophobicContact CD1-CG 4.41Å; Y113-Q199 HydrophobicContact CE1-CB 3.88Å; Y113-Q199 HydrophobicContact CE1-CG 4.3Å; T116-Q199 WeakPolarHBondContact CG2-O 3.48Å; T116-Q199 PolarHBondContact OG1-O 3.39Å; T195-Q199 WeakPolarHBondContact O-CA 3.48Å; T195-Q199 WeakPolarHBondContact O-CB 3.41Å; T195-Q199 PolarHBondContact O-N 3.26Å
200F87.7Confident92.7Very high9 Ų952.3 Ų52.34%0.03929%0.289CS..Iπ-helixtrans-118.6-64-180-65.6-82.6000112.2F196 C204 W261 N265F196-F200 AromaticContact CD2-CD2 3.79Å; F196-F200 HydrophobicContact CD2-CD2 3.79Å; F196-F200 HydrophobicContact CD2-CE2 4.44Å; F196-F200 HydrophobicContact CD2-CG 4.48Å; F196-F200 HydrophobicContact CE2-CB 4.43Å; F196-F200 HydrophobicContact CE2-CD2 4.08Å; F196-F200 HydrophobicContact CE2-CG 4.38Å; F196-F200 WeakPolarHBondContact O-CB 3.23Å; F196-F200 PolarHBondContact O-N 2.81Å; F200-C204 WeakPolarHBondContact O-CB 3.41Å; F200-C204 PolarHBondContact O-N 3.21Å; F200-C204 PolarHBondContact O-SG 2.95Å; F200-W261 HydrophobicContact CE1-CB 3.83Å; F200-W261 HydrophobicContact CZ-CB 3.78Å; F200-N265 HydrophobicContact CE2-CB 4.16Å; F200-N265 VanDerWaalsContact CE2-ND2 3.35Å; F200-N265 WeakPolarHBondContact CE2-ND2 3.44Å; F200-N265 VanDerWaalsContact CE2-OD1 3.3Å; F200-N265 WeakPolarHBondContact CE2-OD1 3.21Å; F200-N265 WeakPolarHBondContact CZ-ND2 3.08Å
201V91Very high92.9Very high60 Ų6048.3 Ų48.336%0.36427%0.268SS..Iπ-helixtrans-62-56.6-165.1-177.90000111.6F196 I197 C204 L205F196-V201 HydrophobicContact CD1-CG2 4.04Å; F196-V201 HydrophobicContact CE1-CG2 3.75Å; F196-V201 PolarHBondContact O-N 3.37Å; I197-V201 PolarHBondContact O-N 3.36Å; I197-V201 VanDerWaalsContact O-N 3.17Å; V201-C204 PolarHBondContact O-N 3.26Å; V201-L205 HydrophobicContact CG1-CD1 4.02Å; V201-L205 WeakPolarHBondContact O-CB 3.38Å; V201-L205 WeakPolarHBondContact O-CG 3.32Å; V201-L205 PolarHBondContact O-N 3.39Å
202A94Very high93Very high35 Ų3554 Ų5429%0.28929%0.29SS..Hα-helixtrans-63.6-48.9-177.500000112.5I197 L205 I206I197-A202 PolarHBondContact O-N 2.97Å; A202-L205 PolarHBondContact O-N 3.24Å; A202-I206 WeakPolarHBondContact O-CG1 3.42Å; A202-I206 PolarHBondContact O-N 3.38Å; A202-I206 VanDerWaalsContact O-N 3.1Å
203P94.5Very high93.4Very high7 Ų759.3 Ų59.35%0.04531%0.307CS..Hα-helixtrans-60.9-44.2175.5-28.538.4000114T116 L198 L205 I206 I207T116-P203 HydrophobicContact CG2-CB 3.23Å; T116-P203 HydrophobicContact CG2-CG 3.28Å; L198-P203 WeakPolarHBondContact O-CD 3.4Å; L198-P203 WeakPolarHBondContact O-CG 3.37Å; P203-L205 VanDerWaalsContact C-N 3.3Å; P203-L205 PolarHBondContact O-N 3.11Å; P203-I206 PolarHBondContact O-N 3.01Å; P203-I207 WeakPolarHBondContact O-CB 3.26Å; P203-I207 WeakPolarHBondContact O-CG1 3.48Å; P203-I207 PolarHBondContact O-N 2.83Å
204C92.9Very high93.8Very high32 Ų3255.5 Ų55.522%0.21628%0.284CS..Hα-helixtrans-62.7-38.9179.6-70.50000111.5F200 V201 S208 V258F200-C204 WeakPolarHBondContact O-CB 3.41Å; F200-C204 PolarHBondContact O-N 3.21Å; F200-C204 PolarHBondContact O-SG 2.95Å; V201-C204 PolarHBondContact O-N 3.26Å; C204-S208 WeakPolarHBondContact O-CB 3.46Å; C204-S208 PolarHBondContact O-N 2.82Å; C204-S208 PolarHBondContact O-OG 3.33Å; C204-V258 VanDerWaalsContact SG-CG2 3.58Å
205L94.9Very high93.9Very high104 Ų10453.6 Ų53.655%0.54528%0.278SS..Hα-helixtrans-63-48.4174.9-71.8173.1000111.3V201 A202 P203 S208 I209V201-L205 HydrophobicContact CG1-CD1 4.02Å; V201-L205 WeakPolarHBondContact O-CB 3.38Å; V201-L205 WeakPolarHBondContact O-CG 3.32Å; V201-L205 PolarHBondContact O-N 3.39Å; A202-L205 PolarHBondContact O-N 3.24Å; P203-L205 VanDerWaalsContact C-N 3.3Å; P203-L205 PolarHBondContact O-N 3.11Å; L205-S208 PolarHBondContact O-N 2.64Å; L205-I209 VanDerWaalsContact O-CG1 3.27Å; L205-I209 WeakPolarHBondContact O-CG1 3.21Å; L205-I209 PolarHBondContact O-N 2.88Å
206I96.8Very high94.1Very high83 Ų8355.3 Ų55.343%0.42629%0.29SS..Hα-helixtrans-60.1-50.9178.5-64.5164.9000110.4T120 A202 P203 S208 I209 C210T120-I206 HydrophobicContact CG2-CB 4.2Å; T120-I206 HydrophobicContact CG2-CD1 4.38Å; T120-I206 HydrophobicContact CG2-CG2 3.7Å; A202-I206 WeakPolarHBondContact O-CG1 3.42Å; A202-I206 PolarHBondContact O-N 3.38Å; A202-I206 VanDerWaalsContact O-N 3.1Å; P203-I206 PolarHBondContact O-N 3.01Å; I206-S208 VanDerWaalsContact C-N 3.33Å; I206-S208 PolarHBondContact O-N 3.26Å; I206-I209 PolarHBondContact O-N 2.94Å; I206-C210 WeakPolarHBondContact O-CB 3.13Å; I206-C210 PolarHBondContact O-N 3.02Å; I206-C210 PolarHBondContact O-SG 3.25Å; I206-C210 VanDerWaalsContact O-SG 3.35Å
207I96.5Very high94.4Very high7 Ų754 Ų544%0.03629%0.287CS..Hα-helixtrans-59.3-44.9-179.8-69167000110.8A123 P203 C210 Y211 V254A123-I207 HydrophobicContact CB-CB 4.29Å; A123-I207 HydrophobicContact CB-CG1 4.02Å; A123-I207 HydrophobicContact CB-CG2 4.14Å; P203-I207 WeakPolarHBondContact O-CB 3.26Å; P203-I207 WeakPolarHBondContact O-CG1 3.48Å; P203-I207 PolarHBondContact O-N 2.83Å; I207-C210 PolarHBondContact O-N 3.26Å; I207-Y211 HydrophobicContact CG2-CD2 3.38Å; I207-Y211 HydrophobicContact CG2-CE2 3.32Å; I207-Y211 HydrophobicContact CG2-CG 4.46Å; I207-Y211 PolarHBondContact O-N 2.91Å; I207-V254 HydrophobicContact CD1-CG1 4.25Å; I207-V254 HydrophobicContact CD1-CG2 4.4Å; I207-V254 HydrophobicContact CG2-CG1 4.09Å; I207-V254 HydrophobicContact CG2-CG2 4.17Å
208S95.3Very high94.4Very high73 Ų7350.4 Ų50.451%0.5127%0.269SS..Hα-helixtrans-62.2-45.2-180-62.90000111.6C204 L205 I206 Y212C204-S208 WeakPolarHBondContact O-CB 3.46Å; C204-S208 PolarHBondContact O-N 2.82Å; C204-S208 PolarHBondContact O-OG 3.33Å; L205-S208 PolarHBondContact O-N 2.64Å; I206-S208 VanDerWaalsContact C-N 3.33Å; I206-S208 PolarHBondContact O-N 3.26Å; S208-Y212 WeakPolarHBondContact O-CB 3.09Å; S208-Y212 PolarHBondContact O-N 3.48Å
209I96.5Very high94.5Very high106 Ų10655.7 Ų55.754%0.54428%0.283SS..Hα-helixtrans-62-47.4176.7-67.3165.4000110.3L205 I206 Y212 R213L205-I209 VanDerWaalsContact O-CG1 3.27Å; L205-I209 WeakPolarHBondContact O-CG1 3.21Å; L205-I209 PolarHBondContact O-N 2.88Å; I206-I209 PolarHBondContact O-N 2.94Å; I209-Y212 PolarHBondContact O-N 2.94Å; I209-R213 VanDerWaalsContact O-CG 3.3Å; I209-R213 WeakPolarHBondContact O-CG 3.49Å; I209-R213 PolarHBondContact O-N 3.07Å
210C97.5Very high94.5Very high13 Ų1358.7 Ų58.79%0.08831%0.305CS..Hα-helixtrans-58.1-53.5178.4-74.70000111.6A123 I206 I207 Y212 R213 V214A123-C210 HydrophobicContact CB-CB 3.84Å; I206-C210 WeakPolarHBondContact O-CB 3.13Å; I206-C210 PolarHBondContact O-N 3.02Å; I206-C210 PolarHBondContact O-SG 3.25Å; I206-C210 VanDerWaalsContact O-SG 3.35Å; I207-C210 PolarHBondContact O-N 3.26Å; C210-Y212 PolarHBondContact O-N 2.7Å; C210-R213 PolarHBondContact O-N 3.44Å; C210-V214 VanDerWaalsContact O-CG2 3.26Å; C210-V214 WeakPolarHBondContact O-CG2 3.26Å; C210-V214 PolarHBondContact O-N 3.37Å
211Y95.9Very high94.5Very high10 Ų1062.1 Ų62.14%0.03932%0.318CS..Hα-helixtrans-70.4-30.9-177.8-72.8-35.7000113.6A123 R126 I207 S215 N247 L250 I251 V254A123-Y211 HydrophobicContact CB-CE1 3.99Å; A123-Y211 HydrophobicContact CB-CE2 4.12Å; R126-Y211 HydrophobicContact CB-CE1 4.47Å; R126-Y211 HydrophobicContact CG-CE1 4.43Å; I207-Y211 HydrophobicContact CG2-CD2 3.38Å; I207-Y211 HydrophobicContact CG2-CE2 3.32Å; I207-Y211 HydrophobicContact CG2-CG 4.46Å; I207-Y211 PolarHBondContact O-N 2.91Å; Y211-S215 VanDerWaalsContact O-CB 3.25Å; Y211-S215 WeakPolarHBondContact O-CB 3.27Å; Y211-S215 PolarHBondContact O-N 3.03Å; Y211-S215 PolarHBondContact O-OG 3.34Å; Y211-N247 WeakPolarHBondContact CD1-OD1 3.37Å; Y211-L250 HydrophobicContact CE1-CB 4.17Å; Y211-L250 HydrophobicContact CE1-CD1 4.4Å; Y211-L250 HydrophobicContact CE2-CB 4.44Å; Y211-L250 WeakPolarHBondContact OH-CB 3.21Å; Y211-I251 HydrophobicContact CD1-CG1 4.31Å; Y211-I251 HydrophobicContact CD2-CG1 3.53Å; Y211-I251 HydrophobicContact CE2-CG1 4.16Å; Y211-I251 HydrophobicContact CG-CD1 4.28Å; Y211-I251 HydrophobicContact CG-CG1 3.64Å; Y211-V254 HydrophobicContact CE2-CG2 4.27Å
212Y96Very high94.1Very high153 Ų15361.3 Ų61.360%0.632%0.322SS*.Hα-helixtrans-60-52.9170.9173.2-103.1000110.6S208 I209 C210 V214 S215 C216S208-Y212 WeakPolarHBondContact O-CB 3.09Å; S208-Y212 PolarHBondContact O-N 3.48Å; I209-Y212 PolarHBondContact O-N 2.94Å; C210-Y212 PolarHBondContact O-N 2.7Å; Y212-V214 PolarHBondContact O-N 3.47Å; Y212-S215 WeakPolarHBondContact O-CB 3.31Å; Y212-S215 PolarHBondContact O-N 3.5Å; Y212-S215 VanDerWaalsContact O-N 3.15Å; Y212-C216 PolarHBondContact O-N 3.28Å; Y212-C216 PolarHBondContact O-SG 3.37Å; Y212-C216 VanDerWaalsContact O-SG 3.33Å
213R97.2Very high93.3Very high140 Ų14064 Ų6453%0.52834%0.338SS..Hα-helixtrans-60.4-44.6178.5-69.5-65.9-147.1178.87112.3Y127 V131 I209 C210 S215 C216 V217Y127-R213 HydrophobicContact CD2-CB 3.88Å; Y127-R213 HydrophobicContact CE2-CB 3.69Å; Y127-R213 HydrophobicContact CE2-CG 3.97Å; V131-R213 HydrophobicContact CG2-CB 4.41Å; I209-R213 VanDerWaalsContact O-CG 3.3Å; I209-R213 WeakPolarHBondContact O-CG 3.49Å; I209-R213 PolarHBondContact O-N 3.07Å; C210-R213 PolarHBondContact O-N 3.44Å; R213-S215 VanDerWaalsContact C-N 3.32Å; R213-S215 PolarHBondContact O-N 2.91Å; R213-C216 PolarHBondContact O-N 3.49Å; R213-V217 WeakPolarHBondContact O-CG2 3.29Å; R213-V217 PolarHBondContact O-N 2.68Å
214V96.2Very high92.4Very high0 Ų067.1 Ų67.10%036%0.357CS..Hα-helixtrans-58.2-45.5175169.10000110.7R126 I130 V131 C210 Y212 C216 V217 L218 N247R126-V214 HydrophobicContact CB-CG2 4.34Å; I130-V214 HydrophobicContact CB-CG1 4.42Å; I130-V214 HydrophobicContact CD1-CG1 3.56Å; I130-V214 HydrophobicContact CG2-CG1 4.26Å; V131-V214 HydrophobicContact CG2-CG2 4.31Å; C210-V214 VanDerWaalsContact O-CG2 3.26Å; C210-V214 WeakPolarHBondContact O-CG2 3.26Å; C210-V214 PolarHBondContact O-N 3.37Å; Y212-V214 PolarHBondContact O-N 3.47Å; V214-C216 PolarHBondContact O-N 3.05Å; V214-V217 PolarHBondContact O-N 3.39Å; V214-L218 HydrophobicContact CG1-CD1 3.77Å; V214-L218 HydrophobicContact CG1-CG 4.29Å; V214-L218 WeakPolarHBondContact O-CB 3.36Å; V214-L218 VanDerWaalsContact O-CG 3.28Å; V214-L218 WeakPolarHBondContact O-CG 3.3Å; V214-L218 PolarHBondContact O-N 2.92Å; V214-N247 HydrophobicContact CG1-CB 4.39Å; V214-N247 VanDerWaalsContact CG1-OD1 3.27Å; V214-N247 WeakPolarHBondContact CG1-OD1 3.4Å
215S95.5Very high91.1Very high46 Ų4674.8 Ų74.832%0.32239%0.387SS..Hα-helixtrans-64-41.2179.3-58.70000112.2Y211 Y212 R213 L218 R219 N247Y211-S215 VanDerWaalsContact O-CB 3.25Å; Y211-S215 WeakPolarHBondContact O-CB 3.27Å; Y211-S215 PolarHBondContact O-N 3.03Å; Y211-S215 PolarHBondContact O-OG 3.34Å; Y212-S215 WeakPolarHBondContact O-CB 3.31Å; Y212-S215 PolarHBondContact O-N 3.5Å; Y212-S215 VanDerWaalsContact O-N 3.15Å; R213-S215 VanDerWaalsContact C-N 3.32Å; R213-S215 PolarHBondContact O-N 2.91Å; S215-L218 PolarHBondContact O-N 3.43Å; S215-R219 WeakPolarHBondContact O-CB 2.96Å; S215-R219 PolarHBondContact O-N 2.8Å; S215-N247 PolarHBondContact OG-ND2 2.88Å; S215-N247 VanDerWaalsContact OG-ND2 3.12Å
216C95.8Very high89.5Confident53 Ų5376.5 Ų76.536%0.35840%0.395SS..Hα-helixtrans-60.7-47.9174.6-69.40000112Y212 R213 V214 R219 S220Y212-C216 PolarHBondContact O-N 3.28Å; Y212-C216 PolarHBondContact O-SG 3.37Å; Y212-C216 VanDerWaalsContact O-SG 3.33Å; R213-C216 PolarHBondContact O-N 3.49Å; V214-C216 PolarHBondContact O-N 3.05Å; C216-R219 PolarHBondContact O-N 2.78Å; C216-S220 PolarHBondContact O-N 3.29Å
217V94.2Very high87.8Confident36 Ų3676.5 Ų76.522%0.21842%0.416CS..Hα-helixtrans-64.8-43.7179.21720000111.2I130 V131 R213 V214 R219 S220 R221I130-V217 HydrophobicContact CG2-CB 4.47Å; I130-V217 HydrophobicContact CG2-CG1 4.07Å; V131-V217 HydrophobicContact CB-CG2 4.48Å; V131-V217 HydrophobicContact CG1-CG2 4.25Å; V131-V217 HydrophobicContact CG2-CG2 4.02Å; R213-V217 WeakPolarHBondContact O-CG2 3.29Å; R213-V217 PolarHBondContact O-N 2.68Å; V214-V217 PolarHBondContact O-N 3.39Å; V217-R219 VanDerWaalsContact C-N 3.28Å; V217-R219 PolarHBondContact O-N 2.83Å; V217-S220 PolarHBondContact O-N 2.95Å; V217-R221 HydrophobicContact CG1-CG 4.4Å; V217-R221 WeakPolarHBondContact O-CG 3.41Å; V217-R221 PolarHBondContact O-N 2.83Å
218L93.2Very high86.3Confident4 Ų479.3 Ų79.32%0.02144%0.435CS..Hα-helixtrans-64.5-32176.6-70.9175.3000112.4I130 V214 S215 G222 N243 R244 N247I130-L218 HydrophobicContact CD1-CD1 4.38Å; I130-L218 HydrophobicContact CG2-CD2 3.9Å; I130-L218 HydrophobicContact CG2-CG 4.01Å; V214-L218 HydrophobicContact CG1-CD1 3.77Å; V214-L218 HydrophobicContact CG1-CG 4.29Å; V214-L218 WeakPolarHBondContact O-CB 3.36Å; V214-L218 VanDerWaalsContact O-CG 3.28Å; V214-L218 WeakPolarHBondContact O-CG 3.3Å; V214-L218 PolarHBondContact O-N 2.92Å; S215-L218 PolarHBondContact O-N 3.43Å; L218-G222 PolarHBondContact O-N 2.98Å; L218-N243 HydrophobicContact CD1-CB 4.31Å; L218-N243 HydrophobicContact CD2-CB 3.77Å; L218-R244 HydrophobicContact CB-CG 3.99Å; L218-R244 HydrophobicContact CD1-CG 4.02Å; L218-R244 HydrophobicContact CG-CG 4.47Å; L218-R244 PolarHBondContact O-NE 3.08Å; L218-R244 PolarHBondContact O-NH2 3.24Å; L218-N247 HydrophobicContact CD1-CB 4.23Å
219R92.4Very high85.2Confident190 Ų19078.3 Ų78.372%0.71744%0.437SS*.Hα-helixtrans-68.5-50.2173.4-172.1176-179.3179.7-0.2110.5S215 C216 V217 R221 G222 S223S215-R219 WeakPolarHBondContact O-CB 2.96Å; S215-R219 PolarHBondContact O-N 2.8Å; C216-R219 PolarHBondContact O-N 2.78Å; V217-R219 VanDerWaalsContact C-N 3.28Å; V217-R219 PolarHBondContact O-N 2.83Å; R219-R221 PolarHBondContact O-N 3.45Å; R219-G222 PolarHBondContact O-N 3.44Å; R219-G222 VanDerWaalsContact O-N 3.15Å; R219-S223 PolarHBondContact O-N 2.89Å; R219-S223 PolarHBondContact O-OG 2.89Å
220S90.7Very high84.2Confident71 Ų7182.8 Ų82.850%0.49745%0.446SS..Hα-helixtrans-57-50.1178.6179.90000112.2C216 V217 G222 S223 T224C216-S220 PolarHBondContact O-N 3.29Å; V217-S220 PolarHBondContact O-N 2.95Å; S220-G222 PolarHBondContact O-N 3.32Å; S220-S223 PolarHBondContact O-N 2.89Å; S220-T224 PolarHBondContact O-N 3.37Å; S220-T224 VanDerWaalsContact O-N 3.13Å; S220-T224 PolarHBondContact O-OG1 3.42Å; S220-T224 VanDerWaalsContact O-OG1 3.1Å
221R87.7Confident83.2Confident81 Ų8190.9 Ų90.931%0.30648%0.48SS..Hα-helixtrans-59.9-29177.5-71.6-173.9-179.5156.59.3114I130 V217 R219 I240I130-R221 VanDerWaalsContact O-CZ 3.25Å; I130-R221 PolarHBondContact O-NH1 3.23Å; I130-R221 VanDerWaalsContact O-NH1 3.11Å; I130-R221 PolarHBondContact O-NH2 2.87Å; V217-R221 HydrophobicContact CG1-CG 4.4Å; V217-R221 WeakPolarHBondContact O-CG 3.41Å; V217-R221 PolarHBondContact O-N 2.83Å; R219-R221 PolarHBondContact O-N 3.45Å; R221-I240 HydrophobicContact CB-CD1 3.86Å; R221-I240 HydrophobicContact CB-CG1 4.44Å
222G82.1Confident82.4Confident44 Ų4493.4 Ų93.445%0.45450%0.499SS..Hα-helixtrans-82.8-12.3175.700000114.4L218 R219 S220L218-G222 PolarHBondContact O-N 2.98Å; R219-G222 PolarHBondContact O-N 3.44Å; R219-G222 VanDerWaalsContact O-N 3.15Å; S220-G222 PolarHBondContact O-N 3.32Å
223S78.7Confident81.7Confident90 Ų9092 Ų9263%0.62949%0.493SS*.Hα-helixtrans-94.1-26.2175.9-67.30000112.3R219 S220 K225R219-S223 PolarHBondContact O-N 2.89Å; R219-S223 PolarHBondContact O-OG 2.89Å; S220-S223 PolarHBondContact O-N 2.89Å; S223-K225 PolarHBondContact O-N 3.37Å
224T74.1Confident81.2Confident73 Ų7390.5 Ų90.545%0.44849%0.492SS..  trans-81.3103.8-177.6-560000111.4S220 I226S220-T224 PolarHBondContact O-N 3.37Å; S220-T224 VanDerWaalsContact O-N 3.13Å; S220-T224 PolarHBondContact O-OG1 3.42Å; S220-T224 VanDerWaalsContact O-OG1 3.1Å; T224-I226 VanDerWaalsContact C-N 3.34Å; T224-I226 HydrophobicContact CG2-CB 4.16Å; T224-I226 HydrophobicContact CG2-CD1 3.19Å; T224-I226 HydrophobicContact CG2-CG1 3.42Å; T224-I226 VanDerWaalsContact CG2-CG1 3.42Å; T224-I226 PolarHBondContact O-N 3.16Å
225K66.2Low80.7Confident194 Ų19497.1 Ų97.184%0.84352%0.521SS*.  trans-90.138.1-177.8-64.1-176.5178.3178.30114.1S223 G227S223-K225 PolarHBondContact O-N 3.37Å; K225-G227 PolarHBondContact O-N 2.81Å
226I61.9Low80.2Confident140 Ų14099.2 Ų99.272%0.71853%0.525SS*.  trans-81.8114.4-166.2-61.1171.7000112.6T224 C228T224-I226 VanDerWaalsContact C-N 3.34Å; T224-I226 HydrophobicContact CG2-CB 4.16Å; T224-I226 HydrophobicContact CG2-CD1 3.19Å; T224-I226 HydrophobicContact CG2-CG1 3.42Å; T224-I226 VanDerWaalsContact CG2-CG1 3.42Å; T224-I226 PolarHBondContact O-N 3.16Å; I226-C228 PolarHBondContact O-N 2.88Å
227G60Low79.8Confident83 Ų83101.9 Ų101.986%0.85653%0.533SS*.SBendtrans69.3-4.4134.200000122.2K225K225-G227 PolarHBondContact O-N 2.81Å
228C64.8Low79.6Confident66 Ų66105.3 Ų105.345%0.44655%0.549SS..  trans-98.4147.8-177.3-147.50000113.2I226 S232I226-C228 PolarHBondContact O-N 2.88Å; C228-S232 VanDerWaalsContact SG-CB 3.51Å; C228-S232 PolarHBondContact SG-OG 3.38Å; C228-S232 VanDerWaalsContact SG-OG 3.36Å
229G72.1Confident79.3Confident52 Ų52108.9 Ų108.954%0.53657%0.566SS.*  trans-53.8148.1-179.700000113.1K231 S232 R233G229-K231 VanDerWaalsContact C-N 3.29Å; G229-K231 PolarHBondContact O-N 2.97Å; G229-S232 WeakPolarHBondContact O-CB 3.48Å; G229-S232 PolarHBondContact O-N 2.96Å; G229-R233 PolarHBondContact O-N 3.1Å; G229-R233 VanDerWaalsContact O-N 3.12Å
230R75.3Confident79.2Confident199 Ų199100.7 Ų100.775%0.75154%0.536SS*.Hα-helixtrans-46.9-44.4-169.4-179.5178.6162.3146.7-2.3114.4R233 E234R230-R233 PolarHBondContact O-N 3.41Å; R230-E234 PolarHBondContact O-N 3.45Å; R230-E234 VanDerWaalsContact O-N 3.11Å
231K76.4Confident79.2Confident184 Ų184102.8 Ų102.880%0.854%0.536SS*.Hα-helixtrans-66.7-39.3-179.9-70-173.1178.2179.80113.2G229 K235G229-K231 VanDerWaalsContact C-N 3.29Å; G229-K231 PolarHBondContact O-N 2.97Å; K231-K235 PolarHBondContact O-N 3.45Å
232S80.6Confident79.3Confident62 Ų62105.1 Ų105.143%0.43455%0.545SS..Hα-helixtrans-66.3-42.4177.7-168.90000110.6C228 G229 E234 K235 E236C228-S232 VanDerWaalsContact SG-CB 3.51Å; C228-S232 PolarHBondContact SG-OG 3.38Å; C228-S232 VanDerWaalsContact SG-OG 3.36Å; G229-S232 WeakPolarHBondContact O-CB 3.48Å; G229-S232 PolarHBondContact O-N 2.96Å; S232-E234 PolarHBondContact O-N 3.41Å; S232-K235 PolarHBondContact O-N 2.93Å; S232-E236 PolarHBondContact O-N 3.11Å
233R81.8Confident79.7Confident123 Ų123104.6 Ų104.646%0.46453%0.532SS..Hα-helixtrans-60.8-45177-168178.273.8-164.70.9112.8G229 R230 K235 E236 E237G229-R233 PolarHBondContact O-N 3.1Å; G229-R233 VanDerWaalsContact O-N 3.12Å; R230-R233 PolarHBondContact O-N 3.41Å; R233-K235 VanDerWaalsContact C-N 3.35Å; R233-K235 PolarHBondContact O-N 3.19Å; R233-E236 PolarHBondContact O-N 3.1Å; R233-E237 HydrophobicContact CG-CG 4.49Å; R233-E237 IonicContact NE-OE1 3.32Å; R233-E237 WeakPolarHBondContact O-CB 3.31Å; R233-E237 WeakPolarHBondContact O-CG 3.3Å; R233-E237 PolarHBondContact O-N 3.39Å
234E84.9Confident80.3Confident110 Ų110104.9 Ų104.951%0.51452%0.519SS..Hα-helixtrans-62.6-42.1178.2-174.5175-175.800111.9R230 S232 E237 L238R230-E234 PolarHBondContact O-N 3.45Å; R230-E234 VanDerWaalsContact O-N 3.11Å; S232-E234 PolarHBondContact O-N 3.41Å; E234-E237 PolarHBondContact O-N 3.41Å; E234-L238 HydrophobicContact CG-CD1 4.36Å; E234-L238 WeakPolarHBondContact O-CB 3.41Å; E234-L238 VanDerWaalsContact O-CG 3.26Å; E234-L238 WeakPolarHBondContact O-CG 3.38Å; E234-L238 PolarHBondContact O-N 2.94Å
235K85.8Confident81.1Confident138 Ų138106 Ų10660%0.652%0.515SS*.Hα-helixtrans-62.2-45.2175.2-174-178.3176.1-174.90111.5K231 S232 R233 L238 E239K231-K235 PolarHBondContact O-N 3.45Å; S232-K235 PolarHBondContact O-N 2.93Å; R233-K235 VanDerWaalsContact C-N 3.35Å; R233-K235 PolarHBondContact O-N 3.19Å; K235-L238 PolarHBondContact O-N 3.16Å; K235-E239 WeakPolarHBondContact CE-OE1 3.45Å; K235-E239 WeakPolarHBondContact O-CG 3.46Å; K235-E239 PolarHBondContact O-N 3.46Å
236E86.1Confident82.3Confident90 Ų9097.8 Ų97.842%0.42148%0.481SS..Hα-helixtrans-63-44.3177.9-174.8177-174.100112S232 R233 L238 E239 I240S232-E236 PolarHBondContact O-N 3.11Å; R233-E236 PolarHBondContact O-N 3.1Å; E236-L238 VanDerWaalsContact C-N 3.33Å; E236-L238 PolarHBondContact O-N 2.67Å; E236-E239 PolarHBondContact O-N 3.46Å; E236-I240 HydrophobicContact CG-CD1 3.98Å; E236-I240 HydrophobicContact CG-CG1 4.48Å; E236-I240 WeakPolarHBondContact O-CG1 3.5Å; E236-I240 PolarHBondContact O-N 2.88Å
237E87.8Confident83.7Confident110 Ų11091.4 Ų91.451%0.51445%0.448SS..Hα-helixtrans-60.5-42176.1-75.7177.5-16500111.9R233 E234 I240 K241R233-E237 HydrophobicContact CG-CG 4.49Å; R233-E237 IonicContact NE-OE1 3.32Å; R233-E237 WeakPolarHBondContact O-CB 3.31Å; R233-E237 WeakPolarHBondContact O-CG 3.3Å; R233-E237 PolarHBondContact O-N 3.39Å; E234-E237 PolarHBondContact O-N 3.41Å; E237-I240 PolarHBondContact O-N 2.92Å; E237-K241 WeakPolarHBondContact O-CB 3.36Å; E237-K241 PolarHBondContact O-N 2.85Å
238L88.3Confident85.2Confident108 Ų10893 Ų9357%0.56543%0.434SS*.Hα-helixtrans-63.2-42.1174.4-72.4171.5000111.8E234 K235 E236 K241 R242E234-L238 HydrophobicContact CG-CD1 4.36Å; E234-L238 WeakPolarHBondContact O-CB 3.41Å; E234-L238 VanDerWaalsContact O-CG 3.26Å; E234-L238 WeakPolarHBondContact O-CG 3.38Å; E234-L238 PolarHBondContact O-N 2.94Å; K235-L238 PolarHBondContact O-N 3.16Å; E236-L238 VanDerWaalsContact C-N 3.33Å; E236-L238 PolarHBondContact O-N 2.67Å; L238-K241 PolarHBondContact O-N 2.94Å; L238-R242 WeakPolarHBondContact O-CB 3.5Å; L238-R242 PolarHBondContact O-N 3.49Å
239E88.7Confident86.6Confident79 Ų7989.9 Ų89.937%0.36941%0.413SS..Hα-helixtrans-64.8-43.5176.1-75.4-175.1-17000112.3K235 E236 R242 N243K235-E239 WeakPolarHBondContact CE-OE1 3.45Å; K235-E239 WeakPolarHBondContact O-CG 3.46Å; K235-E239 PolarHBondContact O-N 3.46Å; E236-E239 PolarHBondContact O-N 3.46Å; E239-R242 PolarHBondContact O-N 3.4Å; E239-N243 WeakPolarHBondContact O-CB 3.26Å; E239-N243 VanDerWaalsContact O-CG 3.22Å; E239-N243 PolarHBondContact O-N 3.48Å; E239-N243 PolarHBondContact O-ND2 2.76Å
240I89.7Confident87.5Confident17 Ų1787.5 Ų87.59%0.08739%0.388CS..Hα-helixtrans-61.4-46.3175.2-68.9166.6000110.1R221 E236 E237 R242 N243 R244R221-I240 HydrophobicContact CB-CD1 3.86Å; R221-I240 HydrophobicContact CB-CG1 4.44Å; E236-I240 HydrophobicContact CG-CD1 3.98Å; E236-I240 HydrophobicContact CG-CG1 4.48Å; E236-I240 WeakPolarHBondContact O-CG1 3.5Å; E236-I240 PolarHBondContact O-N 2.88Å; E237-I240 PolarHBondContact O-N 2.92Å; I240-R242 VanDerWaalsContact C-N 3.32Å; I240-R242 PolarHBondContact O-N 2.9Å; I240-N243 PolarHBondContact O-N 2.97Å; I240-R244 HydrophobicContact CG2-CG 4.44Å; I240-R244 WeakPolarHBondContact O-CG 3.24Å; I240-R244 PolarHBondContact O-N 3.48Å
241K90.3Very high88.4Confident116 Ų11680.3 Ų80.350%0.50436%0.364SS..Hα-helixtrans-61.3-41.2177.9-173.4176.1-177.4175.50111.5E237 L238 R245E237-K241 WeakPolarHBondContact O-CB 3.36Å; E237-K241 PolarHBondContact O-N 2.85Å; L238-K241 PolarHBondContact O-N 2.94Å; K241-R245 WeakPolarHBondContact O-CG 3.49Å; K241-R245 PolarHBondContact O-N 2.85Å; K241-R245 VanDerWaalsContact O-N 3.14Å
242R89.6Confident89.2Confident129 Ų12972.8 Ų72.849%0.48734%0.336SS..Hα-helixtrans-61.8-50.5174.1-176.9-178.166.5176.9-3.9111L238 E239 I240 R244 R245 T246L238-R242 WeakPolarHBondContact O-CB 3.5Å; L238-R242 PolarHBondContact O-N 3.49Å; E239-R242 PolarHBondContact O-N 3.4Å; I240-R242 VanDerWaalsContact C-N 3.32Å; I240-R242 PolarHBondContact O-N 2.9Å; R242-R244 VanDerWaalsContact C-N 3.31Å; R242-R244 PolarHBondContact O-N 2.94Å; R242-R245 PolarHBondContact O-N 3.37Å; R242-T246 PolarHBondContact O-N 3.47Å; R242-T246 PolarHBondContact O-OG1 3.43Å
243N90.7Very high89.8Confident34 Ų3470.1 Ų70.118%0.18232%0.317CS..Hα-helixtrans-61.6-38.2-179.3-70.4-15.9000112.1L218 E239 I240 T246 N247L218-N243 HydrophobicContact CD1-CB 4.31Å; L218-N243 HydrophobicContact CD2-CB 3.77Å; E239-N243 WeakPolarHBondContact O-CB 3.26Å; E239-N243 VanDerWaalsContact O-CG 3.22Å; E239-N243 PolarHBondContact O-N 3.48Å; E239-N243 PolarHBondContact O-ND2 2.76Å; I240-N243 PolarHBondContact O-N 2.97Å; N243-T246 PolarHBondContact O-N 3.26Å; N243-N247 VanDerWaalsContact O-CB 3.26Å; N243-N247 WeakPolarHBondContact O-CB 3.46Å; N243-N247 PolarHBondContact O-N 3.28Å
244R91.7Very high90.2Very high95 Ų9565.1 Ų65.136%0.35830%0.3SS..Hα-helixtrans-61.4-47173.8-74.8178.4-176.7-1752.2112.1L218 I240 R242 N247 Q248L218-R244 HydrophobicContact CB-CG 3.99Å; L218-R244 HydrophobicContact CD1-CG 4.02Å; L218-R244 HydrophobicContact CG-CG 4.47Å; L218-R244 PolarHBondContact O-NE 3.08Å; L218-R244 PolarHBondContact O-NH2 3.24Å; I240-R244 HydrophobicContact CG2-CG 4.44Å; I240-R244 WeakPolarHBondContact O-CG 3.24Å; I240-R244 PolarHBondContact O-N 3.48Å; R242-R244 VanDerWaalsContact C-N 3.31Å; R242-R244 PolarHBondContact O-N 2.94Å; R244-N247 PolarHBondContact O-N 3.36Å; R244-Q248 WeakPolarHBondContact O-CB 3.33Å; R244-Q248 VanDerWaalsContact O-CG 3.31Å; R244-Q248 WeakPolarHBondContact O-CG 3.43Å; R244-Q248 PolarHBondContact O-N 3.01Å
245R91.1Very high90.7Very high96 Ų9664.5 Ų64.536%0.36230%0.299SS..Hα-helixtrans-62.4-45.2177.9-72.7177.9176.4-167.5-3.9112K241 R242 N247 Q248 M249K241-R245 WeakPolarHBondContact O-CG 3.49Å; K241-R245 PolarHBondContact O-N 2.85Å; K241-R245 VanDerWaalsContact O-N 3.14Å; R242-R245 PolarHBondContact O-N 3.37Å; R245-N247 VanDerWaalsContact C-N 3.34Å; R245-N247 PolarHBondContact O-N 2.97Å; R245-Q248 PolarHBondContact O-N 2.9Å; R245-M249 WeakPolarHBondContact O-CB 3.35Å; R245-M249 PolarHBondContact O-N 3.28Å
246T90.5Very high91.1Very high22 Ų2260.1 Ų60.114%0.13528%0.282CS..Hα-helixtrans-60.8-44.7175.3-56.60000110.9R242 N243 M249 L250R242-T246 PolarHBondContact O-N 3.47Å; R242-T246 PolarHBondContact O-OG1 3.43Å; N243-T246 PolarHBondContact O-N 3.26Å; T246-M249 HydrophobicContact CG2-CE 4.38Å; T246-M249 WeakPolarHBondContact O-CB 3.22Å; T246-M249 PolarHBondContact O-N 3.2Å; T246-L250 HydrophobicContact CG2-CD1 4.05Å; T246-L250 HydrophobicContact CG2-CG 4.44Å; T246-L250 VanDerWaalsContact O-CG 3.24Å; T246-L250 WeakPolarHBondContact O-CG 3.48Å; T246-L250 PolarHBondContact O-N 3.38Å
247N92Very high91.4Very high6 Ų656.7 Ų56.73%0.03227%0.265CS..Hα-helixtrans-63.2-42.8177.9-16968.8000112.3Y211 V214 S215 L218 N243 R244 R245 M249 L250 I251Y211-N247 WeakPolarHBondContact CD1-OD1 3.37Å; V214-N247 HydrophobicContact CG1-CB 4.39Å; V214-N247 VanDerWaalsContact CG1-OD1 3.27Å; V214-N247 WeakPolarHBondContact CG1-OD1 3.4Å; S215-N247 PolarHBondContact OG-ND2 2.88Å; S215-N247 VanDerWaalsContact OG-ND2 3.12Å; L218-N247 HydrophobicContact CD1-CB 4.23Å; N243-N247 VanDerWaalsContact O-CB 3.26Å; N243-N247 WeakPolarHBondContact O-CB 3.46Å; N243-N247 PolarHBondContact O-N 3.28Å; R244-N247 PolarHBondContact O-N 3.36Å; R245-N247 VanDerWaalsContact C-N 3.34Å; R245-N247 PolarHBondContact O-N 2.97Å; N247-M249 PolarHBondContact O-N 3.3Å; N247-L250 PolarHBondContact O-N 2.95Å; N247-I251 WeakPolarHBondContact ND2-CD1 3.42Å; N247-I251 VanDerWaalsContact O-CG1 3.28Å; N247-I251 WeakPolarHBondContact O-CG1 3.37Å; N247-I251 PolarHBondContact O-N 3.41Å
248Q91.9Very high91.6Very high118 Ų11852.8 Ų52.855%0.55125%0.249SC*.Hα-helixtrans-60.5-43.8175-76.1173.3-31.100112.2R244 R245 I251 A252R244-Q248 WeakPolarHBondContact O-CB 3.33Å; R244-Q248 VanDerWaalsContact O-CG 3.31Å; R244-Q248 WeakPolarHBondContact O-CG 3.43Å; R244-Q248 PolarHBondContact O-N 3.01Å; R245-Q248 PolarHBondContact O-N 2.9Å; Q248-I251 PolarHBondContact O-N 2.9Å; Q248-A252 WeakPolarHBondContact O-CB 3.22Å; Q248-A252 PolarHBondContact O-N 3.11Å
249M92.4Very high91.9Very high0 Ų052 Ų520%025%0.248CC..Hα-helixtrans-59.6-47.1175.3-179.3-170.178.700111.7I67 R245 T246 N247 A252 M253 L305 Y306 L309 N310I67-M249 HydrophobicContact CD1-CE 4.42Å; R245-M249 WeakPolarHBondContact O-CB 3.35Å; R245-M249 PolarHBondContact O-N 3.28Å; T246-M249 HydrophobicContact CG2-CE 4.38Å; T246-M249 WeakPolarHBondContact O-CB 3.22Å; T246-M249 PolarHBondContact O-N 3.2Å; N247-M249 PolarHBondContact O-N 3.3Å; M249-A252 PolarHBondContact O-N 3.46Å; M249-M253 HydrophobicContact CG-SD 4.43Å; M249-M253 WeakPolarHBondContact O-CG 3.23Å; M249-M253 PolarHBondContact O-N 2.96Å; M249-L305 HydrophobicContact CG-CB 4.32Å; M249-Y306 HydrophobicContact CE-CD1 3.76Å; M249-Y306 HydrophobicContact CE-CE1 3.98Å; M249-Y306 HydrophobicContact CG-CD1 4.46Å; M249-Y306 HydrophobicContact SD-CD1 3.62Å; M249-Y306 HydrophobicContact SD-CE1 4.32Å; M249-L309 HydrophobicContact CB-CB 3.78Å; M249-L309 HydrophobicContact CB-CD1 3.79Å; M249-L309 HydrophobicContact CB-CG 4.45Å; M249-L309 HydrophobicContact CG-CB 3.95Å; M249-L309 HydrophobicContact CG-CD1 4.11Å; M249-L309 HydrophobicContact SD-CB 4.26Å; M249-N310 HydrophobicContact CE-CB 4.47Å; M249-N310 HydrophobicContact SD-CB 3.69Å
250L91.7Very high92.2Very high2 Ų248.6 Ų48.61%0.0123%0.233CC..Hα-helixtrans-65.7-39.2-179.9-68.7172.4000112.5I122 R126 Y211 T246 N247 M253 V254I122-L250 HydrophobicContact CG2-CD1 3.65Å; I122-L250 HydrophobicContact CG2-CD2 3.73Å; I122-L250 HydrophobicContact CG2-CG 4.27Å; R126-L250 HydrophobicContact CG-CD1 3.74Å; Y211-L250 HydrophobicContact CE1-CB 4.17Å; Y211-L250 HydrophobicContact CE1-CD1 4.4Å; Y211-L250 HydrophobicContact CE2-CB 4.44Å; Y211-L250 WeakPolarHBondContact OH-CB 3.21Å; T246-L250 HydrophobicContact CG2-CD1 4.05Å; T246-L250 HydrophobicContact CG2-CG 4.44Å; T246-L250 VanDerWaalsContact O-CG 3.24Å; T246-L250 WeakPolarHBondContact O-CG 3.48Å; T246-L250 PolarHBondContact O-N 3.38Å; N247-L250 PolarHBondContact O-N 2.95Å; L250-M253 HydrophobicContact CD2-SD 4.02Å; L250-V254 WeakPolarHBondContact O-CG2 3.48Å; L250-V254 PolarHBondContact O-N 2.88Å
251I94Very high92.4Very high48 Ų4848.2 Ų48.225%0.24623%0.231CC..Hα-helixtrans-61.8-47172.3-69.2164.8000110.2Y211 N247 Q248 M253 V254 I255Y211-I251 HydrophobicContact CD1-CG1 4.31Å; Y211-I251 HydrophobicContact CD2-CG1 3.53Å; Y211-I251 HydrophobicContact CE2-CG1 4.16Å; Y211-I251 HydrophobicContact CG-CD1 4.28Å; Y211-I251 HydrophobicContact CG-CG1 3.64Å; N247-I251 WeakPolarHBondContact ND2-CD1 3.42Å; N247-I251 VanDerWaalsContact O-CG1 3.28Å; N247-I251 WeakPolarHBondContact O-CG1 3.37Å; N247-I251 PolarHBondContact O-N 3.41Å; Q248-I251 PolarHBondContact O-N 2.9Å; I251-M253 VanDerWaalsContact C-N 3.33Å; I251-M253 PolarHBondContact O-N 3.36Å; I251-V254 PolarHBondContact O-N 3.48Å; I251-I255 HydrophobicContact CG2-CD1 3.67Å; I251-I255 HydrophobicContact CG2-CG1 4.31Å; I251-I255 WeakPolarHBondContact O-CG1 3.35Å; I251-I255 PolarHBondContact O-N 3.31Å
252A94.3Very high92.4Very high26 Ų2646.2 Ų46.222%0.21523%0.225CC..Hα-helixtrans-60-42.8-179.800000112Q248 M249 V254 I255 I256 L305Q248-A252 WeakPolarHBondContact O-CB 3.22Å; Q248-A252 PolarHBondContact O-N 3.11Å; M249-A252 PolarHBondContact O-N 3.46Å; A252-V254 VanDerWaalsContact C-N 3.34Å; A252-V254 PolarHBondContact O-N 2.86Å; A252-I255 PolarHBondContact O-N 3.48Å; A252-I256 WeakPolarHBondContact O-CB 3.45Å; A252-I256 WeakPolarHBondContact O-CG1 3.36Å; A252-I256 PolarHBondContact O-N 2.94Å; A252-L305 HydrophobicContact CB-CD2 4.29Å
253M91.7Very high92.6Very high6 Ų642 Ų423%0.0321%0.214CC..Hα-helixtrans-57.3-46175.4-70.7165.85400112.2L70 M249 L250 I251 I256 F257 L305 Y306L70-M253 HydrophobicContact CD2-CE 3.43Å; L70-M253 VanDerWaalsContact CD2-CE 3.43Å; M249-M253 HydrophobicContact CG-SD 4.43Å; M249-M253 WeakPolarHBondContact O-CG 3.23Å; M249-M253 PolarHBondContact O-N 2.96Å; L250-M253 HydrophobicContact CD2-SD 4.02Å; I251-M253 VanDerWaalsContact C-N 3.33Å; I251-M253 PolarHBondContact O-N 3.36Å; M253-I256 PolarHBondContact O-N 3.48Å; M253-F257 WeakPolarHBondContact O-CB 3.41Å; M253-F257 PolarHBondContact O-N 3.49Å; M253-L305 HydrophobicContact CB-CD1 4.23Å; M253-L305 HydrophobicContact CG-CB 4.39Å; M253-L305 HydrophobicContact CG-CD1 3.51Å; M253-Y306 HydrophobicContact CE-CE1 3.91Å; M253-Y306 WeakPolarHBondContact CE-OH 3.29Å; M253-Y306 HydrophobicContact SD-CD1 4.31Å; M253-Y306 HydrophobicContact SD-CE1 3.33Å; M253-Y306 WeakPolarHBondContact SD-CE1 3.18Å
254V91.9Very high92.7Very high18 Ų1840.8 Ų40.811%0.10921%0.208CC..Hα-helixtrans-66.4-43.3-179.8174.20000111.2I207 Y211 L250 I251 A252 I256 F257 V258I207-V254 HydrophobicContact CD1-CG1 4.25Å; I207-V254 HydrophobicContact CD1-CG2 4.4Å; I207-V254 HydrophobicContact CG2-CG1 4.09Å; I207-V254 HydrophobicContact CG2-CG2 4.17Å; Y211-V254 HydrophobicContact CE2-CG2 4.27Å; L250-V254 WeakPolarHBondContact O-CG2 3.48Å; L250-V254 PolarHBondContact O-N 2.88Å; I251-V254 PolarHBondContact O-N 3.48Å; A252-V254 VanDerWaalsContact C-N 3.34Å; A252-V254 PolarHBondContact O-N 2.86Å; V254-I256 VanDerWaalsContact C-N 3.35Å; V254-I256 PolarHBondContact O-N 3.24Å; V254-F257 PolarHBondContact O-N 3.02Å; V254-V258 HydrophobicContact CG1-CG2 4.29Å; V254-V258 WeakPolarHBondContact O-CB 3.06Å; V254-V258 VanDerWaalsContact O-CG2 3.28Å; V254-V258 WeakPolarHBondContact O-CG2 3.1Å; V254-V258 PolarHBondContact O-N 3.33Å
255I94.3Very high92.6Very high96 Ų9637.3 Ų37.349%0.49220%0.196SC..Hα-helixtrans-59.8-48177.3-68.7170.8000110.3I251 A252 F257 V258 V259I251-I255 HydrophobicContact CG2-CD1 3.67Å; I251-I255 HydrophobicContact CG2-CG1 4.31Å; I251-I255 WeakPolarHBondContact O-CG1 3.35Å; I251-I255 PolarHBondContact O-N 3.31Å; A252-I255 PolarHBondContact O-N 3.48Å; I255-F257 PolarHBondContact O-N 3.17Å; I255-V258 PolarHBondContact O-N 3.45Å; I255-V259 HydrophobicContact CG2-CG2 4.23Å; I255-V259 WeakPolarHBondContact O-CB 3.47Å; I255-V259 VanDerWaalsContact O-CG2 3.27Å; I255-V259 WeakPolarHBondContact O-CG2 3.36Å; I255-V259 PolarHBondContact O-N 2.94Å
256I94.7Very high92.5Very high47 Ų4736.1 Ų36.124%0.24120%0.199CC..Hα-helixtrans-61.1-47.1179.7-74.7163.5000110.6A252 M253 V254 V258 V259 C260 Y301 L305A252-I256 WeakPolarHBondContact O-CB 3.45Å; A252-I256 WeakPolarHBondContact O-CG1 3.36Å; A252-I256 PolarHBondContact O-N 2.94Å; M253-I256 PolarHBondContact O-N 3.48Å; V254-I256 VanDerWaalsContact C-N 3.35Å; V254-I256 PolarHBondContact O-N 3.24Å; I256-V258 PolarHBondContact O-N 3.32Å; I256-V259 PolarHBondContact O-N 2.88Å; I256-C260 VanDerWaalsContact O-CB 3.28Å; I256-C260 WeakPolarHBondContact O-CB 3.39Å; I256-C260 PolarHBondContact O-N 3.49Å; I256-C260 PolarHBondContact O-SG 3.47Å; I256-Y301 HydrophobicContact CG2-CD2 3.28Å; I256-Y301 HydrophobicContact CG2-CE2 4.04Å; I256-Y301 HydrophobicContact CG2-CG 3.91Å; I256-L305 HydrophobicContact CD1-CD1 3.74Å; I256-L305 HydrophobicContact CD1-CD2 4.25Å; I256-L305 HydrophobicContact CD1-CG 4.44Å
257F92Very high92.4Very high18 Ų1836 Ų368%0.07920%0.197CC..Hα-helixtrans-56.9-50.5176178.8-97.7000111.7V112 T116 M253 V254 I255 V259 C260 W261V112-F257 HydrophobicContact CG1-CE1 4.48Å; V112-F257 HydrophobicContact CG1-CZ 3.77Å; T116-F257 WeakPolarHBondContact OG1-CE1 3.22Å; M253-F257 WeakPolarHBondContact O-CB 3.41Å; M253-F257 PolarHBondContact O-N 3.49Å; V254-F257 PolarHBondContact O-N 3.02Å; I255-F257 PolarHBondContact O-N 3.17Å; F257-V259 PolarHBondContact O-N 3.34Å; F257-C260 PolarHBondContact O-N 2.88Å; F257-W261 AromaticContact CD2-CD1 3.61Å; F257-W261 AromaticContact CD2-NE1 3.68Å; F257-W261 AromaticContact CE2-CD1 3.62Å; F257-W261 HydrophobicContact CE2-CG 4.4Å; F257-W261 AromaticContact CE2-NE1 3.45Å; F257-W261 WeakPolarHBondContact O-CB 3.38Å; F257-W261 PolarHBondContact O-N 3.1Å
258V92.2Very high92.1Very high28 Ų2839.9 Ų39.917%0.1721%0.212CC..Hα-helixtrans-61.1-47.8179.81710000111.5C204 V254 I255 I256 C260 W261 I262C204-V258 VanDerWaalsContact SG-CG2 3.58Å; V254-V258 HydrophobicContact CG1-CG2 4.29Å; V254-V258 WeakPolarHBondContact O-CB 3.06Å; V254-V258 VanDerWaalsContact O-CG2 3.28Å; V254-V258 WeakPolarHBondContact O-CG2 3.1Å; V254-V258 PolarHBondContact O-N 3.33Å; I255-V258 PolarHBondContact O-N 3.45Å; I256-V258 PolarHBondContact O-N 3.32Å; V258-C260 VanDerWaalsContact C-N 3.33Å; V258-C260 PolarHBondContact O-N 3.44Å; V258-W261 PolarHBondContact O-N 2.97Å; V258-I262 HydrophobicContact CG1-CD1 3.48Å; V258-I262 VanDerWaalsContact CG1-CD1 3.48Å; V258-I262 HydrophobicContact CG1-CG1 4.05Å; V258-I262 WeakPolarHBondContact O-CB 3.15Å; V258-I262 WeakPolarHBondContact O-CG1 3.35Å; V258-I262 PolarHBondContact O-N 3.27Å
259V94.7Very high91.7Very high90 Ų9036.6 Ų36.655%0.54520%0.197SC..Hα-helixtrans-62.3-40.1179.6170.20000111.7I255 I256 F257 P263I255-V259 HydrophobicContact CG2-CG2 4.23Å; I255-V259 WeakPolarHBondContact O-CB 3.47Å; I255-V259 VanDerWaalsContact O-CG2 3.27Å; I255-V259 WeakPolarHBondContact O-CG2 3.36Å; I255-V259 PolarHBondContact O-N 2.94Å; I256-V259 PolarHBondContact O-N 2.88Å; F257-V259 PolarHBondContact O-N 3.34Å; V259-P263 WeakPolarHBondContact O-CD 3.32Å
260C95.4Very high91.4Very high9 Ų939.5 Ų39.56%0.06122%0.215CC..Hα-helixtrans-67.7-35.8178.7-75.60000112.8I256 F257 V258 I294 A295I256-C260 VanDerWaalsContact O-CB 3.28Å; I256-C260 WeakPolarHBondContact O-CB 3.39Å; I256-C260 PolarHBondContact O-N 3.49Å; I256-C260 PolarHBondContact O-SG 3.47Å; F257-C260 PolarHBondContact O-N 2.88Å; V258-C260 VanDerWaalsContact C-N 3.33Å; V258-C260 PolarHBondContact O-N 3.44Å; C260-I294 HydrophobicContact CB-CG2 4.31Å; C260-I294 WeakPolarHBondContact CB-O 3.22Å; C260-A295 WeakPolarHBondContact O-CA 3.31Å; C260-A295 PolarHBondContact O-N 3.1Å
261W93.4Very high90.9Very high9 Ų939.5 Ų39.53%0.03422%0.215CC..Hα-helixtrans-91.2-23.7-174.4-78.885.2000114.2M77 V112 F200 F257 V258 L264 N265 A295 M296 S298M77-W261 HydrophobicContact CE-CZ2 4.02Å; M77-W261 HydrophobicContact SD-CH2 4Å; M77-W261 HydrophobicContact SD-CZ2 3.65Å; V112-W261 HydrophobicContact CB-CZ3 4.5Å; V112-W261 HydrophobicContact CG1-CD2 4.32Å; V112-W261 HydrophobicContact CG1-CE3 4.24Å; V112-W261 HydrophobicContact CG2-CD2 4.11Å; V112-W261 HydrophobicContact CG2-CE3 3.71Å; V112-W261 HydrophobicContact CG2-CH2 3.08Å; V112-W261 HydrophobicContact CG2-CZ2 3.52Å; V112-W261 HydrophobicContact CG2-CZ3 3.19Å; F200-W261 HydrophobicContact CE1-CB 3.83Å; F200-W261 HydrophobicContact CZ-CB 3.78Å; F257-W261 AromaticContact CD2-CD1 3.61Å; F257-W261 AromaticContact CD2-NE1 3.68Å; F257-W261 AromaticContact CE2-CD1 3.62Å; F257-W261 HydrophobicContact CE2-CG 4.4Å; F257-W261 AromaticContact CE2-NE1 3.45Å; F257-W261 WeakPolarHBondContact O-CB 3.38Å; F257-W261 PolarHBondContact O-N 3.1Å; V258-W261 PolarHBondContact O-N 2.97Å; W261-L264 HydrophobicContact CE3-CD2 4.4Å; W261-L264 HydrophobicContact CZ3-CD2 4.09Å; W261-L264 PolarHBondContact O-N 3.34Å; W261-N265 PolarHBondContact O-N 2.62Å; W261-N265 PolarHBondContact O-ND2 3.06Å; W261-A295 HydrophobicContact CD2-CB 3.99Å; W261-A295 HydrophobicContact CE3-CB 4.07Å; W261-A295 HydrophobicContact CG-CB 4.45Å; W261-A295 HydrophobicContact CH2-CB 4.38Å; W261-A295 HydrophobicContact CZ2-CB 4.3Å; W261-A295 HydrophobicContact CZ3-CB 4.26Å; W261-M296 HydrophobicContact CH2-CE 3.64Å; W261-M296 HydrophobicContact CZ2-CE 3.89Å; W261-S298 PolarHBondContact NE1-OG 3.16Å
262I91.4Very high90.2Very high74 Ų7439 Ų3938%0.37921%0.213SC..Hα-helixtrans-52.1-50.2178.2-82166.2000112.7V258 L264 N265 V266V258-I262 HydrophobicContact CG1-CD1 3.48Å; V258-I262 VanDerWaalsContact CG1-CD1 3.48Å; V258-I262 HydrophobicContact CG1-CG1 4.05Å; V258-I262 WeakPolarHBondContact O-CB 3.15Å; V258-I262 WeakPolarHBondContact O-CG1 3.35Å; V258-I262 PolarHBondContact O-N 3.27Å; I262-L264 VanDerWaalsContact C-N 3.31Å; I262-L264 PolarHBondContact O-N 3.1Å; I262-N265 PolarHBondContact O-N 2.82Å; I262-N265 VanDerWaalsContact O-N 3.13Å; I262-V266 HydrophobicContact CG2-CG2 3.94Å; I262-V266 WeakPolarHBondContact O-CG2 3.29Å; I262-V266 PolarHBondContact O-N 3.38Å
263P93.3Very high89.6Confident41 Ų4144 Ų4427%0.26624%0.235SC..Hα-helixtrans-57.2-43.3-175.3-27.235000113.1V259 L267 C291V259-P263 WeakPolarHBondContact O-CD 3.32Å; P263-L267 WeakPolarHBondContact O-CB 3.28Å; P263-L267 PolarHBondContact O-N 3.05Å; P263-C291 HydrophobicContact CB-CB 4.18Å
264L91.4Very high88.9Confident8 Ų849.1 Ų49.14%0.04226%0.261CS..Hα-helixtrans-67.3-40178.9-17563.6000111.9W261 I262 L267 W268 F288 C291 H292 A295W261-L264 HydrophobicContact CE3-CD2 4.4Å; W261-L264 HydrophobicContact CZ3-CD2 4.09Å; W261-L264 PolarHBondContact O-N 3.34Å; I262-L264 VanDerWaalsContact C-N 3.31Å; I262-L264 PolarHBondContact O-N 3.1Å; L264-L267 WeakPolarHBondContact O-CB 3.46Å; L264-L267 PolarHBondContact O-N 3.38Å; L264-W268 PolarHBondContact O-N 3.43Å; L264-F288 HydrophobicContact CD1-CD2 4.01Å; L264-F288 HydrophobicContact CD1-CE2 3.76Å; L264-C291 HydrophobicContact CB-CB 4.19Å; L264-C291 HydrophobicContact CD1-CB 4.19Å; L264-H292 HydrophobicContact CD1-CB 4.39Å; L264-A295 HydrophobicContact CB-CB 4.41Å; L264-A295 HydrophobicContact CD2-CB 3.99Å
265N89.7Confident87.7Confident22 Ų2249.7 Ų49.712%0.11827%0.271CS..Hα-helixtrans-70.6-40.3179-76.8-88.7000112.2F196 F200 W261 I262 L267 W268 I269F196-N265 HydrophobicContact CD2-CB 4.3Å; F196-N265 HydrophobicContact CE2-CB 4.46Å; F200-N265 HydrophobicContact CE2-CB 4.16Å; F200-N265 VanDerWaalsContact CE2-ND2 3.35Å; F200-N265 WeakPolarHBondContact CE2-ND2 3.44Å; F200-N265 VanDerWaalsContact CE2-OD1 3.3Å; F200-N265 WeakPolarHBondContact CE2-OD1 3.21Å; F200-N265 WeakPolarHBondContact CZ-ND2 3.08Å; W261-N265 PolarHBondContact O-N 2.62Å; W261-N265 PolarHBondContact O-ND2 3.06Å; I262-N265 PolarHBondContact O-N 2.82Å; I262-N265 VanDerWaalsContact O-N 3.13Å; N265-L267 VanDerWaalsContact C-N 3.3Å; N265-L267 PolarHBondContact O-N 3.12Å; N265-W268 PolarHBondContact O-N 2.99Å; N265-I269 WeakPolarHBondContact O-CG1 3.06Å; N265-I269 PolarHBondContact O-N 3.39Å; N265-I269 VanDerWaalsContact O-N 3.07Å
266V88.7Confident86.2Confident70 Ų7051.5 Ų51.542%0.42428%0.277SS..Hα-helixtrans-62.3-41.6173.81720000110.3I262 W268 I269 V270I262-V266 HydrophobicContact CG2-CG2 3.94Å; I262-V266 WeakPolarHBondContact O-CG2 3.29Å; I262-V266 PolarHBondContact O-N 3.38Å; V266-W268 VanDerWaalsContact C-N 3.35Å; V266-W268 PolarHBondContact O-N 3.18Å; V266-I269 PolarHBondContact O-N 3.39Å; V266-V270 HydrophobicContact CG1-CG2 4.21Å; V266-V270 WeakPolarHBondContact O-CB 3.43Å; V266-V270 VanDerWaalsContact O-CG2 3.28Å; V266-V270 WeakPolarHBondContact O-CG2 3.14Å; V266-V270 PolarHBondContact O-N 3.15Å
267L88.4Confident84.5Confident19 Ų1959 Ų5910%0.09931%0.308CS..Hα-helixtrans-56.9-47.3176.2-17665.5000111.6P263 L264 N265 I269 V270 V271 F284 T287 F288 C291P263-L267 WeakPolarHBondContact O-CB 3.28Å; P263-L267 PolarHBondContact O-N 3.05Å; L264-L267 WeakPolarHBondContact O-CB 3.46Å; L264-L267 PolarHBondContact O-N 3.38Å; N265-L267 VanDerWaalsContact C-N 3.3Å; N265-L267 PolarHBondContact O-N 3.12Å; L267-I269 PolarHBondContact O-N 3.43Å; L267-V270 PolarHBondContact O-N 3.32Å; L267-V271 VanDerWaalsContact O-CG2 3.3Å; L267-V271 WeakPolarHBondContact O-CG2 3.43Å; L267-V271 PolarHBondContact O-N 3.22Å; L267-F284 HydrophobicContact CD1-CD2 4.07Å; L267-F284 HydrophobicContact CD1-CE2 3.76Å; L267-F284 HydrophobicContact CD2-CE2 4.08Å; L267-F284 HydrophobicContact CG-CE2 3.88Å; L267-T287 HydrophobicContact CD1-CG2 3.9Å; L267-T287 HydrophobicContact CD2-CG2 4.35Å; L267-F288 VanDerWaalsContact CD2-CA 3.48Å; L267-F288 HydrophobicContact CD2-CB 3.87Å; L267-F288 HydrophobicContact CD2-CD2 4.03Å; L267-F288 HydrophobicContact CD2-CG 4.43Å; L267-C291 HydrophobicContact CD2-CB 4.41Å
268W85.7Confident83Confident89 Ų8959.5 Ų59.534%0.33732%0.316SS..Hα-helixtrans-63.2-40.5177.4-73.8122.8000113.3L264 N265 V266 V270 V271 D272 F288L264-W268 PolarHBondContact O-N 3.43Å; N265-W268 PolarHBondContact O-N 2.99Å; V266-W268 VanDerWaalsContact C-N 3.35Å; V266-W268 PolarHBondContact O-N 3.18Å; W268-V270 VanDerWaalsContact C-N 3.33Å; W268-V270 PolarHBondContact O-N 3.44Å; W268-V271 PolarHBondContact O-N 2.77Å; W268-D272 PolarHBondContact O-N 3.21Å; W268-F288 HydrophobicContact CH2-CE2 4.27Å; W268-F288 HydrophobicContact CZ2-CD2 4.2Å; W268-F288 AromaticContact CZ2-CE2 3.51Å; W268-F288 HydrophobicContact CZ2-CE2 3.51Å; W268-F288 HydrophobicContact CZ2-CZ 4.42Å
269I85.3Confident81.6Confident48 Ų4860.4 Ų60.425%0.24632%0.318CS..Hα-helixtrans-61.8-43.2174.3-67.6166000110.8T192 F196 N265 V266 L267 D272 I273T192-I269 HydrophobicContact CG2-CG1 3.97Å; F196-I269 HydrophobicContact CD2-CD1 3.93Å; F196-I269 HydrophobicContact CE2-CD1 4.24Å; F196-I269 HydrophobicContact CG-CD1 4.1Å; N265-I269 WeakPolarHBondContact O-CG1 3.06Å; N265-I269 PolarHBondContact O-N 3.39Å; N265-I269 VanDerWaalsContact O-N 3.07Å; V266-I269 PolarHBondContact O-N 3.39Å; L267-I269 PolarHBondContact O-N 3.43Å; I269-D272 PolarHBondContact O-N 3.23Å; I269-I273 HydrophobicContact CG2-CD1 3.81Å; I269-I273 VanDerWaalsContact O-CG1 3.29Å; I269-I273 WeakPolarHBondContact O-CG1 3.19Å; I269-I273 PolarHBondContact O-N 3.42Å; I269-I273 VanDerWaalsContact O-N 3.11Å
270V85.2Confident79.9Confident61 Ų6158.6 Ų58.637%0.3732%0.317SS..Hα-helixtrans-63.9-42.3179.1169.10000111.2V266 L267 W268 D272 I273 I274V266-V270 HydrophobicContact CG1-CG2 4.21Å; V266-V270 WeakPolarHBondContact O-CB 3.43Å; V266-V270 VanDerWaalsContact O-CG2 3.28Å; V266-V270 WeakPolarHBondContact O-CG2 3.14Å; V266-V270 PolarHBondContact O-N 3.15Å; L267-V270 PolarHBondContact O-N 3.32Å; W268-V270 VanDerWaalsContact C-N 3.33Å; W268-V270 PolarHBondContact O-N 3.44Å; V270-D272 VanDerWaalsContact C-N 3.33Å; V270-D272 PolarHBondContact O-N 3.03Å; V270-I273 PolarHBondContact O-N 2.71Å; V270-I274 HydrophobicContact CG1-CD1 3.48Å; V270-I274 VanDerWaalsContact CG1-CD1 3.48Å; V270-I274 HydrophobicContact CG1-CG1 4.17Å; V270-I274 WeakPolarHBondContact O-CB 3.43Å; V270-I274 WeakPolarHBondContact O-CG1 3.26Å; V270-I274 PolarHBondContact O-N 3.17Å
271V81Confident78.8Confident3 Ų360.4 Ų60.42%0.01833%0.33CS..Hα-helixtrans-60.1-44.6175.1172.50000111.1L267 W268 I273 G275 E279 F284L267-V271 VanDerWaalsContact O-CG2 3.3Å; L267-V271 WeakPolarHBondContact O-CG2 3.43Å; L267-V271 PolarHBondContact O-N 3.22Å; W268-V271 PolarHBondContact O-N 2.77Å; V271-I273 PolarHBondContact O-N 3.03Å; V271-G275 WeakPolarHBondContact O-CA 3.15Å; V271-G275 PolarHBondContact O-N 3.46Å; V271-E279 HydrophobicContact CG1-CG 3.69Å; V271-E279 WeakPolarHBondContact CG1-OE1 3.24Å; V271-F284 HydrophobicContact CG2-CD2 4.04Å; V271-F284 HydrophobicContact CG2-CE2 3.15Å; V271-F284 HydrophobicContact CG2-CZ 3.64Å
272D79.3Confident77.7Confident37 Ų3762.8 Ų62.820%0.19835%0.346CS..Hα-helixtrans-64.4-26.9179-72.1-5000112.5R188 T192 W268 I269 V270R188-D272 IonicContact CZ-OD1 2.98Å; R188-D272 IonicContact NE-OD1 3.91Å; R188-D272 PolarHBondContact NE-OD1 3.25Å; R188-D272 IonicContact NH2-OD1 3.13Å; R188-D272 PolarHBondContact NH2-OD1 3.49Å; T192-D272 VanDerWaalsContact CB-OD2 3.24Å; T192-D272 WeakPolarHBondContact CB-OD2 3.21Å; T192-D272 WeakPolarHBondContact CG2-OD2 3.49Å; T192-D272 PolarHBondContact OG1-OD2 3.08Å; W268-D272 PolarHBondContact O-N 3.21Å; I269-D272 PolarHBondContact O-N 3.23Å; V270-D272 VanDerWaalsContact C-N 3.33Å; V270-D272 PolarHBondContact O-N 3.03Å
273I81.2Confident77Confident132 Ų13267.7 Ų67.768%0.67736%0.361SS*.Hα-helixtrans-85.1-46178.1-66.5166.3000112.3I269 V270 V271 G275I269-I273 HydrophobicContact CG2-CD1 3.81Å; I269-I273 VanDerWaalsContact O-CG1 3.29Å; I269-I273 WeakPolarHBondContact O-CG1 3.19Å; I269-I273 PolarHBondContact O-N 3.42Å; I269-I273 VanDerWaalsContact O-N 3.11Å; V270-I273 PolarHBondContact O-N 2.71Å; V271-I273 PolarHBondContact O-N 3.03Å; I273-G275 VanDerWaalsContact C-N 3.32Å
274I77Confident76.4Confident112 Ų11266.9 Ų66.957%0.57435%0.353SS*.Hα-helixtrans-79.8-20.1-175-61179.1000111.3V270 A278V270-I274 HydrophobicContact CG1-CD1 3.48Å; V270-I274 VanDerWaalsContact CG1-CD1 3.48Å; V270-I274 HydrophobicContact CG1-CG1 4.17Å; V270-I274 WeakPolarHBondContact O-CB 3.43Å; V270-I274 WeakPolarHBondContact O-CG1 3.26Å; V270-I274 PolarHBondContact O-N 3.17Å; I274-A278 HydrophobicContact CG2-CB 3.99Å
275G67.6Low75.9Confident31 Ų3169.4 Ų69.432%0.3236%0.364SS..  trans82.5168.3-178.900000113.2V271 I273 K277 A278V271-G275 WeakPolarHBondContact O-CA 3.15Å; V271-G275 PolarHBondContact O-N 3.46Å; I273-G275 VanDerWaalsContact C-N 3.32Å; G275-K277 PolarHBondContact O-N 2.87Å; G275-A278 PolarHBondContact O-N 3.29Å; G275-A278 VanDerWaalsContact O-N 3.15Å
276E62.2Low75.7Confident133 Ų13369.1 Ų69.162%0.62136%0.362SS*.G310 helixtrans-56.3-19.2-170.3-64.5180172.300114.8A278 E279E276-A278 PolarHBondContact O-N 3.18Å; E276-A278 VanDerWaalsContact O-N 3.16Å; E276-E279 WeakPolarHBondContact O-CB 3.17Å; E276-E279 PolarHBondContact O-N 3.38Å
277K59.3Low75.7Confident205 Ų20568.7 Ų68.789%0.89136%0.36SS*.G310 helixtrans-60.1-26177.9-67.4-173.6179.3-178.60113G275G275-K277 PolarHBondContact O-N 2.87Å
278A60.9Low75.7Confident29 Ų2968.1 Ų68.124%0.2436%0.357CS..G310 helixtrans-74-29.9176.100000113.2I274 G275 E276 G280 S281 F284I274-A278 HydrophobicContact CG2-CB 3.99Å; G275-A278 PolarHBondContact O-N 3.29Å; G275-A278 VanDerWaalsContact O-N 3.15Å; E276-A278 PolarHBondContact O-N 3.18Å; E276-A278 VanDerWaalsContact O-N 3.16Å; A278-G280 PolarHBondContact O-N 3.39Å; A278-S281 PolarHBondContact O-N 3.09Å; A278-S281 PolarHBondContact O-OG 2.88Å; A278-S281 VanDerWaalsContact O-OG 3.1Å; A278-F284 WeakPolarHBondContact O-CB 3.13Å
279E62.1Low76Confident47 Ų4764 Ų6422%0.2234%0.341CS..THydrogen-bonded Turntrans-66.9-21.4-172.6-64.2-176.1-175.900112.9R172 R188 V271 E276 F284R172-E279 PolarHBondContact NH1-O 2.91Å; R188-E279 IonicContact NH1-OE1 2.81Å; R188-E279 IonicContact NH2-OE1 3.72Å; R188-E279 PolarHBondContact NH2-OE1 3.42Å; V271-E279 HydrophobicContact CG1-CG 3.69Å; V271-E279 WeakPolarHBondContact CG1-OE1 3.24Å; E276-E279 WeakPolarHBondContact O-CB 3.17Å; E276-E279 PolarHBondContact O-N 3.38Å; E279-F284 HydrophobicContact CB-CD1 4.32Å; E279-F284 HydrophobicContact CB-CE1 4.31Å; E279-F284 HydrophobicContact CG-CE1 4.29Å; E279-F284 HydrophobicContact CG-CZ 4.43Å
280G60.6Low76.3Confident51 Ų5165 Ų6553%0.52635%0.346SS..THydrogen-bonded Turntrans-81.4-9.1-179.600000115.1A278A278-G280 PolarHBondContact O-N 3.39Å
281S70.5Confident76.7Confident48 Ų4862.8 Ų62.834%0.33633%0.334SS..SBendtrans-78.8141.8-177.470.50000112A278 Y283 F284 H285A278-S281 PolarHBondContact O-N 3.09Å; A278-S281 PolarHBondContact O-OG 2.88Å; A278-S281 VanDerWaalsContact O-OG 3.1Å; S281-Y283 PolarHBondContact O-N 3.46Å; S281-F284 WeakPolarHBondContact O-CB 3.24Å; S281-F284 PolarHBondContact O-N 3.41Å; S281-F284 WeakPolarHBondContact OG-CB 3.28Å; S281-F284 PolarHBondContact OG-N 3.49Å; S281-F284 VanDerWaalsContact OG-N 3.1Å; S281-H285 PolarHBondContact O-N 3.39Å
282V70.9Confident77.3Confident59 Ų5962.7 Ų62.736%0.35833%0.333SS..Hα-helixtrans-54.9-37.2171.7175.40000110.6I20 F284 H285 H286I20-V282 HydrophobicContact CG2-CG1 4.24Å; I20-V282 HydrophobicContact CG2-CG2 4.06Å; V282-F284 VanDerWaalsContact C-N 3.34Å; V282-F284 PolarHBondContact O-N 3.25Å; V282-H285 WeakPolarHBondContact O-CB 3.3Å; V282-H285 PolarHBondContact O-N 3.24Å; V282-H286 WeakPolarHBondContact CG1-CE1 3.31Å; V282-H286 WeakPolarHBondContact CG1-ND1 3.08Å; V282-H286 PolarHBondContact O-N 3.24Å; V282-H286 PolarHBondContact O-ND1 3.11Å
283Y76.9Confident78.1Confident176 Ų17661.8 Ų61.869%0.6933%0.328SS*.Hα-helixtrans-61-39.1176.3-60.2-69.5000113.1S281 H286 T287S281-Y283 PolarHBondContact O-N 3.46Å; Y283-H286 PolarHBondContact O-N 3.4Å; Y283-T287 VanDerWaalsContact O-CB 3.27Å; Y283-T287 WeakPolarHBondContact O-CB 3.38Å; Y283-T287 PolarHBondContact O-N 2.92Å; Y283-T287 PolarHBondContact O-OG1 2.88Å
284F81.6Confident78.8Confident25 Ų2559.2 Ų59.211%0.1132%0.315CS..Hα-helixtrans-62.5-45.7175.2178.3-101.5000111.2L267 V271 A278 E279 S281 V282 H286 T287 F288L267-F284 HydrophobicContact CD1-CD2 4.07Å; L267-F284 HydrophobicContact CD1-CE2 3.76Å; L267-F284 HydrophobicContact CD2-CE2 4.08Å; L267-F284 HydrophobicContact CG-CE2 3.88Å; V271-F284 HydrophobicContact CG2-CD2 4.04Å; V271-F284 HydrophobicContact CG2-CE2 3.15Å; V271-F284 HydrophobicContact CG2-CZ 3.64Å; A278-F284 WeakPolarHBondContact O-CB 3.13Å; E279-F284 HydrophobicContact CB-CD1 4.32Å; E279-F284 HydrophobicContact CB-CE1 4.31Å; E279-F284 HydrophobicContact CG-CE1 4.29Å; E279-F284 HydrophobicContact CG-CZ 4.43Å; S281-F284 WeakPolarHBondContact O-CB 3.24Å; S281-F284 PolarHBondContact O-N 3.41Å; S281-F284 WeakPolarHBondContact OG-CB 3.28Å; S281-F284 PolarHBondContact OG-N 3.49Å; S281-F284 VanDerWaalsContact OG-N 3.1Å; V282-F284 VanDerWaalsContact C-N 3.34Å; V282-F284 PolarHBondContact O-N 3.25Å; F284-H286 PolarHBondContact O-N 3.42Å; F284-T287 PolarHBondContact O-N 3.17Å; F284-F288 WeakPolarHBondContact O-CB 3.37Å; F284-F288 PolarHBondContact O-N 3.3Å
285H79.7Confident79.6Confident60 Ų6053.9 Ų53.928%0.27829%0.287SS..Hα-helixtrans-58.8-47.6178.2-174.995.1000112.2F89 S281 V282 F288 I289F89-H285 AromaticContact CD1-CE1 3.21Å; F89-H285 WeakPolarHBondContact CD1-CE1 3.2Å; F89-H285 AromaticContact CD1-ND1 3.29Å; F89-H285 VanDerWaalsContact CD1-ND1 3.29Å; F89-H285 WeakPolarHBondContact CD1-ND1 3.48Å; F89-H285 AromaticContact CD1-NE2 3.92Å; F89-H285 AromaticContact CE1-ND1 3.7Å; F89-H285 AromaticContact CG-CE1 3.9Å; F89-H285 PolarHBondContact O-CE1 2.9Å; F89-H285 VanDerWaalsContact O-CE1 3.24Å; S281-H285 PolarHBondContact O-N 3.39Å; V282-H285 WeakPolarHBondContact O-CB 3.3Å; V282-H285 PolarHBondContact O-N 3.24Å; H285-F288 PolarHBondContact O-N 3.49Å; H285-I289 WeakPolarHBondContact O-CG1 3.45Å; H285-I289 PolarHBondContact O-N 3.37Å
286H85.5Confident80.9Confident16 Ų1652.6 Ų52.67%0.07427%0.273CS..Hα-helixtrans-62.5-45.9177.9-71.759.1000111S23 M27 V282 Y283 F284 F288 I289 L290S23-H286 PolarHBondContact O-NE2 3.04Å; S23-H286 PolarHBondContact OG-CD2 3.46Å; S23-H286 PolarHBondContact OG-NE2 3.46Å; M27-H286 WeakPolarHBondContact CG-CD2 3.46Å; M27-H286 WeakPolarHBondContact CG-NE2 3.33Å; V282-H286 WeakPolarHBondContact CG1-CE1 3.31Å; V282-H286 WeakPolarHBondContact CG1-ND1 3.08Å; V282-H286 PolarHBondContact O-N 3.24Å; V282-H286 PolarHBondContact O-ND1 3.11Å; Y283-H286 PolarHBondContact O-N 3.4Å; F284-H286 PolarHBondContact O-N 3.42Å; H286-F288 PolarHBondContact O-N 3.01Å; H286-I289 PolarHBondContact O-N 2.89Å; H286-L290 VanDerWaalsContact O-CG 3.31Å; H286-L290 WeakPolarHBondContact O-CG 3.26Å; H286-L290 PolarHBondContact O-N 3.03Å
287T88.8Confident82.5Confident61 Ų6147 Ų4737%0.37425%0.249SC..Hα-helixtrans-61.8-45.8178.9-56.50000111.2L267 Y283 F284 I289 L290 C291L267-T287 HydrophobicContact CD1-CG2 3.9Å; L267-T287 HydrophobicContact CD2-CG2 4.35Å; Y283-T287 VanDerWaalsContact O-CB 3.27Å; Y283-T287 WeakPolarHBondContact O-CB 3.38Å; Y283-T287 PolarHBondContact O-N 2.92Å; Y283-T287 PolarHBondContact O-OG1 2.88Å; F284-T287 PolarHBondContact O-N 3.17Å; T287-I289 PolarHBondContact O-N 3.1Å; T287-L290 PolarHBondContact O-N 2.98Å; T287-C291 WeakPolarHBondContact O-CB 3.3Å; T287-C291 PolarHBondContact O-N 2.96Å; T287-C291 PolarHBondContact O-SG 3.08Å
288F89.5Confident84.2Confident7 Ų737.3 Ų37.33%0.03121%0.207CC..Hα-helixtrans-58.3-50176.8176.2-88.2000111.7T85 F89 L264 L267 W268 F284 H285 H286 L290 C291 H292T85-F288 HydrophobicContact CG2-CE1 3.86Å; T85-F288 HydrophobicContact CG2-CZ 4.17Å; F89-F288 AromaticContact CD1-CD1 3.64Å; F89-F288 HydrophobicContact CD1-CD1 3.64Å; F89-F288 HydrophobicContact CD1-CE1 4.09Å; F89-F288 HydrophobicContact CD2-CD1 4.13Å; F89-F288 AromaticContact CD2-CE1 3.71Å; F89-F288 HydrophobicContact CD2-CE1 3.71Å; F89-F288 HydrophobicContact CE1-CB 3.96Å; F89-F288 AromaticContact CE1-CD1 3.1Å; F89-F288 HydrophobicContact CE1-CD1 3.1Å; F89-F288 AromaticContact CE1-CE1 3.69Å; F89-F288 HydrophobicContact CE1-CE1 3.69Å; F89-F288 AromaticContact CE1-CG 3.62Å; F89-F288 HydrophobicContact CE1-CG 3.62Å; F89-F288 AromaticContact CE2-CD1 3.59Å; F89-F288 HydrophobicContact CE2-CD1 3.59Å; F89-F288 AromaticContact CE2-CE1 3.2Å; F89-F288 HydrophobicContact CE2-CE1 3.2Å; F89-F288 HydrophobicContact CE2-CE2 4.48Å; F89-F288 HydrophobicContact CE2-CG 4.37Å; F89-F288 AromaticContact CE2-CZ 3.71Å; F89-F288 HydrophobicContact CE2-CZ 3.71Å; F89-F288 HydrophobicContact CG-CD1 4.18Å; F89-F288 HydrophobicContact CG-CE1 4.16Å; F89-F288 HydrophobicContact CZ-CB 4.29Å; F89-F288 AromaticContact CZ-CD1 3.07Å; F89-F288 HydrophobicContact CZ-CD1 3.07Å; F89-F288 HydrophobicContact CZ-CD2 4.08Å; F89-F288 AromaticContact CZ-CE1 3.23Å; F89-F288 HydrophobicContact CZ-CE1 3.23Å; F89-F288 HydrophobicContact CZ-CE2 4.2Å; F89-F288 AromaticContact CZ-CG 3.53Å; F89-F288 HydrophobicContact CZ-CG 3.53Å; F89-F288 AromaticContact CZ-CZ 3.81Å; F89-F288 HydrophobicContact CZ-CZ 3.81Å; L264-F288 HydrophobicContact CD1-CD2 4.01Å; L264-F288 HydrophobicContact CD1-CE2 3.76Å; L267-F288 VanDerWaalsContact CD2-CA 3.48Å; L267-F288 HydrophobicContact CD2-CB 3.87Å; L267-F288 HydrophobicContact CD2-CD2 4.03Å; L267-F288 HydrophobicContact CD2-CG 4.43Å; W268-F288 HydrophobicContact CH2-CE2 4.27Å; W268-F288 HydrophobicContact CZ2-CD2 4.2Å; W268-F288 AromaticContact CZ2-CE2 3.51Å; W268-F288 HydrophobicContact CZ2-CE2 3.51Å; W268-F288 HydrophobicContact CZ2-CZ 4.42Å; F284-F288 WeakPolarHBondContact O-CB 3.37Å; F284-F288 PolarHBondContact O-N 3.3Å; H285-F288 PolarHBondContact O-N 3.49Å; H286-F288 PolarHBondContact O-N 3.01Å; F288-L290 VanDerWaalsContact C-N 3.3Å; F288-L290 PolarHBondContact O-N 3.07Å; F288-C291 PolarHBondContact O-N 3.08Å; F288-H292 HydrophobicContact CD1-CB 4.45Å; F288-H292 HydrophobicContact CE1-CB 4.08Å; F288-H292 HydrophobicContact CZ-CB 4.31Å; F288-H292 WeakPolarHBondContact O-CB 3.31Å; F288-H292 PolarHBondContact O-N 2.93Å
289I90.1Very high85.8Confident3 Ų336 Ų362%0.01520%0.196CC..Hα-helixtrans-60.2-42.1-178.9-74.2-65.1000111.3V31 F89 H285 H286 T287 M293V31-I289 HydrophobicContact CG2-CG2 3.44Å; V31-I289 VanDerWaalsContact CG2-CG2 3.44Å; F89-I289 HydrophobicContact CB-CD1 3.78Å; F89-I289 HydrophobicContact CD1-CD1 3.79Å; F89-I289 HydrophobicContact CD1-CG1 3.92Å; F89-I289 HydrophobicContact CG-CD1 3.87Å; F89-I289 HydrophobicContact CG-CG1 4.5Å; H285-I289 WeakPolarHBondContact O-CG1 3.45Å; H285-I289 PolarHBondContact O-N 3.37Å; H286-I289 PolarHBondContact O-N 2.89Å; T287-I289 PolarHBondContact O-N 3.1Å; I289-M293 HydrophobicContact CG2-CE 4.34Å; I289-M293 WeakPolarHBondContact O-CB 3.33Å; I289-M293 PolarHBondContact O-N 3.15Å
290L92.8Very high87.5Confident68 Ų6834.6 Ų34.636%0.35619%0.191SC..Hα-helixtrans-66.3-47.8176.8-68.8172.6000111.7M27 H286 T287 F288 H292 M293 I294M27-L290 HydrophobicContact CE-CD1 4.04Å; M27-L290 HydrophobicContact CE-CG 4.5Å; M27-L290 HydrophobicContact SD-CD2 4.23Å; M27-L290 HydrophobicContact SD-CG 4.45Å; H286-L290 VanDerWaalsContact O-CG 3.31Å; H286-L290 WeakPolarHBondContact O-CG 3.26Å; H286-L290 PolarHBondContact O-N 3.03Å; T287-L290 PolarHBondContact O-N 2.98Å; F288-L290 VanDerWaalsContact C-N 3.3Å; F288-L290 PolarHBondContact O-N 3.07Å; L290-H292 VanDerWaalsContact C-N 3.33Å; L290-H292 PolarHBondContact O-N 2.95Å; L290-M293 PolarHBondContact O-N 3.32Å; L290-I294 VanDerWaalsContact O-CG1 3.29Å; L290-I294 WeakPolarHBondContact O-CG1 3.32Å; L290-I294 PolarHBondContact O-N 2.94Å
291C94.2Very high89.2Confident16 Ų1636.9 Ų36.911%0.10818%0.184CC..Hα-helixtrans-60.7-42.7176.7-70.10000111.9P263 L264 L267 T287 F288 I294 A295P263-C291 HydrophobicContact CB-CB 4.18Å; L264-C291 HydrophobicContact CB-CB 4.19Å; L264-C291 HydrophobicContact CD1-CB 4.19Å; L267-C291 HydrophobicContact CD2-CB 4.41Å; T287-C291 WeakPolarHBondContact O-CB 3.3Å; T287-C291 PolarHBondContact O-N 2.96Å; T287-C291 PolarHBondContact O-SG 3.08Å; F288-C291 PolarHBondContact O-N 3.08Å; C291-I294 PolarHBondContact O-N 2.66Å; C291-A295 WeakPolarHBondContact O-CB 3.45Å; C291-A295 PolarHBondContact O-N 2.67Å
292H93.4Very high90.3Very high0 Ų035 Ų350%017%0.17CC..Hα-helixtrans-66-40.7177.1-175.5-87.3000111.4Y35 T85 L264 F288 L290 I294 A295 M296Y35-H292 AromaticContact CE1-ND1 3.69Å; Y35-H292 AromaticContact CZ-ND1 3.69Å; Y35-H292 PolarHBondContact OH-ND1 3.15Å; T85-H292 PolarHBondContact OG1-NE2 2.91Å; L264-H292 HydrophobicContact CD1-CB 4.39Å; F288-H292 HydrophobicContact CD1-CB 4.45Å; F288-H292 HydrophobicContact CE1-CB 4.08Å; F288-H292 HydrophobicContact CZ-CB 4.31Å; F288-H292 WeakPolarHBondContact O-CB 3.31Å; F288-H292 PolarHBondContact O-N 2.93Å; L290-H292 VanDerWaalsContact C-N 3.33Å; L290-H292 PolarHBondContact O-N 2.95Å; H292-I294 PolarHBondContact O-N 2.81Å; H292-A295 WeakPolarHBondContact O-CB 3.49Å; H292-A295 PolarHBondContact O-N 3.48Å; H292-M296 WeakPolarHBondContact CE1-CG 3.32Å; H292-M296 VanDerWaalsContact O-CG 3.31Å; H292-M296 WeakPolarHBondContact O-CG 3.24Å; H292-M296 PolarHBondContact O-N 3.12Å
293M94.5Very high91.4Very high19 Ų1932.7 Ų32.79%0.09416%0.157CC..Hα-helixtrans-62.1-43.9175.9-173.5-175.4-66.800111.9I30 V31 I34 Y35 I38 I289 L290 A295 M296 S297I30-M293 HydrophobicContact CG2-CE 3.7Å; I30-M293 HydrophobicContact CG2-SD 4.08Å; V31-M293 HydrophobicContact CG2-CE 4.19Å; I34-M293 HydrophobicContact CB-CE 4.17Å; I34-M293 HydrophobicContact CB-SD 3.86Å; I34-M293 HydrophobicContact CG1-SD 4.24Å; I34-M293 HydrophobicContact CG2-CE 4.36Å; I34-M293 HydrophobicContact CG2-CG 3.75Å; I34-M293 HydrophobicContact CG2-SD 3.51Å; I34-M293 VanDerWaalsContact CG2-SD 3.51Å; Y35-M293 HydrophobicContact CD2-CE 4.04Å; Y35-M293 HydrophobicContact CE2-CB 4.29Å; Y35-M293 HydrophobicContact CE2-CE 3.69Å; Y35-M293 HydrophobicContact CE2-CG 4.41Å; I38-M293 HydrophobicContact CD1-CG 4Å; I289-M293 HydrophobicContact CG2-CE 4.34Å; I289-M293 WeakPolarHBondContact O-CB 3.33Å; I289-M293 PolarHBondContact O-N 3.15Å; L290-M293 PolarHBondContact O-N 3.32Å; M293-A295 VanDerWaalsContact C-N 3.34Å; M293-M296 PolarHBondContact O-N 3.29Å; M293-S297 WeakPolarHBondContact O-CB 3.42Å; M293-S297 PolarHBondContact O-N 2.95Å
294I96.2Very high92.2Very high77 Ų7729.8 Ų29.840%0.39515%0.148SC..Hα-helixtrans-61.2-43.9174.1-66.3166.2000110.1C260 L290 C291 H292 S297C260-I294 HydrophobicContact CB-CG2 4.31Å; C260-I294 WeakPolarHBondContact CB-O 3.22Å; L290-I294 VanDerWaalsContact O-CG1 3.29Å; L290-I294 WeakPolarHBondContact O-CG1 3.32Å; L290-I294 PolarHBondContact O-N 2.94Å; C291-I294 PolarHBondContact O-N 2.66Å; H292-I294 PolarHBondContact O-N 2.81Å; I294-S297 PolarHBondContact O-N 2.77Å; I294-S297 PolarHBondContact O-OG 3.37Å
295A95.3Very high92.8Very high0 Ų029.9 Ų29.90%015%0.149CC..Hα-helixtrans-61.2-48.4176.300000112.1C260 W261 L264 C291 H292 M293 S297 S298C260-A295 WeakPolarHBondContact O-CA 3.31Å; C260-A295 PolarHBondContact O-N 3.1Å; W261-A295 HydrophobicContact CD2-CB 3.99Å; W261-A295 HydrophobicContact CE3-CB 4.07Å; W261-A295 HydrophobicContact CG-CB 4.45Å; W261-A295 HydrophobicContact CH2-CB 4.38Å; W261-A295 HydrophobicContact CZ2-CB 4.3Å; W261-A295 HydrophobicContact CZ3-CB 4.26Å; L264-A295 HydrophobicContact CB-CB 4.41Å; L264-A295 HydrophobicContact CD2-CB 3.99Å; C291-A295 WeakPolarHBondContact O-CB 3.45Å; C291-A295 PolarHBondContact O-N 2.67Å; H292-A295 WeakPolarHBondContact O-CB 3.49Å; H292-A295 PolarHBondContact O-N 3.48Å; M293-A295 VanDerWaalsContact C-N 3.34Å; A295-S297 VanDerWaalsContact C-N 3.28Å; A295-S297 PolarHBondContact O-N 3Å; A295-S298 VanDerWaalsContact O-CB 3.28Å; A295-S298 WeakPolarHBondContact O-CB 3.37Å; A295-S298 PolarHBondContact O-N 3.45Å; A295-S298 VanDerWaalsContact O-N 3.13Å; A295-S298 PolarHBondContact O-OG 2.71Å
296M94.7Very high93.4Very high4 Ų427 Ų272%0.0214%0.136CC..Hα-helixtrans-64.4-31.8179.4-67.1-58.7104.100112.8Y35 I38 M77 A81 A82 W261 H292 M293 S298 A299Y35-M296 HydrophobicContact CE1-CG 4.29Å; I38-M296 HydrophobicContact CD1-CB 4.41Å; I38-M296 HydrophobicContact CG2-CB 4.14Å; M77-M296 HydrophobicContact SD-CE 4.42Å; A81-M296 HydrophobicContact CB-SD 4.1Å; A82-M296 HydrophobicContact CB-SD 4.38Å; W261-M296 HydrophobicContact CH2-CE 3.64Å; W261-M296 HydrophobicContact CZ2-CE 3.89Å; H292-M296 WeakPolarHBondContact CE1-CG 3.32Å; H292-M296 VanDerWaalsContact O-CG 3.31Å; H292-M296 WeakPolarHBondContact O-CG 3.24Å; H292-M296 PolarHBondContact O-N 3.12Å; M293-M296 PolarHBondContact O-N 3.29Å; M296-S298 PolarHBondContact O-N 3.19Å; M296-S298 VanDerWaalsContact O-N 3.14Å; M296-A299 PolarHBondContact O-N 3.15Å
297S95.6Very high93.8Very high15 Ų1527.8 Ų27.811%0.10515%0.145CC..Hα-helixtrans-61.5-20.4176.677.50000113.2M293 I294 A295 A299 V300 Y301M293-S297 WeakPolarHBondContact O-CB 3.42Å; M293-S297 PolarHBondContact O-N 2.95Å; I294-S297 PolarHBondContact O-N 2.77Å; I294-S297 PolarHBondContact O-OG 3.37Å; A295-S297 VanDerWaalsContact C-N 3.28Å; A295-S297 PolarHBondContact O-N 3Å; S297-A299 PolarHBondContact O-N 3.3Å; S297-A299 VanDerWaalsContact O-N 3.16Å; S297-V300 WeakPolarHBondContact O-CB 3.31Å; S297-V300 PolarHBondContact O-N 2.94Å; S297-Y301 VanDerWaalsContact O-CD2 3.3Å; S297-Y301 WeakPolarHBondContact O-CD2 3.5Å; S297-Y301 WeakPolarHBondContact O-CE2 3.25Å; S297-Y301 PolarHBondContact OG-OH 3.33Å
298S95Very high93.8Very high3 Ų334.6 Ų34.62%0.02116%0.164CC..Hα-helixtrans-56.2-35.2178.976.20000112.9W261 A295 M296 V300 Y301W261-S298 PolarHBondContact NE1-OG 3.16Å; A295-S298 VanDerWaalsContact O-CB 3.28Å; A295-S298 WeakPolarHBondContact O-CB 3.37Å; A295-S298 PolarHBondContact O-N 3.45Å; A295-S298 VanDerWaalsContact O-N 3.13Å; A295-S298 PolarHBondContact O-OG 2.71Å; M296-S298 PolarHBondContact O-N 3.19Å; M296-S298 VanDerWaalsContact O-N 3.14Å; S298-V300 PolarHBondContact O-N 3.04Å; S298-Y301 PolarHBondContact O-N 3.26Å
299A94.9Very high93.8Very high2 Ų236.6 Ų36.62%0.01718%0.175CC..Hα-helixtrans-67.2-23.9-179.400000113.1S42 N46 D74 M296 S297S42-A299 VanDerWaalsContact OG-CB 3.32Å; S42-A299 WeakPolarHBondContact OG-CB 3.49Å; N46-A299 PolarHBondContact ND2-O 2.87Å; D74-A299 HydrophobicContact CB-CB 3.87Å; M296-A299 PolarHBondContact O-N 3.15Å; S297-A299 PolarHBondContact O-N 3.3Å; S297-A299 VanDerWaalsContact O-N 3.16Å
300V96.7Very high93.8Very high17 Ų1737.3 Ų37.310%0.10318%0.179CC..Hα-helixtrans-75.5-39.5-179.4178.50000111I38 F41 S297 S298 N302 P303 F304I38-V300 HydrophobicContact CB-CG2 4.37Å; I38-V300 HydrophobicContact CG1-CG2 4.48Å; I38-V300 HydrophobicContact CG2-CG2 4.06Å; F41-V300 HydrophobicContact CB-CG1 3.76Å; F41-V300 HydrophobicContact CB-CG2 4.29Å; S297-V300 WeakPolarHBondContact O-CB 3.31Å; S297-V300 PolarHBondContact O-N 2.94Å; S298-V300 PolarHBondContact O-N 3.04Å; V300-N302 VanDerWaalsContact C-N 3.33Å; V300-N302 PolarHBondContact O-N 2.93Å; V300-P303 WeakPolarHBondContact O-CD 3.38Å; V300-F304 HydrophobicContact CG1-CD2 4.09Å; V300-F304 HydrophobicContact CG1-CE2 3.63Å; V300-F304 WeakPolarHBondContact O-CD2 3.3Å
301Y95.9Very high93.6Very high98 Ų9837 Ų3738%0.38418%0.177SC..Hα-helixtrans-69.7-27.7-170.3-56.2-55.4000113.9I256 S297 S298 F304 L305I256-Y301 HydrophobicContact CG2-CD2 3.28Å; I256-Y301 HydrophobicContact CG2-CE2 4.04Å; I256-Y301 HydrophobicContact CG2-CG 3.91Å; S297-Y301 VanDerWaalsContact O-CD2 3.3Å; S297-Y301 WeakPolarHBondContact O-CD2 3.5Å; S297-Y301 WeakPolarHBondContact O-CE2 3.25Å; S297-Y301 PolarHBondContact OG-OH 3.33Å; S298-Y301 PolarHBondContact O-N 3.26Å; Y301-F304 PolarHBondContact O-N 3.24Å; Y301-L305 WeakPolarHBondContact O-CG 3.45Å; Y301-L305 PolarHBondContact O-N 3.48Å
302N93.8Very high93.4Very high9 Ų939.6 Ų39.65%0.04819%0.19CC..Hα-helixtrans-55.2-59.4-176.1-75.4-20.8000112.5D74 V300 F304 L305 Y306D74-N302 PolarHBondContact OD2-ND2 3.44Å; V300-N302 VanDerWaalsContact C-N 3.33Å; V300-N302 PolarHBondContact O-N 2.93Å; N302-F304 VanDerWaalsContact C-N 3.3Å; N302-F304 PolarHBondContact O-N 3.36Å; N302-L305 PolarHBondContact O-N 3.39Å; N302-L305 VanDerWaalsContact O-N 3.14Å; N302-Y306 HydrophobicContact CB-CE2 4Å; N302-Y306 WeakPolarHBondContact O-CD2 3.35Å; N302-Y306 WeakPolarHBondContact O-CE2 3.32Å; N302-Y306 PolarHBondContact O-N 3.03Å; N302-Y306 VanDerWaalsContact O-N 3.07Å
303P94.6Very high93.4Very high10 Ų1039.6 Ų39.67%0.06519%0.19CC..Hα-helixtrans-50.9-41.7173.5-3034.2000115.1V49 V300 Y306 A307V49-P303 HydrophobicContact CG2-CB 4.37Å; V49-P303 HydrophobicContact CG2-CG 4.21Å; V300-P303 WeakPolarHBondContact O-CD 3.38Å; P303-Y306 PolarHBondContact O-N 3.02Å; P303-A307 WeakPolarHBondContact O-CB 3.36Å; P303-A307 PolarHBondContact O-N 3.02Å
304F93.8Very high93.3Very high115 Ų11543.1 Ų43.150%0.50420%0.202SC..Hα-helixtrans-65.9-41.8179.3-71.6-74000112F41 V300 Y301 N302 Y306 A307 W308F41-F304 HydrophobicContact CD1-CZ 4.4Å; V300-F304 HydrophobicContact CG1-CD2 4.09Å; V300-F304 HydrophobicContact CG1-CE2 3.63Å; V300-F304 WeakPolarHBondContact O-CD2 3.3Å; Y301-F304 PolarHBondContact O-N 3.24Å; N302-F304 VanDerWaalsContact C-N 3.3Å; N302-F304 PolarHBondContact O-N 3.36Å; F304-Y306 VanDerWaalsContact C-N 3.34Å; F304-Y306 PolarHBondContact O-N 3.09Å; F304-A307 PolarHBondContact O-N 2.79Å; F304-W308 WeakPolarHBondContact O-CB 3.04Å; F304-W308 PolarHBondContact O-N 3.46Å
305L94Very high93.1Very high27 Ų2745.5 Ų45.514%0.14121%0.212CC..Hα-helixtrans-62.3-41.8175.4-69.6169000111.4M249 A252 M253 I256 Y301 N302 W308 L309M249-L305 HydrophobicContact CG-CB 4.32Å; A252-L305 HydrophobicContact CB-CD2 4.29Å; M253-L305 HydrophobicContact CB-CD1 4.23Å; M253-L305 HydrophobicContact CG-CB 4.39Å; M253-L305 HydrophobicContact CG-CD1 3.51Å; I256-L305 HydrophobicContact CD1-CD1 3.74Å; I256-L305 HydrophobicContact CD1-CD2 4.25Å; I256-L305 HydrophobicContact CD1-CG 4.44Å; Y301-L305 WeakPolarHBondContact O-CG 3.45Å; Y301-L305 PolarHBondContact O-N 3.48Å; N302-L305 PolarHBondContact O-N 3.39Å; N302-L305 VanDerWaalsContact O-N 3.14Å; L305-W308 PolarHBondContact O-N 3.15Å; L305-L309 HydrophobicContact CD2-CD1 4.27Å; L305-L309 WeakPolarHBondContact O-CB 3.31Å; L305-L309 PolarHBondContact O-N 3.47Å
306Y92.8Very high93Very high1 Ų147.7 Ų47.70%0.00422%0.222CC..Hα-helixtrans-62.6-47175.3-55.6-43.9000111.8V49 I67 M249 M253 N302 P303 F304 W308 N310V49-Y306 HydrophobicContact CG1-CD2 4.46Å; V49-Y306 HydrophobicContact CG1-CE2 4.26Å; V49-Y306 HydrophobicContact CG2-CD2 3.61Å; V49-Y306 HydrophobicContact CG2-CE2 3.95Å; I67-Y306 HydrophobicContact CD1-CE1 3.96Å; I67-Y306 HydrophobicContact CG1-CE1 4.13Å; I67-Y306 HydrophobicContact CG2-CD2 4.39Å; I67-Y306 HydrophobicContact CG2-CE1 3.93Å; I67-Y306 HydrophobicContact CG2-CE2 3.7Å; I67-Y306 VanDerWaalsContact CG2-CZ 3.45Å; I67-Y306 WeakPolarHBondContact CG2-OH 3.43Å; M249-Y306 HydrophobicContact CE-CD1 3.76Å; M249-Y306 HydrophobicContact CE-CE1 3.98Å; M249-Y306 HydrophobicContact CG-CD1 4.46Å; M249-Y306 HydrophobicContact SD-CD1 3.62Å; M249-Y306 HydrophobicContact SD-CE1 4.32Å; M253-Y306 HydrophobicContact CE-CE1 3.91Å; M253-Y306 WeakPolarHBondContact CE-OH 3.29Å; M253-Y306 HydrophobicContact SD-CD1 4.31Å; M253-Y306 HydrophobicContact SD-CE1 3.33Å; M253-Y306 WeakPolarHBondContact SD-CE1 3.18Å; N302-Y306 HydrophobicContact CB-CE2 4Å; N302-Y306 WeakPolarHBondContact O-CD2 3.35Å; N302-Y306 WeakPolarHBondContact O-CE2 3.32Å; N302-Y306 PolarHBondContact O-N 3.03Å; N302-Y306 VanDerWaalsContact O-N 3.07Å; P303-Y306 PolarHBondContact O-N 3.02Å; F304-Y306 VanDerWaalsContact C-N 3.34Å; F304-Y306 PolarHBondContact O-N 3.09Å; Y306-W308 VanDerWaalsContact C-N 3.32Å; Y306-W308 PolarHBondContact O-N 3.38Å; Y306-N310 WeakPolarHBondContact O-CA 3.26Å; Y306-N310 WeakPolarHBondContact O-CB 3.26Å; Y306-N310 PolarHBondContact O-N 2.88Å
307A92.4Very high92.9Very high32 Ų3248.5 Ų48.526%0.26423%0.226SC..Hα-helixtrans-62.6-37.6179.300000112.5P303 F304 R314 F317P303-A307 WeakPolarHBondContact O-CB 3.36Å; P303-A307 PolarHBondContact O-N 3.02Å; F304-A307 PolarHBondContact O-N 2.79Å; A307-R314 WeakPolarHBondContact O-CB 3.21Å; A307-R314 VanDerWaalsContact O-CD 3.32Å; A307-R314 WeakPolarHBondContact O-CD 3.28Å; A307-F317 HydrophobicContact CB-CD2 3.93Å; A307-F317 HydrophobicContact CB-CE2 3.95Å
308W90.7Very high92.7Very high204 Ų20453.6 Ų53.677%0.77325%0.246SC*.Hα-helixtrans-76.3-55.2-179.5-168.1-41.1000111.6F304 L305 Y306 R314F304-W308 WeakPolarHBondContact O-CB 3.04Å; F304-W308 PolarHBondContact O-N 3.46Å; L305-W308 PolarHBondContact O-N 3.15Å; Y306-W308 VanDerWaalsContact C-N 3.32Å; Y306-W308 PolarHBondContact O-N 3.38Å; W308-R314 PolarHBondContact O-NH1 2.92Å; W308-R314 VanDerWaalsContact O-NH1 3.14Å
309L89.1Confident92.5Very high49 Ų4955.4 Ų55.426%0.25726%0.261SS..Hα-helixtrans-96.3-19.2-163.8-62.7172000113.7M249 L305M249-L309 HydrophobicContact CB-CB 3.78Å; M249-L309 HydrophobicContact CB-CD1 3.79Å; M249-L309 HydrophobicContact CB-CG 4.45Å; M249-L309 HydrophobicContact CG-CB 3.95Å; M249-L309 HydrophobicContact CG-CD1 4.11Å; M249-L309 HydrophobicContact SD-CB 4.26Å; L305-L309 HydrophobicContact CD2-CD1 4.27Å; L305-L309 WeakPolarHBondContact O-CB 3.31Å; L305-L309 PolarHBondContact O-N 3.47Å
310N88.8Confident92.2Very high17 Ų1756.2 Ų56.29%0.09127%0.265CS..  trans-108.9105.9179.1-166.9-34.6000112.3M249 Y306 N312 F313 R314M249-N310 HydrophobicContact CE-CB 4.47Å; M249-N310 HydrophobicContact SD-CB 3.69Å; Y306-N310 WeakPolarHBondContact O-CA 3.26Å; Y306-N310 WeakPolarHBondContact O-CB 3.26Å; Y306-N310 PolarHBondContact O-N 2.88Å; N310-N312 VanDerWaalsContact C-N 3.27Å; N310-N312 PolarHBondContact O-N 2.79Å; N310-N312 PolarHBondContact OD1-N 3.2Å; N310-F313 HydrophobicContact CB-CB 4.23Å; N310-F313 HydrophobicContact CB-CD2 4.13Å; N310-F313 WeakPolarHBondContact ND2-CD2 3.35Å; N310-F313 PolarHBondContact O-N 2.99Å; N310-F313 PolarHBondContact OD1-N 3.49Å; N310-R314 PolarHBondContact O-N 3.33Å
311N89.7Confident91.7Very high62 Ų6260.9 Ų60.933%0.33228%0.284SS..Hα-helixtrans-58-36.6-179.1-72.3-13.9000113.4R314 Q315N311-R314 PolarHBondContact O-N 2.97Å; N311-R314 PolarHBondContact OD1-NH2 2.98Å; N311-Q315 VanDerWaalsContact O-CG 3.3Å; N311-Q315 WeakPolarHBondContact O-CG 3.12Å; N311-Q315 PolarHBondContact O-N 3.01Å
312N90.8Very high91.2Very high71 Ų7161.7 Ų61.738%0.3829%0.291SS..Hα-helixtrans-70.1-47.3-177.3-66-2000110.5M59 N310 R314 Q315 E316M59-N312 HydrophobicContact CE-CB 4.19Å; M59-N312 HydrophobicContact SD-CB 3.87Å; N310-N312 VanDerWaalsContact C-N 3.27Å; N310-N312 PolarHBondContact O-N 2.79Å; N310-N312 PolarHBondContact OD1-N 3.2Å; N312-R314 VanDerWaalsContact C-N 3.34Å; N312-R314 PolarHBondContact O-N 3.35Å; N312-Q315 PolarHBondContact O-N 2.62Å; N312-E316 WeakPolarHBondContact O-CG 3.07Å; N312-E316 PolarHBondContact O-N 3.27Å
313F91.5Very high89.8Confident0 Ų063.9 Ų63.90%031%0.307CS..Hα-helixtrans-59.3-44.8173.2-87.4-82.7000111.5V49 T52 V53 M59 N64 I67 N310 Q315 E316 F317V49-F313 HydrophobicContact CG1-CE1 4.19Å; T52-F313 HydrophobicContact CG2-CD1 3.72Å; T52-F313 HydrophobicContact CG2-CE1 3.86Å; V53-F313 HydrophobicContact CG2-CE1 4.04Å; V53-F313 HydrophobicContact CG2-CZ 3.95Å; M59-F313 HydrophobicContact CE-CB 4.38Å; M59-F313 HydrophobicContact CE-CD1 3.82Å; M59-F313 HydrophobicContact CE-CD2 3.56Å; M59-F313 HydrophobicContact CE-CE1 3.93Å; M59-F313 HydrophobicContact CE-CE2 3.69Å; M59-F313 HydrophobicContact CE-CG 3.65Å; M59-F313 HydrophobicContact CE-CZ 3.88Å; N64-F313 WeakPolarHBondContact OD1-CE2 3.28Å; I67-F313 HydrophobicContact CD1-CE2 4.26Å; I67-F313 HydrophobicContact CG2-CZ 3.98Å; N310-F313 HydrophobicContact CB-CB 4.23Å; N310-F313 HydrophobicContact CB-CD2 4.13Å; N310-F313 WeakPolarHBondContact ND2-CD2 3.35Å; N310-F313 PolarHBondContact O-N 2.99Å; N310-F313 PolarHBondContact OD1-N 3.49Å; F313-Q315 VanDerWaalsContact C-N 3.29Å; F313-Q315 PolarHBondContact O-N 3.13Å; F313-E316 PolarHBondContact O-N 2.93Å; F313-F317 HydrophobicContact CB-CE1 4.4Å; F313-F317 HydrophobicContact CB-CZ 4.33Å; F313-F317 AromaticContact CD1-CE1 3.67Å; F313-F317 HydrophobicContact CD1-CE1 3.67Å; F313-F317 AromaticContact CD1-CZ 3.85Å; F313-F317 HydrophobicContact CD1-CZ 3.85Å; F313-F317 WeakPolarHBondContact O-CB 3.42Å; F313-F317 VanDerWaalsContact O-CD1 3.25Å; F313-F317 WeakPolarHBondContact O-CD1 3.42Å; F313-F317 WeakPolarHBondContact O-CG 3.47Å; F313-F317 PolarHBondContact O-N 2.03Å
314R93.4Very high88Confident92 Ų9269.6 Ų69.635%0.34734%0.337SS..Hα-helixtrans-58.9-39.9177.9-172.6173.559.9-132.2-0112.8A307 W308 N310 N311 N312 K318A307-R314 WeakPolarHBondContact O-CB 3.21Å; A307-R314 VanDerWaalsContact O-CD 3.32Å; A307-R314 WeakPolarHBondContact O-CD 3.28Å; W308-R314 PolarHBondContact O-NH1 2.92Å; W308-R314 VanDerWaalsContact O-NH1 3.14Å; N310-R314 PolarHBondContact O-N 3.33Å; N311-R314 PolarHBondContact O-N 2.97Å; N311-R314 PolarHBondContact OD1-NH2 2.98Å; N312-R314 VanDerWaalsContact C-N 3.34Å; N312-R314 PolarHBondContact O-N 3.35Å; R314-K318 WeakPolarHBondContact O-CG 3.46Å; R314-K318 PolarHBondContact O-N 3.17Å; R314-K318 VanDerWaalsContact O-N 3.12Å
315Q92.5Very high86Confident127 Ų12770.9 Ų70.959%0.59335%0.349SS*.Hα-helixtrans-66.7-45.4177.6-75173.36.800111.5N311 N312 F313 K318 A319N311-Q315 VanDerWaalsContact O-CG 3.3Å; N311-Q315 WeakPolarHBondContact O-CG 3.12Å; N311-Q315 PolarHBondContact O-N 3.01Å; N312-Q315 PolarHBondContact O-N 2.62Å; F313-Q315 VanDerWaalsContact C-N 3.29Å; F313-Q315 PolarHBondContact O-N 3.13Å; Q315-K318 WeakPolarHBondContact O-CB 3.24Å; Q315-K318 PolarHBondContact O-N 2.88Å; Q315-A319 PolarHBondContact O-N 2.69Å
316E92.8Very high83.8Confident47 Ų4777.4 Ų77.422%0.2238%0.376CS..Hα-helixtrans-64.8-39.7177.5-68.4-71.7173.100112.2T52 S56 M59 N312 F313 K318 A319 I320T52-E316 HydrophobicContact CG2-CB 3.46Å; T52-E316 VanDerWaalsContact CG2-CB 3.46Å; T52-E316 HydrophobicContact CG2-CG 3.92Å; S56-E316 WeakPolarHBondContact CB-OE1 3.49Å; S56-E316 PolarHBondContact OG-OE1 3.37Å; M59-E316 HydrophobicContact CE-CG 4.4Å; M59-E316 HydrophobicContact CG-CG 3.86Å; M59-E316 HydrophobicContact SD-CG 4.14Å; N312-E316 WeakPolarHBondContact O-CG 3.07Å; N312-E316 PolarHBondContact O-N 3.27Å; F313-E316 PolarHBondContact O-N 2.93Å; E316-K318 VanDerWaalsContact C-N 3.35Å; E316-K318 PolarHBondContact O-N 2.79Å; E316-A319 WeakPolarHBondContact O-CB 3.26Å; E316-A319 PolarHBondContact O-N 3.3Å; E316-A319 VanDerWaalsContact O-N 3.16Å; E316-I320 WeakPolarHBondContact O-CG1 3.43Å; E316-I320 PolarHBondContact O-N 3.21Å
317F92.6Very high81.3Confident20 Ų2086.3 Ų86.39%0.08842%0.415CS..Hα-helixtrans-59.1-47.5173.7-69.51000110.5I48 V49 T52 A307 F313 A319 I320 F321I48-F317 HydrophobicContact CG2-CD1 3.46Å; I48-F317 VanDerWaalsContact CG2-CD1 3.46Å; I48-F317 HydrophobicContact CG2-CE1 3.52Å; I48-F317 HydrophobicContact CG2-CG 4.03Å; I48-F317 HydrophobicContact CG2-CZ 4.13Å; V49-F317 HydrophobicContact CG2-CZ 3.94Å; T52-F317 HydrophobicContact CG2-CE1 4.39Å; T52-F317 VanDerWaalsContact OG1-CD1 3.27Å; T52-F317 WeakPolarHBondContact OG1-CD1 3.31Å; T52-F317 VanDerWaalsContact OG1-CE1 3.28Å; T52-F317 WeakPolarHBondContact OG1-CE1 3.39Å; A307-F317 HydrophobicContact CB-CD2 3.93Å; A307-F317 HydrophobicContact CB-CE2 3.95Å; F313-F317 HydrophobicContact CB-CE1 4.4Å; F313-F317 HydrophobicContact CB-CZ 4.33Å; F313-F317 AromaticContact CD1-CE1 3.67Å; F313-F317 HydrophobicContact CD1-CE1 3.67Å; F313-F317 AromaticContact CD1-CZ 3.85Å; F313-F317 HydrophobicContact CD1-CZ 3.85Å; F313-F317 WeakPolarHBondContact O-CB 3.42Å; F313-F317 VanDerWaalsContact O-CD1 3.25Å; F313-F317 WeakPolarHBondContact O-CD1 3.42Å; F313-F317 WeakPolarHBondContact O-CG 3.47Å; F313-F317 PolarHBondContact O-N 2.03Å; F317-A319 VanDerWaalsContact C-N 3.31Å; F317-A319 PolarHBondContact O-N 3.2Å; F317-I320 PolarHBondContact O-N 3.38Å; F317-F321 HydrophobicContact CB-CE2 4.49Å; F317-F321 WeakPolarHBondContact O-CD2 2.94Å; F317-F321 PolarHBondContact O-N 3.39Å; F317-F321 VanDerWaalsContact O-N 3.08Å
318K91.3Very high78.7Confident122 Ų12290.8 Ų90.853%0.5344%0.443SS..Hα-helixtrans-59-41.7175-74.1179.8179.6-168.20112R314 Q315 E316 F321 Q322R314-K318 WeakPolarHBondContact O-CG 3.46Å; R314-K318 PolarHBondContact O-N 3.17Å; R314-K318 VanDerWaalsContact O-N 3.12Å; Q315-K318 WeakPolarHBondContact O-CB 3.24Å; Q315-K318 PolarHBondContact O-N 2.88Å; E316-K318 VanDerWaalsContact C-N 3.35Å; E316-K318 PolarHBondContact O-N 2.79Å; K318-F321 PolarHBondContact O-N 3.34Å; K318-Q322 WeakPolarHBondContact O-CB 3.34Å; K318-Q322 VanDerWaalsContact O-CG 3.23Å; K318-Q322 WeakPolarHBondContact O-CG 3.04Å; K318-Q322 PolarHBondContact O-N 3.34Å
319A90.2Very high76.1Confident41 Ų4186.3 Ų86.334%0.33944%0.438SS..Hα-helixtrans-62.8-42.3178.300000111.9Q315 E316 F317 Q322 C323Q315-A319 PolarHBondContact O-N 2.69Å; E316-A319 WeakPolarHBondContact O-CB 3.26Å; E316-A319 PolarHBondContact O-N 3.3Å; E316-A319 VanDerWaalsContact O-N 3.16Å; F317-A319 VanDerWaalsContact C-N 3.31Å; F317-A319 PolarHBondContact O-N 3.2Å; A319-Q322 PolarHBondContact O-N 3.29Å; A319-C323 WeakPolarHBondContact O-CB 3.44Å; A319-C323 PolarHBondContact O-N 3.42Å; A319-C323 PolarHBondContact O-SG 2.82Å
320I89.2Confident73.4Confident20 Ų2092.1 Ų92.110%0.10347%0.47CS..Hα-helixtrans-60.8-47.6176.2-68.1165.1000110.8I48 L51 T52 E316 F317 Q322 C323I48-I320 HydrophobicContact CG2-CD1 4.32Å; L51-I320 HydrophobicContact CD2-CD1 4.15Å; L51-I320 HydrophobicContact CD2-CG2 4.1Å; L51-I320 HydrophobicContact CG-CD1 4.2Å; T52-I320 VanDerWaalsContact OG1-CD1 3.31Å; T52-I320 WeakPolarHBondContact OG1-CD1 3.32Å; E316-I320 WeakPolarHBondContact O-CG1 3.43Å; E316-I320 PolarHBondContact O-N 3.21Å; F317-I320 PolarHBondContact O-N 3.38Å; I320-Q322 PolarHBondContact O-N 3.06Å; I320-C323 PolarHBondContact O-N 2.95Å
321F86.8Confident70.8Confident115 Ų11598.2 Ų98.250%0.50450%0.502SS..Hα-helixtrans-68.6-31.3178.7-69-64.4000113.3I48 F317 K318I48-F321 HydrophobicContact CD1-CE1 4.38Å; I48-F321 HydrophobicContact CD1-CE2 4.32Å; I48-F321 HydrophobicContact CD1-CZ 3.61Å; F317-F321 HydrophobicContact CB-CE2 4.49Å; F317-F321 WeakPolarHBondContact O-CD2 2.94Å; F317-F321 PolarHBondContact O-N 3.39Å; F317-F321 VanDerWaalsContact O-N 3.08Å; K318-F321 PolarHBondContact O-N 3.34Å
322Q85.4Confident68.1Low115 Ų115101 Ų10154%0.53753%0.527SS..Hα-helixtrans-75.1-32.8175.7-73.9176.14.400113K318 A319 I320 N324 N325 K326K318-Q322 WeakPolarHBondContact O-CB 3.34Å; K318-Q322 VanDerWaalsContact O-CG 3.23Å; K318-Q322 WeakPolarHBondContact O-CG 3.04Å; K318-Q322 PolarHBondContact O-N 3.34Å; A319-Q322 PolarHBondContact O-N 3.29Å; I320-Q322 PolarHBondContact O-N 3.06Å; Q322-N324 PolarHBondContact O-N 2.71Å; Q322-N325 PolarHBondContact O-N 3.21Å; Q322-K326 PolarHBondContact O-N 3.49Å
323C63.5Low65.4Low54 Ų54102.6 Ų102.637%0.36554%0.543SS..Hα-helixtrans-63.9-29.6176.1-81.80000112.5A319 I320 N325 K326A319-C323 WeakPolarHBondContact O-CB 3.44Å; A319-C323 PolarHBondContact O-N 3.42Å; A319-C323 PolarHBondContact O-SG 2.82Å; I320-C323 PolarHBondContact O-N 2.95Å; C323-N325 VanDerWaalsContact C-N 3.25Å; C323-N325 PolarHBondContact O-N 2.92Å; C323-K326 PolarHBondContact O-N 3.38Å
324N57.7Low62.6Low130 Ų130111 Ų11170%0.69558%0.58SS**Hα-helixtrans-68.9-23.4172.7-78.53000113.1Q322Q322-N324 PolarHBondContact O-N 2.71Å
325N50.1Low59.8Low143 Ų143113 Ų11377%0.76560%0.596SS**Hα-helixtrans-93-12.2177.9-74.7-3.2000114Q322 C323Q322-N325 PolarHBondContact O-N 3.21Å; C323-N325 VanDerWaalsContact C-N 3.25Å; C323-N325 PolarHBondContact O-N 2.92Å
326K48.1Very low57Low163 Ų163112.1 Ų112.171%0.70960%0.6SS**SBendtrans-101.87.1-179-77.6-170.4175.9-177.40114.8Q322 C323 C328Q322-K326 PolarHBondContact O-N 3.49Å; C323-K326 PolarHBondContact O-N 3.38Å; K326-C328 VanDerWaalsContact C-N 3.34Å; K326-C328 PolarHBondContact O-N 2.9Å
327F40.1Very low54.1Low189 Ų189116.9 Ų116.983%0.82963%0.632SS**THydrogen-bonded Turntrans-87.411179.1-121-92.5000115.3
328C38.8Very low51.2Low126 Ų126126.7 Ų126.785%0.85167%0.669SS**THydrogen-bonded Turntrans-135.932.5175.1-63.70000115.1K326K326-C328 VanDerWaalsContact C-N 3.34Å; K326-C328 PolarHBondContact O-N 2.9Å
329T35.7Very low48.4Very low109 Ų109125.6 Ų125.667%0.66967%0.674SS**  trans-138.561.8165.857.10000111.6N331T329-N331 VanDerWaalsContact C-N 3.3Å
330N32.6Very low45.6Very low172 Ų172133.6 Ų133.692%0.9270%0.704SS**  trans-94.671.7148.2-90.8-10.6000107.1
331N34.9Very low43Very low144 Ų144138.2 Ų138.277%0.7773%0.733SS**  trans-112.699.5167.2-104.4-6.3000108.3T329 S333T329-N331 VanDerWaalsContact C-N 3.3Å; N331-S333 PolarHBondContact O-N 3.1Å
332S32.3Very low40.2Very low121 Ų121141.9 Ų141.985%0.84675%0.752SS**  trans10.298.8137.2-50.40000116.1
333S34.7Very low37.6Very low104 Ų104141.6 Ų141.673%0.72776%0.763SS**  trans-178.2135.3150.445.60000106.4N331N331-S333 PolarHBondContact O-N 3.1Å
334F33Very low36Very low178 Ų178148.3 Ų148.378%0.78179%0.786SS**  cis-172.5135.812.7-131.5-126.7000104.3
335I32.9Very low34.7Very low133 Ų133148.8 Ų148.868%0.68279%0.793SS**  trans56112.9148.3-36.4176000117
336T35.4Very low33.7Very low108 Ų108147.8 Ų147.866%0.66379%0.787SS**  -172.6114.760.4-420000109.2R338T336-R338 HydrophobicContact CG2-CG 4.34Å; T336-R338 PolarHBondContact O-N 2.88Å
337T31.2Very low32.9Very low148 Ų148144.9 Ų144.991%0.90879%0.787SS**  trans-66.9111.7154.115.20000107.7
338R31.8Very low32.3Very low226 Ų226145.3 Ų145.385%0.85378%0.783SS**  trans-111.4132160.1-105.3-174.9179.1-175.10.9109.2T336T336-R338 HydrophobicContact CG2-CG 4.34Å; T336-R338 PolarHBondContact O-N 2.88Å
339P31.8Very low31.9Very low98 Ų98150 Ų15064%0.63678%0.784SS**  trans-67.9147.6-175.625.5-25.4000109.9T341P339-T341 PolarHBondContact O-N 2.89Å; P339-T341 PolarHBondContact O-OG1 3.48Å
340Q32Very low31.6Very low210 Ų210150.5 Ų150.598%0.98179%0.788SS**  trans-61.886.8166.6-71.7-179.9-16.100108.9
341T33.5Very low31.5Very low116 Ų116149.1 Ų149.171%0.71279%0.79SS**  trans-101.5122.6163.128.70000109P339 S343P339-T341 PolarHBondContact O-N 2.89Å; P339-T341 PolarHBondContact O-OG1 3.48Å; T341-S343 PolarHBondContact O-N 2.88Å
342Q29.6Very low31.2Very low193 Ų193149.4 Ų149.490%0.90279%0.791SS**  trans-20.3119.4162.9-65.9168-800113.9
343S30.4Very low31.3Very low109 Ų109149.4 Ų149.476%0.76278%0.782SS**  trans-151.296.4154-860000109.6T341 V345T341-S343 PolarHBondContact O-N 2.88Å; S343-V345 PolarHBondContact O-N 2.85Å; S343-V345 VanDerWaalsContact O-N 3.1Å
344K29.8Very low31.3Very low194 Ų194150.6 Ų150.684%0.84378%0.78SS**  trans-50.9108.5157.7-79.2173.1171.8173.20107.9I346K344-I346 VanDerWaalsContact C-N 3.29Å; K344-I346 HydrophobicContact CB-CG1 4.34Å; K344-I346 PolarHBondContact O-N 2.76Å
345V30.9Very low31.4Very low140 Ų140148.4 Ų148.485%0.84878%0.777SS**  trans-75.392.9166.4177.30000107.3S343 S347S343-V345 PolarHBondContact O-N 2.85Å; S343-V345 VanDerWaalsContact O-N 3.1Å; V345-S347 PolarHBondContact O-N 3.45Å
346I28.8Very low31.7Very low123 Ų123148.2 Ų148.263%0.63178%0.777SS**  trans-74.199.6168.1-68.8163.2000106.8K344 R348K344-I346 VanDerWaalsContact C-N 3.29Å; K344-I346 HydrophobicContact CB-CG1 4.34Å; K344-I346 PolarHBondContact O-N 2.76Å; I346-R348 HydrophobicContact CG2-CG 4.34Å; I346-R348 PolarHBondContact O-N 3.05Å
347S30.8Very low31.8Very low101 Ų101149.3 Ų149.371%0.70678%0.779SS**  trans-85.495.9162.3171.10000108.5V345V345-S347 PolarHBondContact O-N 3.45Å
348R28Very low32.1Very low198 Ų198149.1 Ų149.175%0.74777%0.772SS**  trans-59.7123171.7-103.7171.9-95.7166.6-8.8111.1I346I346-R348 HydrophobicContact CG2-CG 4.34Å; I346-R348 PolarHBondContact O-N 3.05Å
349Y30Very low32.3Very low224 Ų224147.9 Ų147.988%0.87877%0.773SS**  trans-144.198.9141.2-77.6-72.1000109.4
350T29.4Very low32.5Very low121 Ų121147.3 Ų147.374%0.74278%0.776SS**  trans-84132165.938.60000109.1
351C30.2Very low32.7Very low143 Ų143146.3 Ų146.397%0.96677%0.769SS**  trans-150.1115.1149.3-105.10000110.2
352N29.5Very low32.6Very low149 Ų149147 Ų14780%0.79777%0.768SS**  trans-98168.6179.1-167.719.6000109.6
353N33.1Very low32.9Very low122 Ų122145.9 Ų145.965%0.65277%0.768SS**  trans89.795.2166-83.8-1.5000120.1
354N34.7Very low32.9Very low128 Ų128150 Ų15068%0.68478%0.775SS**  72.8119.3109.1-75.4-4.8000122.1
355N36.6Very low33.1Very low133 Ų133149.4 Ų149.471%0.71178%0.777SS**  trans91.1118.8130.5-75-4.1000122.1
356N38.2Very low33Very low128 Ų128149.7 Ų149.768%0.68477%0.774SS**  trans92.8102.4136.5-69.2-7.9000121.2
357N36.7Very low33Very low132 Ų132149.2 Ų149.271%0.70678%0.781SS**  75.3122.8119.9-67.9-13000122.4
358N38.7Very low33Very low143 Ų143152.1 Ų152.177%0.76579%0.788SS**  trans102.6101.7137.9-67-18.8000121.3
359K36.6Very low33.1Very low201 Ų201149.8 Ų149.887%0.87479%0.791SS**  67.6112.1121.6-102.3178.5174.3173.10121.8
360A35.5Very low33.2Very low86 Ų86146.9 Ų146.971%0.71179%0.785SS**  99.5120114.800000122.2
361K35.9Very low33.2Very low188 Ų188149 Ų14982%0.81779%0.786SS**  trans93.6120.5134.5-83.5-176.6175.4-178.20122.1
362N31.8Very low33.1Very low130 Ų130148.5 Ų148.570%0.69577%0.774SS**  trans62.7119.8140.9-63.74.9000120.5
363D34.9Very low33.3Very low170 Ų170147.6 Ų147.691%0.90977%0.768SS**  -179.3150.4114.8-82.4-21.5000112.1
364H31.6Very low33.3Very low197 Ų197148.2 Ų148.291%0.91277%0.771SS**  trans-113.2118-177.9-139.7-50.8000106.9
365M32.6Very low33.1Very low180 Ų180148.6 Ų148.689%0.88777%0.774SS**  trans-161.3148.7165.9-151.6155.717400112.5
366D30.3Very low32.8Very low146 Ų146149.9 Ų149.978%0.78178%0.775SS**  trans-50.9150.4-175.5-63.2-64.5000117.4
367C27.7Very low32.4Very low114 Ų114150.3 Ų150.377%0.7778%0.777SS**  trans-149.2142.1151.9-85.70000106.5
368D30.1Very low32.1Very low161 Ų161154.3 Ų154.386%0.86179%0.788SS**  -157.2128.773-73.8-39000112.3
369N30.8Very low31.9Very low149 Ų149155 Ų15580%0.79779%0.789SS**  trans-141.3138.5143.6-141.824.4000108.3
370E31.8Very low31.6Very low163 Ų163152.9 Ų152.976%0.76278%0.781SS**  trans72.1114.7160.9-81.9171.4149.300121.8
371E30.1Very low31.5Very low165 Ų165156.5 Ų156.577%0.77178%0.781SS**  67.9112.7129.1-97.6-177173.400121.2
372N28.7Very low31.3Very low133 Ų133151.9 Ų151.971%0.71177%0.773SS**  85.1136.6129.6-127.4-5.4000118.1
373I33.3Very low31.5Very low130 Ų130153.5 Ų153.567%0.66778%0.779SS**  trans82.8104151.2-59.8156.7000117.1
374N31.9Very low31.5Very low135 Ų135151.4 Ų151.472%0.72277%0.768SS**  trans60.8112.3139.2-74.6-18.6000120.8
375N31.1Very low31.6Very low137 Ų137151 Ų15173%0.73376%0.764SS**  83.3124.7121.6-85.5-15.9000120.5
376Q31Very low31.7Very low159 Ų159147.3 Ų147.374%0.74375%0.753SS**  trans97.685.3140.6-62.2-87.4-11.200117.8
377L29.3Very low31.8Very low138 Ų138150.4 Ų150.472%0.72376%0.76SS**  4.2132126.6-84.5116.2000117.7
378K31.4Very low31.9Very low215 Ų215148.3 Ų148.394%0.93576%0.757SS**  -154.3126.5122.6-113.8170.2-172.3176.20113.8
379M32.9Very low32Very low159 Ų159150.1 Ų150.178%0.78376%0.761SS**  trans-74.1154.8174.9-70-167.5-82.900113.7
380H31.6Very low31.8Very low156 Ų156151.9 Ų151.972%0.72276%0.764SS**  trans-178.9145.4130.2-114.1-144.8000108.6
381K33.4Very low31.6Very low162 Ų162150.1 Ų150.170%0.70476%0.764SS**  cis-170.4140.5-0.1-137-175.3-166.8169.70106.8
382S31.9Very low31.3Very low91 Ų91147.7 Ų147.764%0.63677%0.765SS**  trans42.5127.7134.5170.20000118.8
383I34.9Very low31.2Very low164 Ų164151.4 Ų151.484%0.84177%0.771SS**  -155.213892.9-84148000113
384N34.7Very low30.7Very low126 Ų126153.9 Ų153.967%0.67478%0.782SS**  trans-36.6132.4173.2-78.1-44.4000119.8
385K34.7Very low30.4Very low189 Ų189153.7 Ų153.782%0.82279%0.786SS**  75.3163.1102.9-85.2-173.4176.6174.80116.7
386P35Very low30.2Very low102 Ų102154.5 Ų154.566%0.66279%0.788SS**  cis-141.8172.3-3338.3-19.4000115.9
387K31.8Very low30.1Very low210 Ų210151.2 Ų151.291%0.91379%0.788SS**  trans62.5118.5145.5-75.6176.3-178.9-1720122.1
388G29.4Very low30.1Very low70 Ų70151.9 Ų151.972%0.72279%0.793SS**  122.1109.6123.200000117.1
389Q32Very low30.1Very low199 Ų199145.6 Ų145.693%0.9379%0.789SS**  trans-175.7138.6131-102.9168.56.300112.1
390H27Very low30Very low187 Ų187145.4 Ų145.487%0.86679%0.791SS**  trans-61.5143.1179.2-91.8-116000113.2
391T27.8Very low29.9Very low125 Ų125142.3 Ų142.377%0.76780%0.801SS**  trans-155.9126.9146.29.80000109.8
392S23.9Very low29.7Very low114 Ų114137.3 Ų137.380%0.79780%0.795SS**  trans-65.9135.3-174.9-60.80000113.2
393Y26.5Very low29.5Very low211 Ų211139.6 Ų139.683%0.82781%0.805SS**  trans-138.1138.5161-72.8-79.6000111.3
394M23.3Very low29.2Very low183 Ų183143.2 Ų143.290%0.90181%0.809SS**  trans-79.8121.4-177.6-174.8171.6179.500110.2
395T24.3Very low28.8Very low130 Ų130146 Ų14680%0.79882%0.818SS**  trans-94.3123.1-178-47.40000110.2
396I26.8Very low28.6Very low154 Ų154139.9 Ų139.979%0.7981%0.808SS**  trans-104.1121.4163.4-64.6179.4000107.4
397A28.7Very low28.4Very low90 Ų90141.2 Ų141.274%0.74482%0.816SS**  trans-85.2122.4-176.700000111.4
398D30.7Very low28.4Very low153 Ų153137.9 Ų137.982%0.81881%0.813SS**  trans-94.4134.5159.1-92-28.1000109D400D398-D400 PolarHBondContact O-N 3.34Å
399G30.8Very low28.6Very low82 Ų82140.5 Ų140.585%0.84582%0.819SS**SBendtrans-69.725.2-170.200000117.2
400D31Very low28.7Very low156 Ų156136.3 Ų136.383%0.83481%0.812SS**SBendtrans-149.466.1173.5-91.8-30.4000110.5D398 G402D398-D400 PolarHBondContact O-N 3.34Å; D400-G402 VanDerWaalsContact C-N 3.26Å; D400-G402 PolarHBondContact O-N 2.76Å
401G28.8Very low29Very low91 Ų91136.2 Ų136.294%0.93881%0.812SS**  trans46.513.414600000122.5
402G30.4Very low29.6Very low56 Ų56138.1 Ų138.158%0.57782%0.815SS**  trans-127.9114-173.400000113.6D400D400-G402 VanDerWaalsContact C-N 3.26Å; D400-G402 PolarHBondContact O-N 2.76Å
403V28.1Very low30.3Very low139 Ų139145.6 Ų145.684%0.84283%0.834SS**  trans-79.5117.2172.5177.30000109.1
404W26.9Very low30.5Very low241 Ų241142.3 Ų142.391%0.91383%0.834SS**  trans-109.1117.2169.3-87.192.7000110.5
405Q26.4Very low30.9Very low185 Ų185140.2 Ų140.286%0.86483%0.83SS**  trans-104.4118.9163-74.3175.7-27.600107.6
406G31.3Very low31.3Very low59 Ų59140.7 Ų140.761%0.60883%0.832SS**  trans-127.2150173.600000110.4V408G406-V408 PolarHBondContact O-N 3.37Å
407P29.7Very low31.5Very low130 Ų130139.9 Ų139.984%0.84484%0.835SS**  trans-70.6130.6-167.127.3-32.7000112.4C409P407-C409 PolarHBondContact O-N 2.72Å
408V32.8Very low31.7Very low140 Ų140143.1 Ų143.185%0.84884%0.84SS**  trans-75.8112.4165.6177.60000107.3G406 S410G406-V408 PolarHBondContact O-N 3.37Å; V408-S410 PolarHBondContact O-N 3.1Å
409C33.2Very low31.8Very low125 Ų125142.4 Ų142.485%0.84584%0.842SS**  trans-78.4115164.4-79.50000108.7P407P407-C409 PolarHBondContact O-N 2.72Å
410S33.9Very low31.9Very low111 Ų111146.7 Ų146.778%0.77684%0.841SS**  trans-69147.3165.748.60000111.6V408V408-S410 PolarHBondContact O-N 3.1Å
411E33Very low31.9Very low185 Ų185146 Ų14686%0.86484%0.842SS**  trans-50.6150-175-67.6167.2142.100116.4
412I41.5Very low32.2Very low165 Ų165150.6 Ų150.685%0.84683%0.834SS**  trans-131.9111.1145.5-60.4-179.7000108
413K38.9Very low32.3Very low271 Ų271159.2 Ų159.2100%1.17886%0.857SS**  trans75.70172.8-75.4-172177.4-177.40120.1

Retrieved 413 of 413 residues in 911.8 ms (Link to these results)

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