A0A087XCI5_POEFO Loading...

Tetraspanin

Regulates the proliferation and migration of oligodendrocytes, a process essential for normal myelination and repair.

AlphaFold DB (A0A3B3VU86), UniProt , Accession A0A087XCI5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 252 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
1M43.5Very low65.7Low201 Ų20186.5 Ų86.599%0.9950%0.497SS*.  0-56.90-69.5-176.1175.300113.4G3 Q4 C5M1-G3 PolarHBondContact O-N 2.92Å; M1-Q4 PolarHBondContact O-N 3.28Å; M1-C5 PolarHBondContact O-N 3.2Å
2M46.2Very low67.2Low187 Ų18786.9 Ų86.992%0.92150%0.502SS*.Hα-helixtrans-59.3-36.9176.9-84.2167.6146.800114.4
3G57.7Low68.7Low42 Ų4284.4 Ų84.443%0.43349%0.488SS..Hα-helixtrans-70.8-33.2178.100000115.1M1 I7 R235M1-G3 PolarHBondContact O-N 2.92Å; G3-I7 WeakPolarHBondContact O-CG1 3.49Å; G3-I7 PolarHBondContact O-N 3.38Å; G3-R235 PolarHBondContact O-NH1 2.91Å
4Q60.7Low69.8Low132 Ų13278.5 Ų78.562%0.61745%0.454SS*.Hα-helixtrans-72.6-39.4-179.8-87.5152.7-35.200112.1M1 G6 I7 T8M1-Q4 PolarHBondContact O-N 3.28Å; Q4-G6 VanDerWaalsContact C-N 3.3Å; Q4-G6 PolarHBondContact O-N 3.12Å; Q4-I7 PolarHBondContact O-N 3.36Å; Q4-T8 PolarHBondContact O-N 3.17Å; Q4-T8 VanDerWaalsContact O-N 3.09Å; Q4-T8 PolarHBondContact O-OG1 3.45Å; Q4-T8 VanDerWaalsContact O-OG1 3.13Å
5C62Low71Confident93 Ų9375.5 Ų75.563%0.62844%0.438SS*.Hα-helixtrans-61-40.1177.8-163.50000111.8M1 S9M1-C5 PolarHBondContact O-N 3.2Å; C5-S9 WeakPolarHBondContact O-CB 3.22Å; C5-S9 PolarHBondContact O-N 3.29Å
6G68.8Low72.1Confident24 Ų2478.8 Ų78.825%0.24745%0.445CS..Hα-helixtrans-69.8-30.1176.900000114.7Q4 S10Q4-G6 VanDerWaalsContact C-N 3.3Å; Q4-G6 PolarHBondContact O-N 3.12Å; G6-S10 WeakPolarHBondContact O-CB 3.5Å; G6-S10 PolarHBondContact O-N 3.23Å; G6-S10 VanDerWaalsContact O-N 3.13Å; G6-S10 PolarHBondContact O-OG 3.26Å
7I69.4Low73Confident46 Ų4675.8 Ų75.824%0.23643%0.428CS..Hα-helixtrans-71.7-47.3175.6-65.4169.2000109.8G3 Q4 S9 S10 K11 R235G3-I7 WeakPolarHBondContact O-CG1 3.49Å; G3-I7 PolarHBondContact O-N 3.38Å; Q4-I7 PolarHBondContact O-N 3.36Å; I7-S9 VanDerWaalsContact C-N 3.33Å; I7-S9 PolarHBondContact O-N 3Å; I7-S10 PolarHBondContact O-N 2.99Å; I7-K11 HydrophobicContact CG2-CD 4.06Å; I7-K11 HydrophobicContact CG2-CG 4.44Å; I7-K11 WeakPolarHBondContact O-CG 3.38Å; I7-K11 PolarHBondContact O-N 3.47Å; I7-R235 HydrophobicContact CD1-CB 4.18Å; I7-R235 HydrophobicContact CG1-CB 4.46Å; I7-R235 VanDerWaalsContact CG1-CD 3.49Å
8T73.4Confident73.9Confident89 Ų8972.1 Ų72.155%0.54641%0.407SS..Hα-helixtrans-60.9-43.8178.1-51.80000110.9Q4 S10 K11 T12Q4-T8 PolarHBondContact O-N 3.17Å; Q4-T8 VanDerWaalsContact O-N 3.09Å; Q4-T8 PolarHBondContact O-OG1 3.45Å; Q4-T8 VanDerWaalsContact O-OG1 3.13Å; T8-S10 PolarHBondContact O-N 3.27Å; T8-K11 PolarHBondContact O-N 2.92Å; T8-T12 PolarHBondContact O-N 3.5Å; T8-T12 PolarHBondContact O-OG1 3.09Å
9S78.8Confident74.7Confident71 Ų7172.8 Ų72.850%0.49741%0.409SS..Hα-helixtrans-59.9-46.5175.6178.10000112.5C5 I7 K11 T12 V13C5-S9 WeakPolarHBondContact O-CB 3.22Å; C5-S9 PolarHBondContact O-N 3.29Å; I7-S9 VanDerWaalsContact C-N 3.33Å; I7-S9 PolarHBondContact O-N 3Å; S9-K11 PolarHBondContact O-N 3.01Å; S9-T12 PolarHBondContact O-N 3.19Å; S9-V13 WeakPolarHBondContact O-CG2 3.45Å; S9-V13 PolarHBondContact O-N 3Å
10S80.8Confident75.5Confident22 Ų2273.5 Ų73.515%0.15441%0.41CS..Hα-helixtrans-65-39.7179.8-56.40000112.6G6 I7 T8 L14G6-S10 WeakPolarHBondContact O-CB 3.5Å; G6-S10 PolarHBondContact O-N 3.23Å; G6-S10 VanDerWaalsContact O-N 3.13Å; G6-S10 PolarHBondContact O-OG 3.26Å; I7-S10 PolarHBondContact O-N 2.99Å; T8-S10 PolarHBondContact O-N 3.27Å; S10-L14 WeakPolarHBondContact O-CB 3.4Å; S10-L14 PolarHBondContact O-N 3.4Å
11K81.6Confident76.1Confident45 Ų4573.1 Ų73.120%0.19641%0.405CS..Hα-helixtrans-64.2-45.6175.4-74.1177.8175177.90111.4I7 T8 S9 V13 L14 V15 T76 E79 V232I7-K11 HydrophobicContact CG2-CD 4.06Å; I7-K11 HydrophobicContact CG2-CG 4.44Å; I7-K11 WeakPolarHBondContact O-CG 3.38Å; I7-K11 PolarHBondContact O-N 3.47Å; T8-K11 PolarHBondContact O-N 2.92Å; S9-K11 PolarHBondContact O-N 3.01Å; K11-V13 PolarHBondContact O-N 3.18Å; K11-L14 PolarHBondContact O-N 3.38Å; K11-V15 WeakPolarHBondContact O-CG2 3.46Å; K11-V15 PolarHBondContact O-N 3.28Å; K11-T76 HydrophobicContact CB-CG2 4.43Å; K11-E79 IonicContact NZ-OE1 2.63Å; K11-E79 PolarHBondContact NZ-OE1 2.89Å; K11-E79 IonicContact NZ-OE2 3.14Å; K11-E79 PolarHBondContact NZ-OE2 3.37Å; K11-E79 VanDerWaalsContact NZ-OE2 3.14Å; K11-V232 HydrophobicContact CG-CG2 4.08Å
12T84.3Confident78.4Confident91 Ų9168 Ų6856%0.55837%0.374SS*.Hα-helixtrans-61.3-44.2178.3-57.60000111.5T8 S9 L14 V15 F16T8-T12 PolarHBondContact O-N 3.5Å; T8-T12 PolarHBondContact O-OG1 3.09Å; S9-T12 PolarHBondContact O-N 3.19Å; T12-L14 PolarHBondContact O-N 3.41Å; T12-V15 PolarHBondContact O-N 2.99Å; T12-F16 VanDerWaalsContact O-CB 3.3Å; T12-F16 WeakPolarHBondContact O-CB 3.4Å; T12-F16 PolarHBondContact O-N 3.49Å
13V85.7Confident80.6Confident54 Ų5461.1 Ų61.133%0.32735%0.348SS..Hα-helixtrans-60.6-45.7175.6171.40000110.8S9 K11 V15 F16 L17S9-V13 WeakPolarHBondContact O-CG2 3.45Å; S9-V13 PolarHBondContact O-N 3Å; K11-V13 PolarHBondContact O-N 3.18Å; V13-V15 PolarHBondContact O-N 3.38Å; V13-F16 PolarHBondContact O-N 2.81Å; V13-L17 HydrophobicContact CG1-CD1 3.83Å; V13-L17 HydrophobicContact CG1-CG 4.25Å; V13-L17 WeakPolarHBondContact O-CB 3.2Å; V13-L17 VanDerWaalsContact O-CG 3.31Å; V13-L17 WeakPolarHBondContact O-CG 3.34Å; V13-L17 PolarHBondContact O-N 3.14Å
14L84.9Confident82.2Confident2 Ų261.2 Ų61.21%0.0135%0.345CS..Hα-helixtrans-64.1-43-178.9-164.666.8000112.2S10 K11 T12 N18 T76 L84 F87 C228 A229S10-L14 WeakPolarHBondContact O-CB 3.4Å; S10-L14 PolarHBondContact O-N 3.4Å; K11-L14 PolarHBondContact O-N 3.38Å; T12-L14 PolarHBondContact O-N 3.41Å; L14-N18 WeakPolarHBondContact O-CB 3.25Å; L14-N18 PolarHBondContact O-N 2.87Å; L14-N18 PolarHBondContact O-ND2 2.94Å; L14-T76 HydrophobicContact CB-CG2 4.39Å; L14-T76 HydrophobicContact CD2-CG2 4.07Å; L14-T76 WeakPolarHBondContact CD2-OG1 3.31Å; L14-L84 HydrophobicContact CD2-CD1 3.96Å; L14-F87 HydrophobicContact CD1-CE1 4.05Å; L14-C228 HydrophobicContact CD1-CB 4.37Å; L14-A229 HydrophobicContact CD2-CB 4.26Å
15V87.3Confident83.8Confident34 Ų3455 Ų5521%0.20632%0.316CS..Hα-helixtrans-63.4-45.8175.4172.70000110.5K11 T12 V13 L17 N18 L19 T76 V77K11-V15 WeakPolarHBondContact O-CG2 3.46Å; K11-V15 PolarHBondContact O-N 3.28Å; T12-V15 PolarHBondContact O-N 2.99Å; V13-V15 PolarHBondContact O-N 3.38Å; V15-L17 PolarHBondContact O-N 3.16Å; V15-N18 PolarHBondContact O-N 2.97Å; V15-L19 HydrophobicContact CG1-CD1 3.96Å; V15-L19 HydrophobicContact CG1-CG 4.33Å; V15-L19 WeakPolarHBondContact O-CG 3.41Å; V15-L19 PolarHBondContact O-N 3.05Å; V15-T76 HydrophobicContact CG2-CG2 3.6Å; V15-V77 HydrophobicContact CG2-CG2 4.41Å
16F89.4Confident85.2Confident127 Ų12751.9 Ų51.956%0.55730%0.299SS*.Hα-helixtrans-61.1-46.4179.6-178.4-104.3000112.4T12 V13 N18 L19 I20T12-F16 VanDerWaalsContact O-CB 3.3Å; T12-F16 WeakPolarHBondContact O-CB 3.4Å; T12-F16 PolarHBondContact O-N 3.49Å; V13-F16 PolarHBondContact O-N 2.81Å; F16-N18 PolarHBondContact O-N 3.47Å; F16-L19 PolarHBondContact O-N 3.47Å; F16-I20 HydrophobicContact CD1-CD1 3.82Å; F16-I20 HydrophobicContact CE1-CD1 3.28Å; F16-I20 HydrophobicContact CE1-CG1 4.35Å; F16-I20 HydrophobicContact CE2-CD1 4.29Å; F16-I20 HydrophobicContact CZ-CD1 3.56Å; F16-I20 HydrophobicContact CZ-CG1 4.35Å; F16-I20 PolarHBondContact O-N 3.49Å
17L87.1Confident86.4Confident29 Ų2956 Ų5615%0.15231%0.314CS..Hα-helixtrans-60.9-45.3176.1-70.8175.4000111.7V13 V15 L19 I20 F21 I221 L224V13-L17 HydrophobicContact CG1-CD1 3.83Å; V13-L17 HydrophobicContact CG1-CG 4.25Å; V13-L17 WeakPolarHBondContact O-CB 3.2Å; V13-L17 VanDerWaalsContact O-CG 3.31Å; V13-L17 WeakPolarHBondContact O-CG 3.34Å; V13-L17 PolarHBondContact O-N 3.14Å; V15-L17 PolarHBondContact O-N 3.16Å; L17-L19 VanDerWaalsContact C-N 3.32Å; L17-L19 PolarHBondContact O-N 3.15Å; L17-I20 PolarHBondContact O-N 3.42Å; L17-F21 WeakPolarHBondContact O-CD2 3.33Å; L17-F21 PolarHBondContact O-N 2.93Å; L17-I221 HydrophobicContact CD1-CG2 4.41Å; L17-I221 HydrophobicContact CD2-CG2 4.05Å; L17-L224 HydrophobicContact CD1-CD2 4.27Å
18N88.7Confident87.5Confident8 Ų857.7 Ų57.74%0.04332%0.323CS..Hα-helixtrans-62.7-37.5177.2-82.5-73000112.5L14 V15 F16 F21 W22 F87L14-N18 WeakPolarHBondContact O-CB 3.25Å; L14-N18 PolarHBondContact O-N 2.87Å; L14-N18 PolarHBondContact O-ND2 2.94Å; V15-N18 PolarHBondContact O-N 2.97Å; F16-N18 PolarHBondContact O-N 3.47Å; N18-F21 PolarHBondContact O-N 2.96Å; N18-W22 WeakPolarHBondContact O-CB 3.5Å; N18-W22 PolarHBondContact O-N 3.17Å; N18-F87 VanDerWaalsContact OD1-CE2 3.3Å; N18-F87 WeakPolarHBondContact OD1-CE2 3.21Å; N18-F87 VanDerWaalsContact OD1-CZ 3.25Å; N18-F87 WeakPolarHBondContact OD1-CZ 3.48Å
19L89.6Confident88.4Confident86 Ų8654.9 Ų54.945%0.4531%0.307SS..Hα-helixtrans-66.7-39.9176.2-73.4174.5000112.3V15 F16 L17 W22 A23V15-L19 HydrophobicContact CG1-CD1 3.96Å; V15-L19 HydrophobicContact CG1-CG 4.33Å; V15-L19 WeakPolarHBondContact O-CG 3.41Å; V15-L19 PolarHBondContact O-N 3.05Å; F16-L19 PolarHBondContact O-N 3.47Å; L17-L19 VanDerWaalsContact C-N 3.32Å; L17-L19 PolarHBondContact O-N 3.15Å; L19-W22 PolarHBondContact O-N 3.36Å; L19-A23 WeakPolarHBondContact O-CB 3.49Å; L19-A23 PolarHBondContact O-N 2.91Å
20I89.9Confident89.1Confident86 Ų8659.3 Ų59.344%0.44131%0.314SS..Hα-helixtrans-61.6-49.8174.4-71.5173.1000110.2F16 L17 W22 A23 A24F16-I20 HydrophobicContact CD1-CD1 3.82Å; F16-I20 HydrophobicContact CE1-CD1 3.28Å; F16-I20 HydrophobicContact CE1-CG1 4.35Å; F16-I20 HydrophobicContact CE2-CD1 4.29Å; F16-I20 HydrophobicContact CZ-CD1 3.56Å; F16-I20 HydrophobicContact CZ-CG1 4.35Å; F16-I20 PolarHBondContact O-N 3.49Å; L17-I20 PolarHBondContact O-N 3.42Å; I20-W22 VanDerWaalsContact C-N 3.31Å; I20-W22 PolarHBondContact O-N 2.62Å; I20-A23 PolarHBondContact O-N 3.21Å; I20-A24 WeakPolarHBondContact O-CB 3.29Å; I20-A24 PolarHBondContact O-N 3.15Å
21F88.1Confident89.6Confident66 Ų6661.7 Ų61.729%0.28933%0.327SS..Hα-helixtrans-62.4-40.5179.1-75.9-58.1000112.4L17 N18 A24 A25 F218 I221L17-F21 WeakPolarHBondContact O-CD2 3.33Å; L17-F21 PolarHBondContact O-N 2.93Å; N18-F21 PolarHBondContact O-N 2.96Å; F21-A24 PolarHBondContact O-N 3.34Å; F21-A25 VanDerWaalsContact O-CB 3.26Å; F21-A25 WeakPolarHBondContact O-CB 3.43Å; F21-A25 PolarHBondContact O-N 2.99Å; F21-F218 HydrophobicContact CD1-CE2 4.32Å; F21-F218 AromaticContact CE1-CD2 3.87Å; F21-F218 HydrophobicContact CE1-CD2 3.87Å; F21-F218 AromaticContact CE1-CE2 3.63Å; F21-F218 HydrophobicContact CE1-CE2 3.63Å; F21-F218 HydrophobicContact CZ-CD2 4.28Å; F21-F218 HydrophobicContact CZ-CE2 4.11Å; F21-I221 HydrophobicContact CE2-CG2 3.51Å; F21-I221 HydrophobicContact CZ-CB 4.14Å; F21-I221 HydrophobicContact CZ-CD1 4.44Å; F21-I221 HydrophobicContact CZ-CG2 3.42Å; F21-I221 VanDerWaalsContact CZ-CG2 3.42Å
22W91.9Very high89.9Confident93 Ų9359.7 Ų59.735%0.35232%0.319SS..Hα-helixtrans-62.2-44.7176.5-179.782.3000112.1N18 L19 I20 A25 G26 F66 L70N18-W22 WeakPolarHBondContact O-CB 3.5Å; N18-W22 PolarHBondContact O-N 3.17Å; L19-W22 PolarHBondContact O-N 3.36Å; I20-W22 VanDerWaalsContact C-N 3.31Å; I20-W22 PolarHBondContact O-N 2.62Å; W22-A25 PolarHBondContact O-N 3.27Å; W22-G26 PolarHBondContact O-N 3Å; W22-F66 AromaticContact CD1-CD2 3.68Å; W22-F66 AromaticContact CD1-CE2 3.8Å; W22-F66 HydrophobicContact CD2-CD2 4.44Å; W22-F66 HydrophobicContact CD2-CE2 4.05Å; W22-F66 AromaticContact CE2-CD2 3.89Å; W22-F66 AromaticContact CE2-CE2 3.19Å; W22-F66 AromaticContact CE2-CZ 3.46Å; W22-F66 VanDerWaalsContact CE2-CZ 3.46Å; W22-F66 HydrophobicContact CG-CD2 4.34Å; W22-F66 HydrophobicContact CG-CE2 4.38Å; W22-F66 HydrophobicContact CH2-CE2 4.34Å; W22-F66 HydrophobicContact CZ2-CD2 4.48Å; W22-F66 AromaticContact CZ2-CE2 3.39Å; W22-F66 HydrophobicContact CZ2-CE2 3.39Å; W22-F66 AromaticContact CZ2-CZ 3.43Å; W22-F66 HydrophobicContact CZ2-CZ 3.43Å; W22-F66 VanDerWaalsContact CZ2-CZ 3.43Å; W22-F66 AromaticContact NE1-CD1 3.9Å; W22-F66 AromaticContact NE1-CD2 3.37Å; W22-F66 AromaticContact NE1-CE1 3.57Å; W22-F66 AromaticContact NE1-CE2 3Å; W22-F66 AromaticContact NE1-CG 3.82Å; W22-F66 AromaticContact NE1-CZ 3.12Å; W22-L70 VanDerWaalsContact NE1-CD2 3.29Å
23A92.7Very high90.2Very high44 Ų4457.1 Ų57.136%0.36431%0.308SS..Hα-helixtrans-64.9-44.8176.400000111.7L19 I20 A25 G26 I27L19-A23 WeakPolarHBondContact O-CB 3.49Å; L19-A23 PolarHBondContact O-N 2.91Å; I20-A23 PolarHBondContact O-N 3.21Å; A23-A25 VanDerWaalsContact C-N 3.33Å; A23-A25 PolarHBondContact O-N 3.49Å; A23-G26 PolarHBondContact O-N 3.47Å; A23-I27 WeakPolarHBondContact O-CG1 3.35Å; A23-I27 PolarHBondContact O-N 3.21Å
24A92Very high90.4Very high44 Ų4461.5 Ų61.536%0.36432%0.319SS..Hα-helixtrans-60.4-42.8176.100000111.7I20 F21 I27 L28I20-A24 WeakPolarHBondContact O-CB 3.29Å; I20-A24 PolarHBondContact O-N 3.15Å; F21-A24 PolarHBondContact O-N 3.34Å; A24-I27 PolarHBondContact O-N 3.24Å; A24-L28 WeakPolarHBondContact O-CG 3.33Å; A24-L28 PolarHBondContact O-N 2.79Å
25A92.8Very high90.5Very high1 Ų164 Ų641%0.00833%0.334CS..Hα-helixtrans-63.2-41175.700000112.1F21 W22 A23 I27 L28 C29 L65 F66F21-A25 VanDerWaalsContact O-CB 3.26Å; F21-A25 WeakPolarHBondContact O-CB 3.43Å; F21-A25 PolarHBondContact O-N 2.99Å; W22-A25 PolarHBondContact O-N 3.27Å; A23-A25 VanDerWaalsContact C-N 3.33Å; A23-A25 PolarHBondContact O-N 3.49Å; A25-I27 PolarHBondContact O-N 3.26Å; A25-L28 PolarHBondContact O-N 2.84Å; A25-C29 PolarHBondContact O-N 3.36Å; A25-C29 PolarHBondContact O-SG 3.33Å; A25-C29 VanDerWaalsContact O-SG 3.36Å; A25-L65 HydrophobicContact CB-CB 3.79Å; A25-F66 HydrophobicContact CB-CB 4.01Å
26G93.1Very high90.4Very high27 Ų2765.5 Ų65.528%0.27834%0.338SS..Hα-helixtrans-60.9-42.6174.300000112.8W22 A23 C29 Y30W22-G26 PolarHBondContact O-N 3Å; A23-G26 PolarHBondContact O-N 3.47Å; G26-C29 PolarHBondContact O-N 3.22Å; G26-Y30 WeakPolarHBondContact O-CB 3.31Å; G26-Y30 PolarHBondContact O-N 2.94Å
27I93.9Very high90.2Very high110 Ų11064.2 Ų64.256%0.56434%0.336SS*.Hα-helixtrans-64.4-44.4175.2-65.9166000110.6A23 A24 A25 C29 Y30 V31A23-I27 WeakPolarHBondContact O-CG1 3.35Å; A23-I27 PolarHBondContact O-N 3.21Å; A24-I27 PolarHBondContact O-N 3.24Å; A25-I27 PolarHBondContact O-N 3.26Å; I27-C29 PolarHBondContact O-N 2.89Å; I27-Y30 WeakPolarHBondContact O-CB 3.44Å; I27-Y30 PolarHBondContact O-N 3.49Å; I27-V31 HydrophobicContact CG2-CG2 4.35Å; I27-V31 WeakPolarHBondContact O-CG2 3.35Å; I27-V31 PolarHBondContact O-N 3.26Å
28L91.5Very high90Very high83 Ų8364.9 Ų64.944%0.43534%0.341SS..Hα-helixtrans-60.7-44.2177.4-75.8170.3000112.1A24 A25 Y30 V31 G32A24-L28 WeakPolarHBondContact O-CG 3.33Å; A24-L28 PolarHBondContact O-N 2.79Å; A25-L28 PolarHBondContact O-N 2.84Å; L28-Y30 VanDerWaalsContact C-N 3.34Å; L28-Y30 PolarHBondContact O-N 2.99Å; L28-V31 PolarHBondContact O-N 3.47Å; L28-G32 PolarHBondContact O-N 3.31Å
29C92.3Very high89.3Confident30 Ų3069.6 Ų69.620%0.20336%0.359CS..Hα-helixtrans-59.8-44.5173.9-73.80000112A25 G26 I27 G32 A33 G62 A63A25-C29 PolarHBondContact O-N 3.36Å; A25-C29 PolarHBondContact O-SG 3.33Å; A25-C29 VanDerWaalsContact O-SG 3.36Å; G26-C29 PolarHBondContact O-N 3.22Å; I27-C29 PolarHBondContact O-N 2.89Å; C29-G32 PolarHBondContact O-N 3.33Å; C29-A33 VanDerWaalsContact O-CB 3.29Å; C29-A33 WeakPolarHBondContact O-CB 3.4Å; C29-A33 PolarHBondContact O-N 2.91Å; C29-G62 VanDerWaalsContact SG-CA 3.59Å; C29-A63 PolarHBondContact SG-N 3.2Å
30Y92.8Very high88.4Confident164 Ų16469.4 Ų69.464%0.64336%0.358SS*.Hα-helixtrans-61.5-48.5178.6172.6-97.5000111.7G26 I27 L28 A33 Y34G26-Y30 WeakPolarHBondContact O-CB 3.31Å; G26-Y30 PolarHBondContact O-N 2.94Å; I27-Y30 WeakPolarHBondContact O-CB 3.44Å; I27-Y30 PolarHBondContact O-N 3.49Å; L28-Y30 VanDerWaalsContact C-N 3.34Å; L28-Y30 PolarHBondContact O-N 2.99Å; Y30-A33 PolarHBondContact O-N 2.88Å; Y30-Y34 WeakPolarHBondContact O-CB 3.31Å; Y30-Y34 PolarHBondContact O-N 3.23Å
31V91.4Very high87.3Confident72 Ų7271.5 Ų71.544%0.43637%0.371SS..Hα-helixtrans-63.4-44.3177.8174.20000110.8I27 L28 A33 Y34 V35I27-V31 HydrophobicContact CG2-CG2 4.35Å; I27-V31 WeakPolarHBondContact O-CG2 3.35Å; I27-V31 PolarHBondContact O-N 3.26Å; L28-V31 PolarHBondContact O-N 3.47Å; V31-A33 PolarHBondContact O-N 3.44Å; V31-Y34 PolarHBondContact O-N 3.07Å; V31-V35 WeakPolarHBondContact O-CG2 3.27Å; V31-V35 PolarHBondContact O-N 3.49Å
32G89.4Confident86.1Confident2 Ų274.6 Ų74.62%0.02138%0.381CS..Hα-helixtrans-59.7-46.8177.200000112.3L28 C29 V35 F36L28-G32 PolarHBondContact O-N 3.31Å; C29-G32 PolarHBondContact O-N 3.33Å; G32-V35 PolarHBondContact O-N 3.36Å; G32-F36 WeakPolarHBondContact O-CB 3.39Å; G32-F36 PolarHBondContact O-N 3.04Å
33A89.9Confident84.3Confident38 Ų3873.2 Ų73.231%0.31438%0.381SS..Hα-helixtrans-64.6-39.9176.900000112.2C29 Y30 V31 F36 I37C29-A33 VanDerWaalsContact O-CB 3.29Å; C29-A33 WeakPolarHBondContact O-CB 3.4Å; C29-A33 PolarHBondContact O-N 2.91Å; Y30-A33 PolarHBondContact O-N 2.88Å; V31-A33 PolarHBondContact O-N 3.44Å; A33-F36 PolarHBondContact O-N 3.39Å; A33-I37 VanDerWaalsContact O-CG1 3.3Å; A33-I37 WeakPolarHBondContact O-CG1 3.34Å; A33-I37 PolarHBondContact O-N 3.45Å
34Y90.4Very high82.4Confident146 Ų14680.5 Ų80.557%0.57341%0.407SS*.Hα-helixtrans-60.5-45.9175.6177.6-99.3000111.6Y30 V31 T38Y30-Y34 WeakPolarHBondContact O-CB 3.31Å; Y30-Y34 PolarHBondContact O-N 3.23Å; V31-Y34 PolarHBondContact O-N 3.07Å; Y34-T38 VanDerWaalsContact O-CB 3.29Å; Y34-T38 WeakPolarHBondContact O-CB 3.12Å; Y34-T38 PolarHBondContact O-N 3.28Å; Y34-T38 PolarHBondContact O-OG1 3.05Å
35V86.1Confident80.5Confident53 Ų5385.6 Ų85.632%0.32142%0.421SS..Hα-helixtrans-63-47.8175.3173.40000110.3V31 G32 I37 T38 Y39 A55V31-V35 WeakPolarHBondContact O-CG2 3.27Å; V31-V35 PolarHBondContact O-N 3.49Å; G32-V35 PolarHBondContact O-N 3.36Å; V35-I37 PolarHBondContact O-N 2.91Å; V35-T38 PolarHBondContact O-N 3.38Å; V35-Y39 HydrophobicContact CG1-CD2 3.73Å; V35-Y39 HydrophobicContact CG1-CE2 3.91Å; V35-Y39 WeakPolarHBondContact O-CD2 3.38Å; V35-Y39 PolarHBondContact O-N 2.85Å; V35-A55 HydrophobicContact CB-CB 4.43Å; V35-A55 HydrophobicContact CG1-CB 3.93Å
36F85.5Confident78.7Confident67 Ų6787.5 Ų87.529%0.29443%0.429SS..Hα-helixtrans-56.4-51.8-179.6-175.3-88.9000111.8G32 A33 T38 Y39 D40 L52 A55 V56 I59G32-F36 WeakPolarHBondContact O-CB 3.39Å; G32-F36 PolarHBondContact O-N 3.04Å; A33-F36 PolarHBondContact O-N 3.39Å; F36-T38 PolarHBondContact O-N 2.97Å; F36-Y39 PolarHBondContact O-N 3.43Å; F36-D40 HydrophobicContact CE1-CB 4.47Å; F36-D40 VanDerWaalsContact O-CB 3.27Å; F36-D40 WeakPolarHBondContact O-CB 3.18Å; F36-D40 PolarHBondContact O-N 3.47Å; F36-L52 HydrophobicContact CD2-CD2 4.42Å; F36-A55 HydrophobicContact CB-CB 4.44Å; F36-V56 HydrophobicContact CD2-CG2 3.91Å; F36-V56 HydrophobicContact CE2-CG2 3.74Å; F36-I59 HydrophobicContact CB-CD1 3.91Å; F36-I59 HydrophobicContact CG-CD1 4.31Å
37I85.1Confident76.7Confident100 Ų10095.6 Ų95.651%0.51346%0.46SS..Hα-helixtrans-62.8-43.2179.2-65.7164.8000111.1A33 V35 Y39 D40 D41A33-I37 VanDerWaalsContact O-CG1 3.3Å; A33-I37 WeakPolarHBondContact O-CG1 3.34Å; A33-I37 PolarHBondContact O-N 3.45Å; V35-I37 PolarHBondContact O-N 2.91Å; I37-Y39 VanDerWaalsContact C-N 3.28Å; I37-Y39 PolarHBondContact O-N 2.85Å; I37-D40 PolarHBondContact O-N 3.42Å; I37-D41 PolarHBondContact O-N 2.79Å; I37-D41 VanDerWaalsContact O-N 3.07Å
38T82.5Confident75Confident42 Ų4293.8 Ų93.826%0.25845%0.451SS..Hα-helixtrans-60.1-41.9179.8-58.80000110.8Y34 V35 F36 Y42Y34-T38 VanDerWaalsContact O-CB 3.29Å; Y34-T38 WeakPolarHBondContact O-CB 3.12Å; Y34-T38 PolarHBondContact O-N 3.28Å; Y34-T38 PolarHBondContact O-OG1 3.05Å; V35-T38 PolarHBondContact O-N 3.38Å; F36-T38 PolarHBondContact O-N 2.97Å; T38-Y42 HydrophobicContact CG2-CE2 3.91Å; T38-Y42 WeakPolarHBondContact O-CD2 3.42Å; T38-Y42 WeakPolarHBondContact O-CE2 3.41Å
39Y74.6Confident73.6Confident108 Ų10895.1 Ų95.142%0.42446%0.463SS..Hα-helixtrans-78.4-35.7179.9-84.5-95.2000113.5V35 F36 I37 D41 Y42 D43 L52V35-Y39 HydrophobicContact CG1-CD2 3.73Å; V35-Y39 HydrophobicContact CG1-CE2 3.91Å; V35-Y39 WeakPolarHBondContact O-CD2 3.38Å; V35-Y39 PolarHBondContact O-N 2.85Å; F36-Y39 PolarHBondContact O-N 3.43Å; I37-Y39 VanDerWaalsContact C-N 3.28Å; I37-Y39 PolarHBondContact O-N 2.85Å; Y39-D41 VanDerWaalsContact C-N 3.3Å; Y39-D41 PolarHBondContact O-N 3.31Å; Y39-Y42 CarbonylContact O-C 3.54Å; Y39-Y42 WeakPolarHBondContact O-CA 3.32Å; Y39-Y42 WeakPolarHBondContact O-CB 3.24Å; Y39-Y42 PolarHBondContact O-N 3.08Å; Y39-D43 PolarHBondContact O-N 3.46Å; Y39-D43 VanDerWaalsContact O-N 3.14Å; Y39-L52 VanDerWaalsContact CB-CD2 3.49Å; Y39-L52 HydrophobicContact CG-CD2 4.43Å
40D70.4Confident72.2Confident81 Ų81102.2 Ų102.243%0.43349%0.487SS..Hα-helixtrans-61.2-37175.3-167.361.5000111.5F36 I37 Y42 D43F36-D40 HydrophobicContact CE1-CB 4.47Å; F36-D40 VanDerWaalsContact O-CB 3.27Å; F36-D40 WeakPolarHBondContact O-CB 3.18Å; F36-D40 PolarHBondContact O-N 3.47Å; I37-D40 PolarHBondContact O-N 3.42Å; D40-Y42 PolarHBondContact O-N 3.24Å; D40-Y42 VanDerWaalsContact O-N 3.16Å; D40-D43 WeakPolarHBondContact O-CB 3.33Å; D40-D43 PolarHBondContact O-N 3.41Å
41D67.5Low71Confident130 Ų13097.3 Ų97.370%0.69547%0.474SS*.THydrogen-bonded Turntrans-63.1-20.2171.7-84.5-12.9000112.9I37 Y39I37-D41 PolarHBondContact O-N 2.79Å; I37-D41 VanDerWaalsContact O-N 3.07Å; Y39-D41 VanDerWaalsContact C-N 3.3Å; Y39-D41 PolarHBondContact O-N 3.31Å
42Y61.8Low70.3Confident131 Ų13194.8 Ų94.851%0.51446%0.458SS..THydrogen-bonded Turntrans-102.25.4174.1-59.8-70.2000113.6T38 Y39 D40 H44 F45 F46T38-Y42 HydrophobicContact CG2-CE2 3.91Å; T38-Y42 WeakPolarHBondContact O-CD2 3.42Å; T38-Y42 WeakPolarHBondContact O-CE2 3.41Å; Y39-Y42 CarbonylContact O-C 3.54Å; Y39-Y42 WeakPolarHBondContact O-CA 3.32Å; Y39-Y42 WeakPolarHBondContact O-CB 3.24Å; Y39-Y42 PolarHBondContact O-N 3.08Å; D40-Y42 PolarHBondContact O-N 3.24Å; D40-Y42 VanDerWaalsContact O-N 3.16Å; Y42-H44 PolarHBondContact O-N 3.4Å; Y42-H44 VanDerWaalsContact O-N 3.14Å; Y42-F45 WeakPolarHBondContact O-CA 3.4Å; Y42-F45 WeakPolarHBondContact O-CB 3.24Å; Y42-F45 PolarHBondContact O-N 3.33Å; Y42-F46 HydrophobicContact CG-CE2 4.35Å; Y42-F46 WeakPolarHBondContact O-CD2 3.5Å; Y42-F46 PolarHBondContact O-N 2.92Å
43D54.6Low69.9Low65 Ų6598.4 Ų98.435%0.34848%0.476SS..THydrogen-bonded Turntrans-62.7-21.7-179.6-105.614.9000112.3Y39 D40 F45 F46Y39-D43 PolarHBondContact O-N 3.46Å; Y39-D43 VanDerWaalsContact O-N 3.14Å; D40-D43 WeakPolarHBondContact O-CB 3.33Å; D40-D43 PolarHBondContact O-N 3.41Å; D43-F45 PolarHBondContact O-N 3.22Å; D43-F45 VanDerWaalsContact O-N 3.17Å; D43-F46 PolarHBondContact O-N 3.14Å
44H53.8Low69.5Low197 Ų197100.3 Ų100.391%0.91249%0.485SS*.THydrogen-bonded Turntrans-66.9-9.4168.5-101.5-20.7000114.2Y42Y42-H44 PolarHBondContact O-N 3.4Å; Y42-H44 VanDerWaalsContact O-N 3.14Å
45F51.2Low69.3Low151 Ų15193.6 Ų93.666%0.66246%0.46SS*.THydrogen-bonded Turntrans-115.8-13.6178.3-94-87.7000114.2Y42 D43Y42-F45 WeakPolarHBondContact O-CA 3.4Å; Y42-F45 WeakPolarHBondContact O-CB 3.24Å; Y42-F45 PolarHBondContact O-N 3.33Å; D43-F45 PolarHBondContact O-N 3.22Å; D43-F45 VanDerWaalsContact O-N 3.17Å
46F54.2Low69.3Low41 Ų4194.6 Ų94.618%0.1847%0.466CS..  trans-126.4101.8-177.1-61.2-54.8000110.9Y42 D43 D48 A134Y42-F46 HydrophobicContact CG-CE2 4.35Å; Y42-F46 WeakPolarHBondContact O-CD2 3.5Å; Y42-F46 PolarHBondContact O-N 2.92Å; D43-F46 PolarHBondContact O-N 3.14Å; F46-D48 PolarHBondContact O-N 2.63Å; F46-A134 HydrophobicContact CD1-CB 4.29Å; F46-A134 HydrophobicContact CE1-CB 4.31Å
47E52.9Low69.5Low196 Ų19696 Ų9692%0.91648%0.475SS*.  trans-71.3-2.2177.3-76.8-175.3147.500113.9V49E47-V49 PolarHBondContact O-N 3.4Å
48D58.1Low69.7Low72 Ų7294.9 Ų94.939%0.38547%0.47SS..  trans-99.795.6-173.1-76.2-45.3000112.9F46 Y50 T51F46-D48 PolarHBondContact O-N 2.63Å; D48-Y50 PolarHBondContact O-N 2.86Å; D48-T51 HydrophobicContact CB-CG2 4.31Å; D48-T51 PolarHBondContact O-N 3.4Å; D48-T51 PolarHBondContact O-OG1 2.94Å
49V60.4Low70.1Confident112 Ų11295.3 Ų95.368%0.67947%0.47SS*.G310 helixtrans-45.7-25.9167.2178.30000112.6E47 T51 L52E47-V49 PolarHBondContact O-N 3.4Å; V49-T51 VanDerWaalsContact C-N 3.26Å; V49-T51 PolarHBondContact O-N 2.89Å; V49-L52 PolarHBondContact O-N 2.89Å
50Y63.9Low70.9Confident178 Ų17893 Ų9370%0.69847%0.474SS*.G310 helixtrans-64.9-25179.7-60-76.8000114.2D48 I53D48-Y50 PolarHBondContact O-N 2.86Å; Y50-I53 HydrophobicContact CD1-CD1 3.78Å; Y50-I53 HydrophobicContact CG-CD1 4.48Å
51T68.4Low71.9Confident62 Ų6292.7 Ų92.738%0.3847%0.474SS..G310 helixtrans-72.7-27-179.357.40000113.3D48 V49 P54D48-T51 HydrophobicContact CB-CG2 4.31Å; D48-T51 PolarHBondContact O-N 3.4Å; D48-T51 PolarHBondContact O-OG1 2.94Å; V49-T51 VanDerWaalsContact C-N 3.26Å; V49-T51 PolarHBondContact O-N 2.89Å; T51-P54 WeakPolarHBondContact O-CD 3.3Å
52L75.3Confident73Confident19 Ų1986.6 Ų86.610%0.09944%0.442CS..THydrogen-bonded Turntrans-86.1-17.2-179.7-68.6174.2000113.6F36 Y39 V49 A55 V56F36-L52 HydrophobicContact CD2-CD2 4.42Å; Y39-L52 VanDerWaalsContact CB-CD2 3.49Å; Y39-L52 HydrophobicContact CG-CD2 4.43Å; V49-L52 PolarHBondContact O-N 2.89Å; L52-A55 PolarHBondContact O-N 3.4Å; L52-A55 VanDerWaalsContact O-N 3.11Å; L52-V56 WeakPolarHBondContact O-CG2 3.46Å; L52-V56 PolarHBondContact O-N 3.25Å; L52-V56 VanDerWaalsContact O-N 3.1Å
53I80.7Confident74.5Confident78 Ų7882.4 Ų82.440%0.444%0.435SS..Hα-helixtrans-52.5-47.4-176.5-62.7176.4000112.3Y50 A55 V56 I57Y50-I53 HydrophobicContact CD1-CD1 3.78Å; Y50-I53 HydrophobicContact CG-CD1 4.48Å; I53-A55 PolarHBondContact O-N 2.87Å; I53-V56 PolarHBondContact O-N 3.25Å; I53-I57 HydrophobicContact CG2-CD1 3.74Å; I53-I57 HydrophobicContact CG2-CG1 4.41Å; I53-I57 WeakPolarHBondContact O-CG1 3.42Å; I53-I57 PolarHBondContact O-N 2.98Å; I53-I57 VanDerWaalsContact O-N 3.07Å
54P82.6Confident76.2Confident77 Ų7784.1 Ų84.150%0.544%0.443SS..Hα-helixtrans-62.1-40179.6-2335.2000113.2T51 I57 I58T51-P54 WeakPolarHBondContact O-CD 3.3Å; P54-I57 PolarHBondContact O-N 3.25Å; P54-I58 WeakPolarHBondContact O-CD1 3.38Å; P54-I58 VanDerWaalsContact O-CG1 3.25Å; P54-I58 WeakPolarHBondContact O-CG1 3.27Å; P54-I58 PolarHBondContact O-N 3.38Å
55A85.3Confident78Confident6 Ų677.2 Ų77.25%0.0541%0.413CS..Hα-helixtrans-65.2-44179.900000111.3V35 F36 L52 I53 I57 I58 I59V35-A55 HydrophobicContact CB-CB 4.43Å; V35-A55 HydrophobicContact CG1-CB 3.93Å; F36-A55 HydrophobicContact CB-CB 4.44Å; L52-A55 PolarHBondContact O-N 3.4Å; L52-A55 VanDerWaalsContact O-N 3.11Å; I53-A55 PolarHBondContact O-N 2.87Å; A55-I57 PolarHBondContact O-N 2.88Å; A55-I58 PolarHBondContact O-N 3.16Å; A55-I59 WeakPolarHBondContact O-CG1 3.43Å; A55-I59 PolarHBondContact O-N 3.41Å
56V87.4Confident79.9Confident73 Ų7373 Ų7344%0.44239%0.394SS..Hα-helixtrans-61.8-42.9177175.80000111.4F36 L52 I53 I59 A60F36-V56 HydrophobicContact CD2-CG2 3.91Å; F36-V56 HydrophobicContact CE2-CG2 3.74Å; L52-V56 WeakPolarHBondContact O-CG2 3.46Å; L52-V56 PolarHBondContact O-N 3.25Å; L52-V56 VanDerWaalsContact O-N 3.1Å; I53-V56 PolarHBondContact O-N 3.25Å; V56-I59 PolarHBondContact O-N 2.99Å; V56-A60 WeakPolarHBondContact O-CB 3.35Å; V56-A60 PolarHBondContact O-N 3.42Å
57I89.6Confident81.5Confident97 Ų9775.7 Ų75.750%0.49741%0.41SS..Hα-helixtrans-62-45176.6-67.9169.3000110.8I53 P54 A55 I59 A60 V61I53-I57 HydrophobicContact CG2-CD1 3.74Å; I53-I57 HydrophobicContact CG2-CG1 4.41Å; I53-I57 WeakPolarHBondContact O-CG1 3.42Å; I53-I57 PolarHBondContact O-N 2.98Å; I53-I57 VanDerWaalsContact O-N 3.07Å; P54-I57 PolarHBondContact O-N 3.25Å; A55-I57 PolarHBondContact O-N 2.88Å; I57-I59 VanDerWaalsContact C-N 3.33Å; I57-I59 PolarHBondContact O-N 3.47Å; I57-A60 PolarHBondContact O-N 2.92Å; I57-V61 HydrophobicContact CG2-CG2 4.24Å; I57-V61 WeakPolarHBondContact O-CB 3.46Å; I57-V61 WeakPolarHBondContact O-CG2 3.46Å; I57-V61 PolarHBondContact O-N 2.65Å
58I88.3Confident83.2Confident76 Ų7667.4 Ų67.439%0.3937%0.372SS..Hα-helixtrans-59.3-44.8178.3-70.6164.9000110.8P54 A55 G62P54-I58 WeakPolarHBondContact O-CD1 3.38Å; P54-I58 VanDerWaalsContact O-CG1 3.25Å; P54-I58 WeakPolarHBondContact O-CG1 3.27Å; P54-I58 PolarHBondContact O-N 3.38Å; A55-I58 PolarHBondContact O-N 3.16Å; I58-G62 PolarHBondContact O-N 3.01Å
59I90.9Very high84.6Confident51 Ų5164.1 Ų64.126%0.26236%0.355SS..Hα-helixtrans-62.8-47.4177.3-65.6166000110.7F36 A55 V56 I57 G62 A63F36-I59 HydrophobicContact CB-CD1 3.91Å; F36-I59 HydrophobicContact CG-CD1 4.31Å; A55-I59 WeakPolarHBondContact O-CG1 3.43Å; A55-I59 PolarHBondContact O-N 3.41Å; V56-I59 PolarHBondContact O-N 2.99Å; I57-I59 VanDerWaalsContact C-N 3.33Å; I57-I59 PolarHBondContact O-N 3.47Å; I59-G62 PolarHBondContact O-N 3.02Å; I59-A63 WeakPolarHBondContact O-CB 3.42Å; I59-A63 PolarHBondContact O-N 2.88Å
60A91.2Very high85.9Confident61 Ų6162.2 Ų62.250%0.50434%0.34SS..Hα-helixtrans-62.1-46.4-178.200000112.1V56 I57 A63 L64V56-A60 WeakPolarHBondContact O-CB 3.35Å; V56-A60 PolarHBondContact O-N 3.42Å; I57-A60 PolarHBondContact O-N 2.92Å; A60-A63 PolarHBondContact O-N 3.29Å; A60-L64 PolarHBondContact O-N 3.44Å; A60-L64 VanDerWaalsContact O-N 3.07Å
61V91.1Very high86.9Confident74 Ų7457.4 Ų57.445%0.44833%0.326SS..Hα-helixtrans-65.1-44.9176.7173.20000110.7I57 A63 L64 L65I57-V61 HydrophobicContact CG2-CG2 4.24Å; I57-V61 WeakPolarHBondContact O-CB 3.46Å; I57-V61 WeakPolarHBondContact O-CG2 3.46Å; I57-V61 PolarHBondContact O-N 2.65Å; V61-A63 VanDerWaalsContact C-N 3.35Å; V61-A63 PolarHBondContact O-N 3.34Å; V61-L64 PolarHBondContact O-N 2.94Å; V61-L65 HydrophobicContact CG1-CD1 3.94Å; V61-L65 HydrophobicContact CG1-CG 4.32Å; V61-L65 WeakPolarHBondContact O-CG 3.35Å; V61-L65 PolarHBondContact O-N 2.9Å
62G92.1Very high87.8Confident1 Ų154.4 Ų54.41%0.0131%0.308CS..Hα-helixtrans-58.3-45.8176.900000112.1C29 I58 I59 L64 L65 F66C29-G62 VanDerWaalsContact SG-CA 3.59Å; I58-G62 PolarHBondContact O-N 3.01Å; I59-G62 PolarHBondContact O-N 3.02Å; G62-L64 PolarHBondContact O-N 3.47Å; G62-L65 PolarHBondContact O-N 2.79Å; G62-F66 WeakPolarHBondContact O-CB 3.4Å; G62-F66 PolarHBondContact O-N 3.13Å
63A92.3Very high88.3Confident44 Ų4455 Ų5536%0.36431%0.313SS..Hα-helixtrans-64-41.9179.400000111.7C29 I59 A60 V61 F66 L67C29-A63 PolarHBondContact SG-N 3.2Å; I59-A63 WeakPolarHBondContact O-CB 3.42Å; I59-A63 PolarHBondContact O-N 2.88Å; A60-A63 PolarHBondContact O-N 3.29Å; V61-A63 VanDerWaalsContact C-N 3.35Å; V61-A63 PolarHBondContact O-N 3.34Å; A63-F66 PolarHBondContact O-N 3.43Å; A63-L67 WeakPolarHBondContact O-CG 3.3Å; A63-L67 PolarHBondContact O-N 3.49Å
64L91.1Very high88.5Confident101 Ų10154.1 Ų54.153%0.52931%0.313SS..Hα-helixtrans-60.5-49.2175-179.764.3000111.3A60 V61 G62 F66 L67 I68A60-L64 PolarHBondContact O-N 3.44Å; A60-L64 VanDerWaalsContact O-N 3.07Å; V61-L64 PolarHBondContact O-N 2.94Å; G62-L64 PolarHBondContact O-N 3.47Å; L64-F66 VanDerWaalsContact C-N 3.3Å; L64-F66 PolarHBondContact O-N 3.38Å; L64-L67 PolarHBondContact O-N 3.49Å; L64-I68 HydrophobicContact CD1-CD1 4.16Å; L64-I68 HydrophobicContact CG-CD1 3.92Å; L64-I68 VanDerWaalsContact O-CG1 3.27Å; L64-I68 WeakPolarHBondContact O-CG1 3.38Å; L64-I68 PolarHBondContact O-N 3.01Å
65L90.4Very high88.7Confident51 Ų5150.8 Ų50.827%0.26729%0.292SS..Hα-helixtrans-62.8-36.9178.9-69.1176.2000112.2A25 V61 G62 I68 G69A25-L65 HydrophobicContact CB-CB 3.79Å; V61-L65 HydrophobicContact CG1-CD1 3.94Å; V61-L65 HydrophobicContact CG1-CG 4.32Å; V61-L65 WeakPolarHBondContact O-CG 3.35Å; V61-L65 PolarHBondContact O-N 2.9Å; G62-L65 PolarHBondContact O-N 2.79Å; L65-I68 PolarHBondContact O-N 2.98Å; L65-G69 PolarHBondContact O-N 3.4Å
66F90.9Very high88.6Confident63 Ų6351 Ų5128%0.27629%0.292SS..Hα-helixtrans-62.2-46.1175.8-174.8-89.5000111.6W22 A25 G62 A63 L64 G69 L70W22-F66 AromaticContact CD1-CD2 3.68Å; W22-F66 AromaticContact CD1-CE2 3.8Å; W22-F66 HydrophobicContact CD2-CD2 4.44Å; W22-F66 HydrophobicContact CD2-CE2 4.05Å; W22-F66 AromaticContact CE2-CD2 3.89Å; W22-F66 AromaticContact CE2-CE2 3.19Å; W22-F66 AromaticContact CE2-CZ 3.46Å; W22-F66 VanDerWaalsContact CE2-CZ 3.46Å; W22-F66 HydrophobicContact CG-CD2 4.34Å; W22-F66 HydrophobicContact CG-CE2 4.38Å; W22-F66 HydrophobicContact CH2-CE2 4.34Å; W22-F66 HydrophobicContact CZ2-CD2 4.48Å; W22-F66 AromaticContact CZ2-CE2 3.39Å; W22-F66 HydrophobicContact CZ2-CE2 3.39Å; W22-F66 AromaticContact CZ2-CZ 3.43Å; W22-F66 HydrophobicContact CZ2-CZ 3.43Å; W22-F66 VanDerWaalsContact CZ2-CZ 3.43Å; W22-F66 AromaticContact NE1-CD1 3.9Å; W22-F66 AromaticContact NE1-CD2 3.37Å; W22-F66 AromaticContact NE1-CE1 3.57Å; W22-F66 AromaticContact NE1-CE2 3Å; W22-F66 AromaticContact NE1-CG 3.82Å; W22-F66 AromaticContact NE1-CZ 3.12Å; A25-F66 HydrophobicContact CB-CB 4.01Å; G62-F66 WeakPolarHBondContact O-CB 3.4Å; G62-F66 PolarHBondContact O-N 3.13Å; A63-F66 PolarHBondContact O-N 3.43Å; L64-F66 VanDerWaalsContact C-N 3.3Å; L64-F66 PolarHBondContact O-N 3.38Å; F66-G69 PolarHBondContact O-N 3.28Å; F66-L70 HydrophobicContact CD1-CD1 3.96Å; F66-L70 HydrophobicContact CD1-CG 4.42Å; F66-L70 HydrophobicContact CE1-CD1 3.59Å; F66-L70 HydrophobicContact CE1-CG 4.23Å; F66-L70 HydrophobicContact CZ-CD1 4.45Å; F66-L70 PolarHBondContact O-N 3.33Å
67L89.6Confident88.4Confident98 Ų9852.2 Ų52.251%0.51330%0.3SS..Hα-helixtrans-63.1-43.5176.1-68.8173.9000111.8A63 L64 G69 L70 I71A63-L67 WeakPolarHBondContact O-CG 3.3Å; A63-L67 PolarHBondContact O-N 3.49Å; L64-L67 PolarHBondContact O-N 3.49Å; L67-G69 VanDerWaalsContact C-N 3.33Å; L67-G69 PolarHBondContact O-N 3.35Å; L67-L70 PolarHBondContact O-N 3.41Å; L67-I71 VanDerWaalsContact O-CG1 3.31Å; L67-I71 WeakPolarHBondContact O-CG1 3.25Å; L67-I71 PolarHBondContact O-N 2.79Å
68I88.4Confident88Confident22 Ų2257.1 Ų57.111%0.11331%0.312CS..Hα-helixtrans-60.8-43.6177.3-66.6169.5000110.7L64 L65 L70 I71 G72 F87 I90 V94L64-I68 HydrophobicContact CD1-CD1 4.16Å; L64-I68 HydrophobicContact CG-CD1 3.92Å; L64-I68 VanDerWaalsContact O-CG1 3.27Å; L64-I68 WeakPolarHBondContact O-CG1 3.38Å; L64-I68 PolarHBondContact O-N 3.01Å; L65-I68 PolarHBondContact O-N 2.98Å; I68-L70 PolarHBondContact O-N 3.47Å; I68-I71 PolarHBondContact O-N 3.13Å; I68-G72 PolarHBondContact O-N 3.47Å; I68-F87 HydrophobicContact CG2-CE2 4.27Å; I68-I90 HydrophobicContact CD1-CG2 3.71Å; I68-I90 HydrophobicContact CG1-CG2 3.85Å; I68-I90 HydrophobicContact CG2-CG2 3.89Å; I68-V94 HydrophobicContact CD1-CG2 4.45Å
69G87.7Confident87.4Confident3 Ų357.8 Ų57.83%0.03131%0.314CS..Hα-helixtrans-62-41176.800000113.1L65 F66 L67 G72 C73L65-G69 PolarHBondContact O-N 3.4Å; F66-G69 PolarHBondContact O-N 3.28Å; L67-G69 VanDerWaalsContact C-N 3.33Å; L67-G69 PolarHBondContact O-N 3.35Å; G69-G72 PolarHBondContact O-N 3.27Å; G69-C73 WeakPolarHBondContact O-CB 3.4Å; G69-C73 PolarHBondContact O-N 3.45Å
70L86.6Confident86.9Confident71 Ų7157.7 Ų57.737%0.37232%0.317SS..Hα-helixtrans-62.4-47.5174-74.5178.8000111.8W22 F66 L67 I68 G72 C73 C74W22-L70 VanDerWaalsContact NE1-CD2 3.29Å; F66-L70 HydrophobicContact CD1-CD1 3.96Å; F66-L70 HydrophobicContact CD1-CG 4.42Å; F66-L70 HydrophobicContact CE1-CD1 3.59Å; F66-L70 HydrophobicContact CE1-CG 4.23Å; F66-L70 HydrophobicContact CZ-CD1 4.45Å; F66-L70 PolarHBondContact O-N 3.33Å; L67-L70 PolarHBondContact O-N 3.41Å; I68-L70 PolarHBondContact O-N 3.47Å; L70-G72 VanDerWaalsContact C-N 3.33Å; L70-G72 PolarHBondContact O-N 2.94Å; L70-C73 PolarHBondContact O-N 2.94Å; L70-C74 WeakPolarHBondContact O-CB 3.41Å; L70-C74 PolarHBondContact O-N 3.09Å; L70-C74 PolarHBondContact O-SG 3.21Å; L70-C74 VanDerWaalsContact O-SG 3.4Å
71I85.9Confident86.4Confident77 Ų7757.6 Ų57.640%0.39531%0.307SS..Hα-helixtrans-60.6-45.1177.9-66.8166000110.1L67 I68 C74 A75L67-I71 VanDerWaalsContact O-CG1 3.31Å; L67-I71 WeakPolarHBondContact O-CG1 3.25Å; L67-I71 PolarHBondContact O-N 2.79Å; I68-I71 PolarHBondContact O-N 3.13Å; I71-C74 PolarHBondContact O-N 2.92Å; I71-A75 WeakPolarHBondContact O-CB 3.42Å; I71-A75 PolarHBondContact O-N 3.07Å
72G86.3Confident86.1Confident0 Ų058.3 Ų58.30%031%0.314CS..Hα-helixtrans-61.2-44.4178.400000112.9I68 G69 L70 T76 F87I68-G72 PolarHBondContact O-N 3.47Å; G69-G72 PolarHBondContact O-N 3.27Å; L70-G72 VanDerWaalsContact C-N 3.33Å; L70-G72 PolarHBondContact O-N 2.94Å; G72-T76 WeakPolarHBondContact O-CB 3.4Å; G72-T76 PolarHBondContact O-N 3.47Å; G72-T76 VanDerWaalsContact O-N 3.08Å; G72-T76 PolarHBondContact O-OG1 2.86Å; G72-F87 VanDerWaalsContact CA-CD2 3.44Å
73C85.8Confident85.7Confident30 Ų3059 Ų5920%0.20332%0.321CS..Hα-helixtrans-64.1-51175.8-171.40000111.4G69 L70 A75 T76 V77G69-C73 WeakPolarHBondContact O-CB 3.4Å; G69-C73 PolarHBondContact O-N 3.45Å; L70-C73 PolarHBondContact O-N 2.94Å; C73-A75 PolarHBondContact O-N 3.3Å; C73-T76 PolarHBondContact O-N 3.44Å; C73-V77 WeakPolarHBondContact O-CB 3.42Å; C73-V77 WeakPolarHBondContact O-CG2 3.4Å; C73-V77 PolarHBondContact O-N 2.91Å
74C85.9Confident85.4Confident60 Ų6057.3 Ų57.341%0.40531%0.306SS..Hα-helixtrans-60.9-41.9178.1-72.40000112.6L70 I71 T76 R78L70-C74 WeakPolarHBondContact O-CB 3.41Å; L70-C74 PolarHBondContact O-N 3.09Å; L70-C74 PolarHBondContact O-SG 3.21Å; L70-C74 VanDerWaalsContact O-SG 3.4Å; I71-C74 PolarHBondContact O-N 2.92Å; C74-T76 VanDerWaalsContact C-N 3.31Å; C74-T76 PolarHBondContact O-N 3.25Å; C74-R78 WeakPolarHBondContact O-CB 3.36Å; C74-R78 WeakPolarHBondContact O-CG 3.34Å; C74-R78 PolarHBondContact O-N 3.32Å
75A85.3Confident85.2Confident7 Ų755 Ų556%0.05830%0.296CS..Hα-helixtrans-61.5-40.9177.900000111.9I71 C73 E79 S80 G83I71-A75 WeakPolarHBondContact O-CB 3.42Å; I71-A75 PolarHBondContact O-N 3.07Å; C73-A75 PolarHBondContact O-N 3.3Å; A75-E79 PolarHBondContact O-N 3.36Å; A75-S80 PolarHBondContact O-N 3.26Å; A75-S80 VanDerWaalsContact O-N 3.15Å; A75-G83 VanDerWaalsContact CB-C 3.45Å
76T83.8Confident85.2Confident10 Ų1055.7 Ų55.76%0.06130%0.302CS..Hα-helixtrans-73-45-179.8-51.50000111.7K11 L14 V15 G72 C73 C74 E79K11-T76 HydrophobicContact CB-CG2 4.43Å; L14-T76 HydrophobicContact CB-CG2 4.39Å; L14-T76 HydrophobicContact CD2-CG2 4.07Å; L14-T76 WeakPolarHBondContact CD2-OG1 3.31Å; V15-T76 HydrophobicContact CG2-CG2 3.6Å; G72-T76 WeakPolarHBondContact O-CB 3.4Å; G72-T76 PolarHBondContact O-N 3.47Å; G72-T76 VanDerWaalsContact O-N 3.08Å; G72-T76 PolarHBondContact O-OG1 2.86Å; C73-T76 PolarHBondContact O-N 3.44Å; C74-T76 VanDerWaalsContact C-N 3.31Å; C74-T76 PolarHBondContact O-N 3.25Å; T76-E79 PolarHBondContact O-N 3.38Å
77V82.6Confident85.1Confident99 Ų9952.9 Ų52.960%0.629%0.29SS*.Hα-helixtrans-71.4-44.1-178.5172.80000112.2V15 C73 E79V15-V77 HydrophobicContact CG2-CG2 4.41Å; C73-V77 WeakPolarHBondContact O-CB 3.42Å; C73-V77 WeakPolarHBondContact O-CG2 3.4Å; C73-V77 PolarHBondContact O-N 2.91Å; V77-E79 PolarHBondContact O-N 2.99Å
78R81.4Confident85.2Confident201 Ų20149.5 Ų49.576%0.75827%0.273SS*.THydrogen-bonded Turntrans-74.3-4.6178.2-66.7-177.1174.7-179.5-0.6112.8C74 S80C74-R78 WeakPolarHBondContact O-CB 3.36Å; C74-R78 WeakPolarHBondContact O-CG 3.34Å; C74-R78 PolarHBondContact O-N 3.32Å; R78-S80 PolarHBondContact O-N 2.95Å
79E77.2Confident85.4Confident90 Ų9052 Ų5242%0.42129%0.29SS..THydrogen-bonded Turntrans44.355.2-172.4-51.9-164.6177.700109.4K11 A75 T76 V77 R236K11-E79 IonicContact NZ-OE1 2.63Å; K11-E79 PolarHBondContact NZ-OE1 2.89Å; K11-E79 IonicContact NZ-OE2 3.14Å; K11-E79 PolarHBondContact NZ-OE2 3.37Å; K11-E79 VanDerWaalsContact NZ-OE2 3.14Å; A75-E79 PolarHBondContact O-N 3.36Å; T76-E79 PolarHBondContact O-N 3.38Å; V77-E79 PolarHBondContact O-N 2.99Å; E79-R236 PolarHBondContact O-NH1 2.98Å; E79-R236 PolarHBondContact O-NH2 3.4Å
80S79.8Confident85.5Confident48 Ų4853.6 Ų53.634%0.33630%0.297SS..  trans-92.1122.8177.4176.40000109.3A75 R78 G83 L84A75-S80 PolarHBondContact O-N 3.26Å; A75-S80 VanDerWaalsContact O-N 3.15Å; R78-S80 PolarHBondContact O-N 2.95Å; S80-G83 PolarHBondContact O-N 3.37Å; S80-G83 PolarHBondContact OG-N 2.94Å; S80-L84 WeakPolarHBondContact O-CB 3.29Å; S80-L84 PolarHBondContact O-N 3.05Å
81H80.4Confident85.8Confident60 Ų6051.3 Ų51.328%0.27829%0.285SS..Hα-helixtrans-60.8-52.9177.1-175.7-83.2000110.7G83 L84 T85 Y242H81-G83 VanDerWaalsContact C-N 3.29Å; H81-G83 PolarHBondContact O-N 3.49Å; H81-L84 PolarHBondContact O-N 3.31Å; H81-T85 PolarHBondContact O-N 3.4Å; H81-T85 PolarHBondContact O-OG1 3.43Å; H81-T85 VanDerWaalsContact O-OG1 3.05Å; H81-Y242 HydrophobicContact CB-CE2 4.35Å; H81-Y242 AromaticContact CD2-CZ 3.73Å; H81-Y242 PolarHBondContact CD2-OH 3.2Å; H81-Y242 VanDerWaalsContact CD2-OH 3.26Å; H81-Y242 PolarHBondContact CE1-OH 2.82Å; H81-Y242 VanDerWaalsContact CE1-OH 3.27Å; H81-Y242 PolarHBondContact ND1-OH 3Å; H81-Y242 AromaticContact NE2-CZ 3.96Å; H81-Y242 PolarHBondContact NE2-OH 2.75Å
82C83.9Confident86.1Confident88 Ų8851.9 Ų51.960%0.59529%0.289SS*.Hα-helixtrans-57.7-42.1176.8-177.30000111.6L84 T85 T86C82-L84 PolarHBondContact O-N 2.9Å; C82-T85 PolarHBondContact O-N 2.96Å; C82-T86 WeakPolarHBondContact O-CB 3.49Å; C82-T86 PolarHBondContact O-N 3.26Å; C82-T86 PolarHBondContact O-OG1 3.09Å
83G84.9Confident86.5Confident17 Ų1757.1 Ų57.118%0.17532%0.316CS..Hα-helixtrans-62.3-43.8177.400000113.3A75 S80 H81 T86 F87A75-G83 VanDerWaalsContact CB-C 3.45Å; S80-G83 PolarHBondContact O-N 3.37Å; S80-G83 PolarHBondContact OG-N 2.94Å; H81-G83 VanDerWaalsContact C-N 3.29Å; H81-G83 PolarHBondContact O-N 3.49Å; G83-T86 PolarHBondContact O-N 2.95Å; G83-F87 WeakPolarHBondContact O-CB 3.49Å; G83-F87 PolarHBondContact O-N 3.06Å
84L85.5Confident86.9Confident7 Ų757.3 Ų57.34%0.03732%0.316CS..Hα-helixtrans-73.1-35.8-179.1-172.362000111.8L14 S80 H81 C82 F87 V88 A229 V232 L233L14-L84 HydrophobicContact CD2-CD1 3.96Å; S80-L84 WeakPolarHBondContact O-CB 3.29Å; S80-L84 PolarHBondContact O-N 3.05Å; H81-L84 PolarHBondContact O-N 3.31Å; C82-L84 PolarHBondContact O-N 2.9Å; L84-F87 HydrophobicContact CD1-CD1 4.42Å; L84-F87 PolarHBondContact O-N 2.82Å; L84-V88 WeakPolarHBondContact O-CG2 3.41Å; L84-V88 PolarHBondContact O-N 3.47Å; L84-A229 HydrophobicContact CD1-CB 3.76Å; L84-A229 HydrophobicContact CG-CB 4.31Å; L84-V232 HydrophobicContact CD2-CB 3.96Å; L84-V232 HydrophobicContact CD2-CG1 3.6Å; L84-L233 HydrophobicContact CB-CD2 3.93Å; L84-L233 HydrophobicContact CB-CG 4.37Å; L84-L233 HydrophobicContact CD2-CD1 4.48Å; L84-L233 HydrophobicContact CD2-CD2 3.74Å; L84-L233 HydrophobicContact CD2-CG 3.61Å; L84-L233 HydrophobicContact CG-CD1 4.17Å; L84-L233 HydrophobicContact CG-CD2 3.91Å; L84-L233 HydrophobicContact CG-CG 3.81Å
85T87.8Confident87.3Confident54 Ų5457 Ų5733%0.33131%0.308SS..Hα-helixtrans-61.7-48.1170.7-57.20000111.3H81 C82 F87 V88 V89H81-T85 PolarHBondContact O-N 3.4Å; H81-T85 PolarHBondContact O-OG1 3.43Å; H81-T85 VanDerWaalsContact O-OG1 3.05Å; C82-T85 PolarHBondContact O-N 2.96Å; T85-F87 VanDerWaalsContact C-N 3.29Å; T85-F87 PolarHBondContact O-N 3Å; T85-V88 PolarHBondContact O-N 3.19Å; T85-V89 WeakPolarHBondContact O-CG2 3.5Å; T85-V89 PolarHBondContact O-N 2.88Å
86T89.3Confident87.8Confident64 Ų6462.2 Ų62.239%0.39333%0.332SS..Hα-helixtrans-59.4-41.1176.5-62.20000111.4C82 G83 V88 V89 I90C82-T86 WeakPolarHBondContact O-CB 3.49Å; C82-T86 PolarHBondContact O-N 3.26Å; C82-T86 PolarHBondContact O-OG1 3.09Å; G83-T86 PolarHBondContact O-N 2.95Å; T86-V88 PolarHBondContact O-N 3.45Å; T86-V89 PolarHBondContact O-N 2.94Å; T86-I90 HydrophobicContact CG2-CD1 3.88Å; T86-I90 HydrophobicContact CG2-CG1 4.41Å; T86-I90 VanDerWaalsContact O-CG1 3.31Å; T86-I90 WeakPolarHBondContact O-CG1 3.36Å; T86-I90 PolarHBondContact O-N 3.44Å
87F89.1Confident88.3Confident5 Ų565.9 Ų65.92%0.02236%0.355CS..Hα-helixtrans-60-44.4175.6-179-108.4000112.4L14 N18 I68 G72 G83 L84 T85 V89 I90 L91L14-F87 HydrophobicContact CD1-CE1 4.05Å; N18-F87 VanDerWaalsContact OD1-CE2 3.3Å; N18-F87 WeakPolarHBondContact OD1-CE2 3.21Å; N18-F87 VanDerWaalsContact OD1-CZ 3.25Å; N18-F87 WeakPolarHBondContact OD1-CZ 3.48Å; I68-F87 HydrophobicContact CG2-CE2 4.27Å; G72-F87 VanDerWaalsContact CA-CD2 3.44Å; G83-F87 WeakPolarHBondContact O-CB 3.49Å; G83-F87 PolarHBondContact O-N 3.06Å; L84-F87 HydrophobicContact CD1-CD1 4.42Å; L84-F87 PolarHBondContact O-N 2.82Å; T85-F87 VanDerWaalsContact C-N 3.29Å; T85-F87 PolarHBondContact O-N 3Å; F87-V89 PolarHBondContact O-N 2.81Å; F87-I90 PolarHBondContact O-N 3.44Å; F87-L91 HydrophobicContact CD1-CD1 4.07Å; F87-L91 HydrophobicContact CD1-CG 4.45Å; F87-L91 HydrophobicContact CE1-CD1 3.43Å; F87-L91 VanDerWaalsContact CE1-CD1 3.43Å; F87-L91 HydrophobicContact CE1-CG 4.06Å; F87-L91 HydrophobicContact CE2-CD1 4.43Å; F87-L91 HydrophobicContact CE2-CD2 4.27Å; F87-L91 HydrophobicContact CE2-CG 4.26Å; F87-L91 HydrophobicContact CZ-CD1 3.66Å; F87-L91 HydrophobicContact CZ-CD2 4.09Å; F87-L91 HydrophobicContact CZ-CG 3.97Å; F87-L91 WeakPolarHBondContact O-CG 3.41Å; F87-L91 PolarHBondContact O-N 2.91Å
88V90.8Very high88.7Confident26 Ų2662.5 Ų62.516%0.15833%0.333CS..Hα-helixtrans-62.1-42.7175.2172.60000111.7L84 T85 T86 L91 L92 A229 L233L84-V88 WeakPolarHBondContact O-CG2 3.41Å; L84-V88 PolarHBondContact O-N 3.47Å; T85-V88 PolarHBondContact O-N 3.19Å; T86-V88 PolarHBondContact O-N 3.45Å; V88-L91 PolarHBondContact O-N 3.02Å; V88-L92 WeakPolarHBondContact O-CB 3.48Å; V88-L92 PolarHBondContact O-N 3.34Å; V88-A229 HydrophobicContact CG2-CB 3.45Å; V88-A229 VanDerWaalsContact CG2-CB 3.45Å; V88-L233 HydrophobicContact CG2-CD1 4.21Å
89V92.6Very high89.3Confident75 Ų7556 Ų5646%0.45532%0.316SS..Hα-helixtrans-62.3-43.5177.2172.80000111.1T85 T86 F87 L92 L93T85-V89 WeakPolarHBondContact O-CG2 3.5Å; T85-V89 PolarHBondContact O-N 2.88Å; T86-V89 PolarHBondContact O-N 2.94Å; F87-V89 PolarHBondContact O-N 2.81Å; V89-L92 WeakPolarHBondContact O-CB 3.37Å; V89-L92 PolarHBondContact O-N 3.03Å; V89-L93 HydrophobicContact CG1-CD1 4.32Å; V89-L93 WeakPolarHBondContact O-CG 3.41Å; V89-L93 PolarHBondContact O-N 2.9Å
90I91.8Very high90.2Very high37 Ų3754 Ų5419%0.1931%0.314CS..Hα-helixtrans-61.4-47.3176.1-70168.5000110.6I68 T86 F87 L92 L93 V94I68-I90 HydrophobicContact CD1-CG2 3.71Å; I68-I90 HydrophobicContact CG1-CG2 3.85Å; I68-I90 HydrophobicContact CG2-CG2 3.89Å; T86-I90 HydrophobicContact CG2-CD1 3.88Å; T86-I90 HydrophobicContact CG2-CG1 4.41Å; T86-I90 VanDerWaalsContact O-CG1 3.31Å; T86-I90 WeakPolarHBondContact O-CG1 3.36Å; T86-I90 PolarHBondContact O-N 3.44Å; F87-I90 PolarHBondContact O-N 3.44Å; I90-L92 VanDerWaalsContact C-N 3.27Å; I90-L92 PolarHBondContact O-N 3.35Å; I90-L93 PolarHBondContact O-N 3.15Å; I90-V94 WeakPolarHBondContact O-CG2 3.5Å; I90-V94 PolarHBondContact O-N 2.88Å
91L90.9Very high90.8Very high23 Ų2356.2 Ų56.212%0.1233%0.325CS..Hα-helixtrans-60.2-38.2176.1-69.5-173.8000111.4F87 V88 V94 F95 Q222 M226F87-L91 HydrophobicContact CD1-CD1 4.07Å; F87-L91 HydrophobicContact CD1-CG 4.45Å; F87-L91 HydrophobicContact CE1-CD1 3.43Å; F87-L91 VanDerWaalsContact CE1-CD1 3.43Å; F87-L91 HydrophobicContact CE1-CG 4.06Å; F87-L91 HydrophobicContact CE2-CD1 4.43Å; F87-L91 HydrophobicContact CE2-CD2 4.27Å; F87-L91 HydrophobicContact CE2-CG 4.26Å; F87-L91 HydrophobicContact CZ-CD1 3.66Å; F87-L91 HydrophobicContact CZ-CD2 4.09Å; F87-L91 HydrophobicContact CZ-CG 3.97Å; F87-L91 WeakPolarHBondContact O-CG 3.41Å; F87-L91 PolarHBondContact O-N 2.91Å; V88-L91 PolarHBondContact O-N 3.02Å; L91-V94 PolarHBondContact O-N 3.06Å; L91-F95 WeakPolarHBondContact O-CB 3.43Å; L91-F95 PolarHBondContact O-N 3.36Å; L91-Q222 HydrophobicContact CB-CG 4.24Å; L91-Q222 HydrophobicContact CD2-CG 4.31Å; L91-Q222 PolarHBondContact O-NE2 2.84Å; L91-M226 HydrophobicContact CB-CG 3.7Å; L91-M226 HydrophobicContact CB-SD 4.09Å; L91-M226 HydrophobicContact CD1-CG 3.85Å; L91-M226 HydrophobicContact CG-CG 4.47Å
92L94.1Very high91.3Very high89 Ų8956.7 Ų56.747%0.46633%0.332SS..Hα-helixtrans-64-44176.1-175.866.2000112V88 V89 I90 V94 F95 M96 M226V88-L92 WeakPolarHBondContact O-CB 3.48Å; V88-L92 PolarHBondContact O-N 3.34Å; V89-L92 WeakPolarHBondContact O-CB 3.37Å; V89-L92 PolarHBondContact O-N 3.03Å; I90-L92 VanDerWaalsContact C-N 3.27Å; I90-L92 PolarHBondContact O-N 3.35Å; L92-V94 PolarHBondContact O-N 3.34Å; L92-F95 PolarHBondContact O-N 3.3Å; L92-M96 WeakPolarHBondContact O-CG 3.28Å; L92-M96 PolarHBondContact O-N 3.47Å; L92-M226 HydrophobicContact CB-SD 4.39Å
93L94.4Very high91.7Very high109 Ų10956.2 Ų56.257%0.57133%0.326SS*.Hα-helixtrans-63.6-40.7178.8-69.6174.3000112.3V89 I90 M96 T97V89-L93 HydrophobicContact CG1-CD1 4.32Å; V89-L93 WeakPolarHBondContact O-CG 3.41Å; V89-L93 PolarHBondContact O-N 2.9Å; I90-L93 PolarHBondContact O-N 3.15Å; L93-M96 PolarHBondContact O-N 3.38Å; L93-T97 PolarHBondContact O-N 2.9Å; L93-T97 PolarHBondContact O-OG1 3.49Å
94V92.9Very high92Very high35 Ų3559.9 Ų59.921%0.21234%0.341CS..Hα-helixtrans-64.2-42.2175.8171.30000110.4I68 I90 L91 L92 M96 T97 E98 F218 Q222I68-V94 HydrophobicContact CD1-CG2 4.45Å; I90-V94 WeakPolarHBondContact O-CG2 3.5Å; I90-V94 PolarHBondContact O-N 2.88Å; L91-V94 PolarHBondContact O-N 3.06Å; L92-V94 PolarHBondContact O-N 3.34Å; V94-M96 PolarHBondContact O-N 3.03Å; V94-T97 WeakPolarHBondContact O-CB 3.29Å; V94-T97 PolarHBondContact O-N 3.31Å; V94-T97 VanDerWaalsContact O-N 3.16Å; V94-E98 PolarHBondContact O-N 3.24Å; V94-F218 HydrophobicContact CG1-CE1 4.01Å; V94-F218 HydrophobicContact CG1-CZ 4.33Å; V94-Q222 VanDerWaalsContact CB-NE2 3.26Å; V94-Q222 VanDerWaalsContact CG1-NE2 3.3Å
95F94.4Very high92.1Very high53 Ų5361.6 Ų61.623%0.23236%0.361CS..Hα-helixtrans-61.9-44177.4179.2-101.1000111.8L91 L92 T97 E98 V99 A219 M223L91-F95 WeakPolarHBondContact O-CB 3.43Å; L91-F95 PolarHBondContact O-N 3.36Å; L92-F95 PolarHBondContact O-N 3.3Å; F95-T97 VanDerWaalsContact C-N 3.28Å; F95-T97 PolarHBondContact O-N 3.49Å; F95-E98 WeakPolarHBondContact O-CB 3.47Å; F95-E98 PolarHBondContact O-N 3.47Å; F95-V99 HydrophobicContact CD1-CG2 4.41Å; F95-V99 HydrophobicContact CE1-CG2 4.01Å; F95-V99 HydrophobicContact CE2-CG2 4.42Å; F95-V99 HydrophobicContact CZ-CG2 4.02Å; F95-V99 WeakPolarHBondContact O-CG2 3.33Å; F95-V99 PolarHBondContact O-N 3.49Å; F95-A219 HydrophobicContact CD2-CB 4.42Å; F95-A219 HydrophobicContact CE2-CB 4.08Å; F95-M223 HydrophobicContact CE2-CG 4.43Å; F95-M223 HydrophobicContact CE2-SD 4.42Å
96M96Very high92.1Very high116 Ų11666.1 Ų66.157%0.57137%0.373SS*.Hα-helixtrans-61.3-38.5175.1-68.2-60.3-64.800112.1L92 L93 V94 A100L92-M96 WeakPolarHBondContact O-CG 3.28Å; L92-M96 PolarHBondContact O-N 3.47Å; L93-M96 PolarHBondContact O-N 3.38Å; V94-M96 PolarHBondContact O-N 3.03Å; M96-A100 WeakPolarHBondContact O-CB 3.48Å; M96-A100 PolarHBondContact O-N 2.95Å
97T93.7Very high92.2Very high87 Ų8767.6 Ų67.653%0.53438%0.382SS..Hα-helixtrans-66.6-42.2176.4-54.30000111.3L93 V94 F95 A100 V101L93-T97 PolarHBondContact O-N 2.9Å; L93-T97 PolarHBondContact O-OG1 3.49Å; V94-T97 WeakPolarHBondContact O-CB 3.29Å; V94-T97 PolarHBondContact O-N 3.31Å; V94-T97 VanDerWaalsContact O-N 3.16Å; F95-T97 VanDerWaalsContact C-N 3.28Å; F95-T97 PolarHBondContact O-N 3.49Å; T97-A100 PolarHBondContact O-N 2.98Å; T97-V101 HydrophobicContact CG2-CG2 4.45Å; T97-V101 WeakPolarHBondContact O-CG2 3.33Å; T97-V101 PolarHBondContact O-N 3.32Å
98E92.8Very high92.2Very high28 Ų2873.4 Ų73.413%0.13140%0.404CS..Hα-helixtrans-60.1-48.1176-178.2177.6-166.700111.6V94 F95 A100 V101 V102 A215 F218 Q222V94-E98 PolarHBondContact O-N 3.24Å; F95-E98 WeakPolarHBondContact O-CB 3.47Å; F95-E98 PolarHBondContact O-N 3.47Å; E98-A100 VanDerWaalsContact C-N 3.31Å; E98-A100 PolarHBondContact O-N 3.47Å; E98-V101 PolarHBondContact O-N 3.41Å; E98-V102 WeakPolarHBondContact O-CG2 3.11Å; E98-V102 PolarHBondContact O-N 3.4Å; E98-A215 VanDerWaalsContact OE1-C 3.23Å; E98-A215 VanDerWaalsContact OE1-CA 3.28Å; E98-A215 WeakPolarHBondContact OE1-CA 3.48Å; E98-A215 WeakPolarHBondContact OE1-CB 3.42Å; E98-F218 WeakPolarHBondContact OE2-CD1 3.47Å; E98-Q222 PolarHBondContact OE2-OE1 3.01Å
99V94.1Very high92Very high66 Ų6678.1 Ų78.140%0.442%0.419SS..Hα-helixtrans-59.4-44.1175.5174.40000110.7F95 V102 V103F95-V99 HydrophobicContact CD1-CG2 4.41Å; F95-V99 HydrophobicContact CE1-CG2 4.01Å; F95-V99 HydrophobicContact CE2-CG2 4.42Å; F95-V99 HydrophobicContact CZ-CG2 4.02Å; F95-V99 WeakPolarHBondContact O-CG2 3.33Å; F95-V99 PolarHBondContact O-N 3.49Å; V99-V102 PolarHBondContact O-N 3.33Å; V99-V103 HydrophobicContact CG1-CG2 4.27Å; V99-V103 WeakPolarHBondContact O-CB 3.31Å; V99-V103 VanDerWaalsContact O-CG2 3.24Å; V99-V103 WeakPolarHBondContact O-CG2 3.47Å; V99-V103 PolarHBondContact O-N 2.99Å
100A95.1Very high91.7Very high46 Ų4677.6 Ų77.638%0.3842%0.423SS..Hα-helixtrans-61.1-45.3177.400000112M96 T97 E98 V103 L104M96-A100 WeakPolarHBondContact O-CB 3.48Å; M96-A100 PolarHBondContact O-N 2.95Å; T97-A100 PolarHBondContact O-N 2.98Å; E98-A100 VanDerWaalsContact C-N 3.31Å; E98-A100 PolarHBondContact O-N 3.47Å; A100-V103 PolarHBondContact O-N 2.91Å; A100-L104 VanDerWaalsContact O-CB 3.32Å; A100-L104 WeakPolarHBondContact O-CB 3.43Å; A100-L104 WeakPolarHBondContact O-CG 3.34Å; A100-L104 PolarHBondContact O-N 3.07Å
101V91.9Very high91.5Very high95 Ų9582.2 Ų82.258%0.57644%0.442SS*.Hα-helixtrans-62.1-45177.9169.90000111.1T97 E98 G105T97-V101 HydrophobicContact CG2-CG2 4.45Å; T97-V101 WeakPolarHBondContact O-CG2 3.33Å; T97-V101 PolarHBondContact O-N 3.32Å; E98-V101 PolarHBondContact O-N 3.41Å; V101-G105 PolarHBondContact O-N 3.38Å
102V90.7Very high91.2Very high71 Ų7185.1 Ų85.143%0.4346%0.46SS..Hα-helixtrans-63.3-44.9178.2172.20000111.2E98 V99 G105 Y106 A215E98-V102 WeakPolarHBondContact O-CG2 3.11Å; E98-V102 PolarHBondContact O-N 3.4Å; V99-V102 PolarHBondContact O-N 3.33Å; V102-G105 PolarHBondContact O-N 3.11Å; V102-Y106 WeakPolarHBondContact O-CB 3.35Å; V102-Y106 PolarHBondContact O-N 3.01Å; V102-A215 HydrophobicContact CG2-CB 4.39Å
103V92.3Very high90.7Very high78 Ų7884.1 Ų84.147%0.47345%0.453SS..Hα-helixtrans-64.5-48.4178.8171.10000111V99 A100 G105 Y106 V107V99-V103 HydrophobicContact CG1-CG2 4.27Å; V99-V103 WeakPolarHBondContact O-CB 3.31Å; V99-V103 VanDerWaalsContact O-CG2 3.24Å; V99-V103 WeakPolarHBondContact O-CG2 3.47Å; V99-V103 PolarHBondContact O-N 2.99Å; A100-V103 PolarHBondContact O-N 2.91Å; V103-G105 VanDerWaalsContact C-N 3.34Å; V103-G105 PolarHBondContact O-N 3.1Å; V103-Y106 PolarHBondContact O-N 3.46Å; V103-V107 HydrophobicContact CG1-CG2 4.34Å; V103-V107 WeakPolarHBondContact O-CB 3.25Å; V103-V107 VanDerWaalsContact O-CG2 3.29Å; V103-V107 WeakPolarHBondContact O-CG2 3.35Å; V103-V107 PolarHBondContact O-N 3.01Å
104L91.8Very high90.3Very high93 Ų9383.9 Ų83.949%0.48745%0.452SS..Hα-helixtrans-63-41.8178.1-68.1170.5000111A100 Y106 V107 Y108A100-L104 VanDerWaalsContact O-CB 3.32Å; A100-L104 WeakPolarHBondContact O-CB 3.43Å; A100-L104 WeakPolarHBondContact O-CG 3.34Å; A100-L104 PolarHBondContact O-N 3.07Å; L104-Y106 VanDerWaalsContact C-N 3.32Å; L104-Y106 PolarHBondContact O-N 3.4Å; L104-V107 PolarHBondContact O-N 3.43Å; L104-Y108 HydrophobicContact CB-CD2 4.32Å; L104-Y108 HydrophobicContact CD2-CD2 4.4Å; L104-Y108 HydrophobicContact CD2-CE2 3.86Å; L104-Y108 WeakPolarHBondContact O-CB 3.26Å; L104-Y108 VanDerWaalsContact O-CD2 3.24Å; L104-Y108 WeakPolarHBondContact O-CD2 3.32Å; L104-Y108 PolarHBondContact O-N 2.88Å
105G88.3Confident90Very high43 Ų4387.4 Ų87.444%0.44347%0.466SS..Hα-helixtrans-59.6-42175.500000112.4V101 V102 V103 R109V101-G105 PolarHBondContact O-N 3.38Å; V102-G105 PolarHBondContact O-N 3.11Å; V103-G105 VanDerWaalsContact C-N 3.34Å; V103-G105 PolarHBondContact O-N 3.1Å; G105-R109 PolarHBondContact O-N 3.26Å; G105-R109 VanDerWaalsContact O-N 3.09Å
106Y86.8Confident89.5Confident150 Ų15086.3 Ų86.359%0.58846%0.464SS*.Hα-helixtrans-68-44.9175.7-176.2-95.4000112.6V102 V103 L104 R109V102-Y106 WeakPolarHBondContact O-CB 3.35Å; V102-Y106 PolarHBondContact O-N 3.01Å; V103-Y106 PolarHBondContact O-N 3.46Å; L104-Y106 VanDerWaalsContact C-N 3.32Å; L104-Y106 PolarHBondContact O-N 3.4Å; Y106-R109 WeakPolarHBondContact O-CB 3.5Å; Y106-R109 WeakPolarHBondContact O-CD 3.48Å; Y106-R109 WeakPolarHBondContact O-CG 3.32Å; Y106-R109 PolarHBondContact O-N 3.35Å
107V91.5Very high89Confident95 Ų9582.6 Ų82.658%0.57645%0.446SS*.Hα-helixtrans-63.7-42.2-179.8169.30000111.2V103 L104V103-V107 HydrophobicContact CG1-CG2 4.34Å; V103-V107 WeakPolarHBondContact O-CB 3.25Å; V103-V107 VanDerWaalsContact O-CG2 3.29Å; V103-V107 WeakPolarHBondContact O-CG2 3.35Å; V103-V107 PolarHBondContact O-N 3.01Å; L104-V107 PolarHBondContact O-N 3.43Å
108Y89.6Confident88.7Confident127 Ų12782 Ų8250%0.49844%0.443SS..THydrogen-bonded Turntrans-90.34.6-178.2-68.6-66.4000114.3L104 A110 K111 V112L104-Y108 HydrophobicContact CB-CD2 4.32Å; L104-Y108 HydrophobicContact CD2-CD2 4.4Å; L104-Y108 HydrophobicContact CD2-CE2 3.86Å; L104-Y108 WeakPolarHBondContact O-CB 3.26Å; L104-Y108 VanDerWaalsContact O-CD2 3.24Å; L104-Y108 WeakPolarHBondContact O-CD2 3.32Å; L104-Y108 PolarHBondContact O-N 2.88Å; Y108-A110 VanDerWaalsContact C-N 3.28Å; Y108-A110 PolarHBondContact O-N 3.36Å; Y108-K111 HydrophobicContact CD1-CD 4.3Å; Y108-K111 WeakPolarHBondContact O-CA 3.38Å; Y108-K111 WeakPolarHBondContact O-CB 3.3Å; Y108-K111 PolarHBondContact O-N 2.86Å; Y108-V112 WeakPolarHBondContact O-CG2 3.17Å; Y108-V112 PolarHBondContact O-N 3.45Å
109R85.6Confident88.4Confident124 Ų12483.2 Ų83.247%0.46845%0.454SS..Hα-helixtrans-52.4-43.6-17774.7-172.7-179.6156.42.2113.5G105 Y106 K111 V112 E113G105-R109 PolarHBondContact O-N 3.26Å; G105-R109 VanDerWaalsContact O-N 3.09Å; Y106-R109 WeakPolarHBondContact O-CB 3.5Å; Y106-R109 WeakPolarHBondContact O-CD 3.48Å; Y106-R109 WeakPolarHBondContact O-CG 3.32Å; Y106-R109 PolarHBondContact O-N 3.35Å; R109-K111 VanDerWaalsContact C-N 3.32Å; R109-K111 PolarHBondContact O-N 3.41Å; R109-V112 PolarHBondContact O-N 3.45Å; R109-E113 PolarHBondContact O-N 2.87Å
110A86.7Confident88.1Confident65 Ų6581.2 Ų81.254%0.53744%0.441SS..Hα-helixtrans-68.9-34.3-178.400000111.6Y108 E113 D114Y108-A110 VanDerWaalsContact C-N 3.28Å; Y108-A110 PolarHBondContact O-N 3.36Å; A110-E113 PolarHBondContact O-N 3.41Å; A110-D114 PolarHBondContact O-N 2.93Å; A110-D114 VanDerWaalsContact O-N 3.1Å
111K88.6Confident87.8Confident134 Ų13483.5 Ų83.558%0.58345%0.445SS*.Hα-helixtrans-68.6-38.2174.4-172.1177.1-178.4-178.80111.2Y108 R109 D114 E115Y108-K111 HydrophobicContact CD1-CD 4.3Å; Y108-K111 WeakPolarHBondContact O-CA 3.38Å; Y108-K111 WeakPolarHBondContact O-CB 3.3Å; Y108-K111 PolarHBondContact O-N 2.86Å; R109-K111 VanDerWaalsContact C-N 3.32Å; R109-K111 PolarHBondContact O-N 3.41Å; K111-D114 PolarHBondContact O-N 3.29Å; K111-E115 WeakPolarHBondContact O-CB 3.39Å; K111-E115 PolarHBondContact O-N 3.49Å
112V83.1Confident87.6Confident83 Ų8385.2 Ų85.250%0.50345%0.445SS..Hα-helixtrans-64.6-42.4175.2174.80000110.9Y108 R109 D114 E115 V116Y108-V112 WeakPolarHBondContact O-CG2 3.17Å; Y108-V112 PolarHBondContact O-N 3.45Å; R109-V112 PolarHBondContact O-N 3.45Å; V112-D114 PolarHBondContact O-N 3.42Å; V112-E115 PolarHBondContact O-N 3.5Å; V112-V116 HydrophobicContact CG1-CG2 4.44Å; V112-V116 WeakPolarHBondContact O-CB 3.29Å; V112-V116 VanDerWaalsContact O-CG2 3.23Å; V112-V116 WeakPolarHBondContact O-CG2 3.39Å; V112-V116 PolarHBondContact O-N 3.43Å
113E83.9Confident87.4Confident68 Ų6884 Ų8432%0.31844%0.437SS..Hα-helixtrans-60.1-44.4175.3-72.2178.4170.800111.7R109 A110 V116 N117 Q205R109-E113 PolarHBondContact O-N 2.87Å; A110-E113 PolarHBondContact O-N 3.41Å; E113-V116 PolarHBondContact O-N 3.43Å; E113-N117 PolarHBondContact O-N 3.47Å; E113-N117 VanDerWaalsContact O-N 3.09Å; E113-N117 PolarHBondContact O-OD1 2.91Å; E113-Q205 PolarHBondContact OE1-NE2 3.02Å
114D87.3Confident87.2Confident104 Ų10480.8 Ų80.856%0.55642%0.417SS*.Hα-helixtrans-65.5-40.4177.3-168.354.4000113.1A110 K111 V112 V116 N117 T118A110-D114 PolarHBondContact O-N 2.93Å; A110-D114 VanDerWaalsContact O-N 3.1Å; K111-D114 PolarHBondContact O-N 3.29Å; V112-D114 PolarHBondContact O-N 3.42Å; D114-V116 VanDerWaalsContact C-N 3.34Å; D114-V116 PolarHBondContact O-N 2.92Å; D114-N117 PolarHBondContact O-N 3.27Å; D114-T118 PolarHBondContact O-N 3.32Å; D114-T118 PolarHBondContact O-OG1 3.29Å; D114-T118 VanDerWaalsContact O-OG1 3.07Å
115E86.1Confident87.1Confident109 Ų10981.5 Ų81.551%0.50942%0.421SS..Hα-helixtrans-65.3-38.1176.2-165.173.5-151.700111.4K111 V112 T118 S119K111-E115 WeakPolarHBondContact O-CB 3.39Å; K111-E115 PolarHBondContact O-N 3.49Å; V112-E115 PolarHBondContact O-N 3.5Å; E115-T118 PolarHBondContact O-N 2.95Å; E115-S119 WeakPolarHBondContact O-CB 3.27Å; E115-S119 PolarHBondContact O-N 3.46Å; E115-S119 PolarHBondContact O-OG 2.88Å
116V83.9Confident87Confident31 Ų3183.4 Ų83.419%0.18842%0.418CS..Hα-helixtrans-62.2-45.4174.51670000110.3V112 E113 D114 S119 I120 V200 L204V112-V116 HydrophobicContact CG1-CG2 4.44Å; V112-V116 WeakPolarHBondContact O-CB 3.29Å; V112-V116 VanDerWaalsContact O-CG2 3.23Å; V112-V116 WeakPolarHBondContact O-CG2 3.39Å; V112-V116 PolarHBondContact O-N 3.43Å; E113-V116 PolarHBondContact O-N 3.43Å; D114-V116 VanDerWaalsContact C-N 3.34Å; D114-V116 PolarHBondContact O-N 2.92Å; V116-S119 PolarHBondContact O-N 3.49Å; V116-I120 HydrophobicContact CG1-CD1 3.86Å; V116-I120 HydrophobicContact CG1-CG1 4.41Å; V116-I120 VanDerWaalsContact O-CG1 3.32Å; V116-I120 WeakPolarHBondContact O-CG1 3.38Å; V116-I120 PolarHBondContact O-N 3.23Å; V116-V200 HydrophobicContact CG1-CG1 4.16Å; V116-L204 HydrophobicContact CG1-CD1 4.05Å; V116-L204 HydrophobicContact CG2-CD1 3.91Å
117N85.7Confident87.1Confident37 Ų3776.9 Ų76.920%0.19839%0.393CS..Hα-helixtrans-61.2-47.7178.6-73.2-1.7000111.7E113 D114 S119 I120 M121 E197E113-N117 PolarHBondContact O-N 3.47Å; E113-N117 VanDerWaalsContact O-N 3.09Å; E113-N117 PolarHBondContact O-OD1 2.91Å; D114-N117 PolarHBondContact O-N 3.27Å; N117-S119 VanDerWaalsContact C-N 3.33Å; N117-S119 PolarHBondContact O-N 2.95Å; N117-I120 PolarHBondContact O-N 3.07Å; N117-M121 WeakPolarHBondContact O-CG 3.19Å; N117-M121 PolarHBondContact O-N 3.29Å; N117-M121 VanDerWaalsContact O-N 3.14Å; N117-E197 PolarHBondContact ND2-OE1 3.36Å; N117-E197 VanDerWaalsContact OD1-CG 3.28Å; N117-E197 WeakPolarHBondContact OD1-CG 3.33Å; N117-E197 PolarHBondContact OD1-OE1 3.48Å
118T87.9Confident87Confident76 Ų7675.7 Ų75.747%0.46638%0.383SS..Hα-helixtrans-62-41.6176.8-57.30000111.6D114 E115 M121 K122D114-T118 PolarHBondContact O-N 3.32Å; D114-T118 PolarHBondContact O-OG1 3.29Å; D114-T118 VanDerWaalsContact O-OG1 3.07Å; E115-T118 PolarHBondContact O-N 2.95Å; T118-M121 PolarHBondContact O-N 3.49Å; T118-K122 PolarHBondContact O-N 3.46Å; T118-K122 VanDerWaalsContact O-N 3.08Å
119S86.5Confident86.7Confident52 Ų5271.3 Ų71.336%0.36438%0.377SS..Hα-helixtrans-64.7-43.3178.5-63.60000111.8E115 V116 N117 M121 K122 V123E115-S119 WeakPolarHBondContact O-CB 3.27Å; E115-S119 PolarHBondContact O-N 3.46Å; E115-S119 PolarHBondContact O-OG 2.88Å; V116-S119 PolarHBondContact O-N 3.49Å; N117-S119 VanDerWaalsContact C-N 3.33Å; N117-S119 PolarHBondContact O-N 2.95Å; S119-M121 VanDerWaalsContact C-N 3.34Å; S119-M121 PolarHBondContact O-N 2.95Å; S119-K122 PolarHBondContact O-N 3.1Å; S119-V123 VanDerWaalsContact O-CG2 3.24Å; S119-V123 WeakPolarHBondContact O-CG2 3.5Å; S119-V123 PolarHBondContact O-N 3.45Å
120I87.2Confident86.6Confident24 Ų2468.1 Ų68.112%0.12337%0.372CS..Hα-helixtrans-58.6-48176.2-73.1171.5000109.9V116 N117 K122 V123 Y124 I151 E197 V200V116-I120 HydrophobicContact CG1-CD1 3.86Å; V116-I120 HydrophobicContact CG1-CG1 4.41Å; V116-I120 VanDerWaalsContact O-CG1 3.32Å; V116-I120 WeakPolarHBondContact O-CG1 3.38Å; V116-I120 PolarHBondContact O-N 3.23Å; N117-I120 PolarHBondContact O-N 3.07Å; I120-K122 VanDerWaalsContact C-N 3.33Å; I120-K122 PolarHBondContact O-N 3.5Å; I120-V123 PolarHBondContact O-N 2.95Å; I120-Y124 HydrophobicContact CG2-CD2 3.87Å; I120-Y124 HydrophobicContact CG2-CE2 3.94Å; I120-Y124 VanDerWaalsContact O-CD2 3.32Å; I120-Y124 WeakPolarHBondContact O-CD2 3.37Å; I120-Y124 PolarHBondContact O-N 2.99Å; I120-I151 HydrophobicContact CG2-CG1 4.19Å; I120-I151 HydrophobicContact CG2-CG2 4.21Å; I120-E197 HydrophobicContact CD1-CG 4.5Å; I120-V200 HydrophobicContact CD1-CB 4.25Å; I120-V200 HydrophobicContact CD1-CG1 4.17Å; I120-V200 HydrophobicContact CD1-CG2 4.45Å
121M88Confident86.1Confident94 Ų9471.1 Ų71.146%0.46338%0.379SS..Hα-helixtrans-57.5-45.7178.2-68.3-179.6-176.800112.1N117 T118 S119 Y124 D125 I151N117-M121 WeakPolarHBondContact O-CG 3.19Å; N117-M121 PolarHBondContact O-N 3.29Å; N117-M121 VanDerWaalsContact O-N 3.14Å; T118-M121 PolarHBondContact O-N 3.49Å; S119-M121 VanDerWaalsContact C-N 3.34Å; S119-M121 PolarHBondContact O-N 2.95Å; M121-Y124 PolarHBondContact O-N 3.39Å; M121-D125 PolarHBondContact O-N 3.42Å; M121-D125 VanDerWaalsContact O-N 3.1Å; M121-I151 HydrophobicContact CB-CD1 4.5Å; M121-I151 HydrophobicContact CG-CD1 4.05Å
122K87.4Confident85.5Confident132 Ų13268.4 Ų68.457%0.57438%0.376SS*.Hα-helixtrans-62.7-45.1179.2-173.7-179.5174.6-172.50112.4T118 S119 I120 Y124 D125 E126T118-K122 PolarHBondContact O-N 3.46Å; T118-K122 VanDerWaalsContact O-N 3.08Å; S119-K122 PolarHBondContact O-N 3.1Å; I120-K122 VanDerWaalsContact C-N 3.33Å; I120-K122 PolarHBondContact O-N 3.5Å; K122-Y124 VanDerWaalsContact C-N 3.27Å; K122-Y124 PolarHBondContact O-N 3.46Å; K122-D125 PolarHBondContact O-N 2.98Å; K122-D125 VanDerWaalsContact O-N 3.16Å; K122-E126 WeakPolarHBondContact CE-OE1 3.23Å; K122-E126 PolarHBondContact O-N 3.22Å; K122-E126 VanDerWaalsContact O-N 3.11Å
123V86.5Confident85.4Confident45 Ų4565.7 Ų65.727%0.27336%0.359SS..Hα-helixtrans-64.4-34.6179.8177.40000111.1S119 I120 E126 Y127 Q135 I139S119-V123 VanDerWaalsContact O-CG2 3.24Å; S119-V123 WeakPolarHBondContact O-CG2 3.5Å; S119-V123 PolarHBondContact O-N 3.45Å; I120-V123 PolarHBondContact O-N 2.95Å; V123-E126 PolarHBondContact O-N 2.71Å; V123-Y127 PolarHBondContact O-N 3.44Å; V123-Q135 HydrophobicContact CG1-CB 3.88Å; V123-Q135 HydrophobicContact CG1-CG 4.18Å; V123-I139 HydrophobicContact CG1-CD1 3.77Å; V123-I139 HydrophobicContact CG1-CG1 3.85Å; V123-I139 VanDerWaalsContact O-CD1 3.26Å; V123-I139 WeakPolarHBondContact O-CD1 3.49Å
124Y89.6Confident85.2Confident11 Ų1163.9 Ų63.94%0.04336%0.356CS..Hα-helixtrans-69.5-33174.3-92.1-96.6000113.4I120 M121 K122 Y127 I139 Q143 G150 I151 W157I120-Y124 HydrophobicContact CG2-CD2 3.87Å; I120-Y124 HydrophobicContact CG2-CE2 3.94Å; I120-Y124 VanDerWaalsContact O-CD2 3.32Å; I120-Y124 WeakPolarHBondContact O-CD2 3.37Å; I120-Y124 PolarHBondContact O-N 2.99Å; M121-Y124 PolarHBondContact O-N 3.39Å; K122-Y124 VanDerWaalsContact C-N 3.27Å; K122-Y124 PolarHBondContact O-N 3.46Å; Y124-Y127 WeakPolarHBondContact O-CB 3.38Å; Y124-Y127 PolarHBondContact O-N 2.84Å; Y124-I139 HydrophobicContact CD1-CD1 4.18Å; Y124-I139 HydrophobicContact CD2-CD1 3.86Å; Y124-I139 HydrophobicContact CD2-CG1 4.13Å; Y124-I139 HydrophobicContact CE1-CG2 4.02Å; Y124-I139 HydrophobicContact CE2-CD1 4.24Å; Y124-I139 HydrophobicContact CE2-CG1 4.06Å; Y124-I139 HydrophobicContact CE2-CG2 4.37Å; Y124-I139 HydrophobicContact CG-CD1 3.85Å; Y124-Q143 PolarHBondContact OH-NE2 2.9Å; Y124-G150 PolarHBondContact OH-O 3.29Å; Y124-I151 HydrophobicContact CD1-CG1 4.22Å; Y124-I151 HydrophobicContact CD2-CD1 4.46Å; Y124-I151 HydrophobicContact CD2-CG1 3.9Å; Y124-I151 HydrophobicContact CE1-CG1 4.47Å; Y124-I151 HydrophobicContact CE2-CG1 4.16Å; Y124-I151 HydrophobicContact CG-CD1 4.21Å; Y124-I151 HydrophobicContact CG-CG1 3.91Å; Y124-W157 AromaticContact CD1-CH2 3.89Å; Y124-W157 HydrophobicContact CD1-CH2 3.89Å; Y124-W157 AromaticContact CD1-CZ2 3.96Å; Y124-W157 HydrophobicContact CD1-CZ2 3.96Å; Y124-W157 HydrophobicContact CD1-CZ3 4.3Å; Y124-W157 AromaticContact CE1-CE2 3.85Å; Y124-W157 AromaticContact CE1-CH2 3.83Å; Y124-W157 HydrophobicContact CE1-CH2 3.83Å; Y124-W157 AromaticContact CE1-CZ2 3.44Å; Y124-W157 HydrophobicContact CE1-CZ2 3.44Å; Y124-W157 VanDerWaalsContact CE1-CZ2 3.44Å
125D87.9Confident85.1Confident108 Ų10860.7 Ų60.758%0.57834%0.338SS*.Hα-helixtrans-70.6-33.6175.3-161.747.8000112M121 K122 Y127M121-D125 PolarHBondContact O-N 3.42Å; M121-D125 VanDerWaalsContact O-N 3.1Å; K122-D125 PolarHBondContact O-N 2.98Å; K122-D125 VanDerWaalsContact O-N 3.16Å; D125-Y127 VanDerWaalsContact C-N 3.27Å; D125-Y127 PolarHBondContact O-N 3.48Å
126E87.6Confident85.2Confident82 Ų8255.6 Ų55.638%0.38331%0.314SS..THydrogen-bonded Turntrans-82.12.6176-67.7175.9-170.700113.8K122 V123 N128 N133 Q135K122-E126 WeakPolarHBondContact CE-OE1 3.23Å; K122-E126 PolarHBondContact O-N 3.22Å; K122-E126 VanDerWaalsContact O-N 3.11Å; V123-E126 PolarHBondContact O-N 2.71Å; E126-N128 PolarHBondContact O-N 3.31Å; E126-N133 PolarHBondContact O-ND2 2.92Å; E126-Q135 HydrophobicContact CB-CB 4.4Å; E126-Q135 HydrophobicContact CB-CG 4Å; E126-Q135 WeakPolarHBondContact OE2-CG 3.31Å; E126-Q135 PolarHBondContact OE2-NE2 3.3Å
127Y89.4Confident85.4Confident13 Ų1358.4 Ų58.45%0.05132%0.321CS..  trans-67.7128.8177.2-173.6-88.6000111V123 Y124 D125 G129 I139 D140 W157 W162 P172V123-Y127 PolarHBondContact O-N 3.44Å; Y124-Y127 WeakPolarHBondContact O-CB 3.38Å; Y124-Y127 PolarHBondContact O-N 2.84Å; D125-Y127 VanDerWaalsContact C-N 3.27Å; D125-Y127 PolarHBondContact O-N 3.48Å; Y127-G129 VanDerWaalsContact CE1-CA 3.44Å; Y127-G129 VanDerWaalsContact CE1-N 3.29Å; Y127-I139 HydrophobicContact CD2-CB 4Å; Y127-I139 HydrophobicContact CD2-CD1 3.67Å; Y127-I139 HydrophobicContact CD2-CG1 4.42Å; Y127-I139 HydrophobicContact CD2-CG2 4.12Å; Y127-I139 HydrophobicContact CE2-CB 4.18Å; Y127-I139 HydrophobicContact CE2-CG2 4.13Å; Y127-I139 HydrophobicContact CG-CD1 4.27Å; Y127-D140 PolarHBondContact OH-OD1 2.93Å; Y127-D140 VanDerWaalsContact OH-OD1 3.07Å; Y127-W157 AromaticContact CD1-CH2 3.8Å; Y127-W157 HydrophobicContact CD1-CH2 3.8Å; Y127-W157 AromaticContact CD1-CZ3 3.56Å; Y127-W157 HydrophobicContact CD1-CZ3 3.56Å; Y127-W157 AromaticContact CD2-CH2 3.86Å; Y127-W157 HydrophobicContact CD2-CH2 3.86Å; Y127-W157 HydrophobicContact CD2-CZ3 4.39Å; Y127-W157 AromaticContact CE1-CH2 3.97Å; Y127-W157 HydrophobicContact CE1-CH2 3.97Å; Y127-W157 AromaticContact CE1-CZ3 3.96Å; Y127-W157 HydrophobicContact CE1-CZ3 3.96Å; Y127-W157 HydrophobicContact CE2-CH2 4.03Å; Y127-W157 AromaticContact CG-CH2 3.74Å; Y127-W157 HydrophobicContact CG-CH2 3.74Å; Y127-W157 AromaticContact CG-CZ3 3.81Å; Y127-W157 HydrophobicContact CG-CZ3 3.81Å; Y127-W162 HydrophobicContact CD1-CB 4.02Å; Y127-W162 HydrophobicContact CD1-CD2 4Å; Y127-W162 AromaticContact CD1-CG 3.72Å; Y127-W162 HydrophobicContact CD1-CG 3.72Å; Y127-W162 AromaticContact CE1-CD2 3.84Å; Y127-W162 HydrophobicContact CE1-CD2 3.84Å; Y127-W162 AromaticContact CE1-CE2 3.89Å; Y127-W162 HydrophobicContact CE1-CE3 4.38Å; Y127-W162 AromaticContact CE1-CG 3.97Å; Y127-W162 HydrophobicContact CE1-CG 3.97Å; Y127-W162 HydrophobicContact CE1-CZ2 4.46Å; Y127-W162 AromaticContact CE1-NE1 3.99Å; Y127-W162 WeakPolarHBondContact O-CB 3.48Å; Y127-P172 HydrophobicContact CE1-CG 3.7Å; Y127-P172 HydrophobicContact CE2-CG 4.43Å; Y127-P172 WeakPolarHBondContact OH-CB 3.5Å; Y127-P172 VanDerWaalsContact OH-CG 3.32Å; Y127-P172 WeakPolarHBondContact OH-CG 3.13Å
128N88.6Confident85.5Confident70 Ų7058.9 Ų58.937%0.37433%0.33SS..  trans-126.31177.77110.3000113.8E126 T130 N133 S136E126-N128 PolarHBondContact O-N 3.31Å; N128-T130 VanDerWaalsContact CG-OG1 3.24Å; N128-T130 PolarHBondContact ND2-OG1 2.71Å; N128-T130 PolarHBondContact O-N 3.44Å; N128-T130 WeakPolarHBondContact OD1-CB 3.07Å; N128-T130 PolarHBondContact OD1-N 3.16Å; N128-T130 PolarHBondContact OD1-OG1 3.07Å; N128-N133 WeakPolarHBondContact OD1-CB 3.45Å; N128-N133 PolarHBondContact OD1-ND2 2.99Å; N128-S136 PolarHBondContact N-OG 3.23Å; N128-S136 VanDerWaalsContact N-OG 3.14Å; N128-S136 PolarHBondContact OD1-OG 3.27Å
129G84.3Confident85.7Confident36 Ų3655.5 Ų55.537%0.37131%0.309SS..  trans68.56.8179.200000116Y127 S136Y127-G129 VanDerWaalsContact CE1-CA 3.44Å; Y127-G129 VanDerWaalsContact CE1-N 3.29Å; G129-S136 PolarHBondContact N-OG 2.95Å; G129-S136 VanDerWaalsContact N-OG 3.15Å
130T82.6Confident86Confident57 Ų5753.9 Ų53.935%0.3530%0.296SS..  trans-93141.1176.765.70000111.4N128 S132 N133 S136N128-T130 VanDerWaalsContact CG-OG1 3.24Å; N128-T130 PolarHBondContact ND2-OG1 2.71Å; N128-T130 PolarHBondContact O-N 3.44Å; N128-T130 WeakPolarHBondContact OD1-CB 3.07Å; N128-T130 PolarHBondContact OD1-N 3.16Å; N128-T130 PolarHBondContact OD1-OG1 3.07Å; T130-S132 PolarHBondContact O-N 3.33Å; T130-S132 PolarHBondContact OG1-OG 2.93Å; T130-N133 PolarHBondContact O-N 2.8Å; T130-S136 WeakPolarHBondContact O-CB 3.47Å
131N75.4Confident86.3Confident128 Ų12859.7 Ų59.768%0.68432%0.318SS*.THydrogen-bonded Turntrans-69-17.6178.6-73.8-37.7000113.4R137N131-R137 VanDerWaalsContact O-CD 3.27Å; N131-R137 WeakPolarHBondContact O-CD 3.33Å; N131-R137 PolarHBondContact O-NH1 3.32Å
132S76.6Confident86.5Confident76 Ų7657.5 Ų57.553%0.53131%0.309SS..THydrogen-bonded Turntrans-73-30.3174.146.70000111.9T130 R137T130-S132 PolarHBondContact O-N 3.33Å; T130-S132 PolarHBondContact OG1-OG 2.93Å; S132-R137 PolarHBondContact O-NH1 3Å
133N80.7Confident86.9Confident27 Ų2751.2 Ų51.214%0.14428%0.282CS..  trans-74.5126-179.1-166.637.6000112.4E126 N128 T130 Q135 S136 R137E126-N133 PolarHBondContact O-ND2 2.92Å; N128-N133 WeakPolarHBondContact OD1-CB 3.45Å; N128-N133 PolarHBondContact OD1-ND2 2.99Å; T130-N133 PolarHBondContact O-N 2.8Å; N133-Q135 PolarHBondContact OD1-OE1 3.03Å; N133-S136 PolarHBondContact ND2-N 2.92Å; N133-S136 PolarHBondContact ND2-OG 3.26Å; N133-S136 PolarHBondContact O-N 3.19Å; N133-R137 PolarHBondContact O-N 3.44Å
134A80.4Confident87.3Confident30 Ų3055.7 Ų55.725%0.24829%0.294CS..Hα-helixtrans-66.6-41-177.400000112.1F46 S136 R137 A138F46-A134 HydrophobicContact CD1-CB 4.29Å; F46-A134 HydrophobicContact CE1-CB 4.31Å; A134-S136 PolarHBondContact O-N 3.46Å; A134-R137 PolarHBondContact O-N 2.88Å; A134-A138 WeakPolarHBondContact O-CB 3.38Å; A134-A138 PolarHBondContact O-N 3.36Å
135Q84.9Confident87.6Confident37 Ų3760.7 Ų60.717%0.17332%0.318CS..Hα-helixtrans-60.4-45.3177.8-63.785.7-3100110.8V123 E126 N133 R137 A138 I139V123-Q135 HydrophobicContact CG1-CB 3.88Å; V123-Q135 HydrophobicContact CG1-CG 4.18Å; E126-Q135 HydrophobicContact CB-CB 4.4Å; E126-Q135 HydrophobicContact CB-CG 4Å; E126-Q135 WeakPolarHBondContact OE2-CG 3.31Å; E126-Q135 PolarHBondContact OE2-NE2 3.3Å; N133-Q135 PolarHBondContact OD1-OE1 3.03Å; Q135-R137 PolarHBondContact O-N 3.31Å; Q135-A138 PolarHBondContact O-N 2.9Å; Q135-I139 PolarHBondContact O-N 3.42Å
136S88.2Confident87.9Confident1 Ų157.3 Ų57.31%0.00730%0.3CS..Hα-helixtrans-61.1-45.2177.1-58.40000112N128 G129 T130 N133 A134 I139 D140N128-S136 PolarHBondContact N-OG 3.23Å; N128-S136 VanDerWaalsContact N-OG 3.14Å; N128-S136 PolarHBondContact OD1-OG 3.27Å; G129-S136 PolarHBondContact N-OG 2.95Å; G129-S136 VanDerWaalsContact N-OG 3.15Å; T130-S136 WeakPolarHBondContact O-CB 3.47Å; N133-S136 PolarHBondContact ND2-N 2.92Å; N133-S136 PolarHBondContact ND2-OG 3.26Å; N133-S136 PolarHBondContact O-N 3.19Å; A134-S136 PolarHBondContact O-N 3.46Å; S136-I139 PolarHBondContact O-N 2.86Å; S136-D140 WeakPolarHBondContact O-CB 3.38Å; S136-D140 PolarHBondContact O-N 3.48Å
137R88.1Confident88.3Confident91 Ų9159.2 Ų59.234%0.34331%0.308SS..Hα-helixtrans-65-39.2176.3-67.7-165.3-53.4-83-9.9112.3N131 S132 N133 A134 Q135 Y141N131-R137 VanDerWaalsContact O-CD 3.27Å; N131-R137 WeakPolarHBondContact O-CD 3.33Å; N131-R137 PolarHBondContact O-NH1 3.32Å; S132-R137 PolarHBondContact O-NH1 3Å; N133-R137 PolarHBondContact O-N 3.44Å; A134-R137 PolarHBondContact O-N 2.88Å; Q135-R137 PolarHBondContact O-N 3.31Å; R137-Y141 WeakPolarHBondContact O-CB 3.4Å; R137-Y141 PolarHBondContact O-N 3.01Å
138A87.7Confident88.6Confident47 Ų4758.6 Ų58.639%0.38831%0.306SS..Hα-helixtrans-63.6-46.7178.700000111.3A134 Q135 Y141 V142A134-A138 WeakPolarHBondContact O-CB 3.38Å; A134-A138 PolarHBondContact O-N 3.36Å; Q135-A138 PolarHBondContact O-N 2.9Å; A138-Y141 PolarHBondContact O-N 2.97Å; A138-V142 WeakPolarHBondContact O-CB 3.34Å; A138-V142 VanDerWaalsContact O-CG2 3.27Å; A138-V142 WeakPolarHBondContact O-CG2 3.3Å; A138-V142 PolarHBondContact O-N 3.49Å
139I92.3Very high89Confident5 Ų555.3 Ų55.33%0.02629%0.288CS..Hα-helixtrans-61.7-49.6176.1-72.5166.9000110.9V123 Y124 Y127 Q135 S136 Y141 V142 Q143 W157V123-I139 HydrophobicContact CG1-CD1 3.77Å; V123-I139 HydrophobicContact CG1-CG1 3.85Å; V123-I139 VanDerWaalsContact O-CD1 3.26Å; V123-I139 WeakPolarHBondContact O-CD1 3.49Å; Y124-I139 HydrophobicContact CD1-CD1 4.18Å; Y124-I139 HydrophobicContact CD2-CD1 3.86Å; Y124-I139 HydrophobicContact CD2-CG1 4.13Å; Y124-I139 HydrophobicContact CE1-CG2 4.02Å; Y124-I139 HydrophobicContact CE2-CD1 4.24Å; Y124-I139 HydrophobicContact CE2-CG1 4.06Å; Y124-I139 HydrophobicContact CE2-CG2 4.37Å; Y124-I139 HydrophobicContact CG-CD1 3.85Å; Y127-I139 HydrophobicContact CD2-CB 4Å; Y127-I139 HydrophobicContact CD2-CD1 3.67Å; Y127-I139 HydrophobicContact CD2-CG1 4.42Å; Y127-I139 HydrophobicContact CD2-CG2 4.12Å; Y127-I139 HydrophobicContact CE2-CB 4.18Å; Y127-I139 HydrophobicContact CE2-CG2 4.13Å; Y127-I139 HydrophobicContact CG-CD1 4.27Å; Q135-I139 PolarHBondContact O-N 3.42Å; S136-I139 PolarHBondContact O-N 2.86Å; I139-Y141 PolarHBondContact O-N 3.3Å; I139-V142 PolarHBondContact O-N 3.43Å; I139-Q143 HydrophobicContact CG2-CG 4.24Å; I139-Q143 WeakPolarHBondContact O-CB 3.36Å; I139-Q143 WeakPolarHBondContact O-CG 3.28Å; I139-Q143 PolarHBondContact O-N 2.91Å; I139-W157 HydrophobicContact CG2-CH2 4.04Å; I139-W157 HydrophobicContact CG2-CZ2 3.99Å
140D93.4Very high89.4Confident17 Ų1753.6 Ų53.69%0.09127%0.271CS..Hα-helixtrans-60.3-37.7-179.8-81.85000112.1Y127 S136 R144 S174Y127-D140 PolarHBondContact OH-OD1 2.93Å; Y127-D140 VanDerWaalsContact OH-OD1 3.07Å; S136-D140 WeakPolarHBondContact O-CB 3.38Å; S136-D140 PolarHBondContact O-N 3.48Å; D140-R144 WeakPolarHBondContact O-CB 3.5Å; D140-R144 WeakPolarHBondContact O-CD 3.48Å; D140-R144 WeakPolarHBondContact O-CG 3.38Å; D140-R144 PolarHBondContact O-N 3.22Å; D140-R144 IonicContact OD2-NH2 3.87Å; D140-S174 VanDerWaalsContact CG-OG 3.32Å; D140-S174 WeakPolarHBondContact OD1-CB 3.39Å; D140-S174 PolarHBondContact OD1-OG 3Å
141Y92.2Very high90Very high147 Ų14751.9 Ų51.958%0.57626%0.259SS*.Hα-helixtrans-65.8-50175.3178.3-96.9000111.3R137 A138 I139 Q143 R144 Q145R137-Y141 WeakPolarHBondContact O-CB 3.4Å; R137-Y141 PolarHBondContact O-N 3.01Å; A138-Y141 PolarHBondContact O-N 2.97Å; I139-Y141 PolarHBondContact O-N 3.3Å; Y141-Q143 PolarHBondContact O-N 3.16Å; Y141-R144 PolarHBondContact O-N 3.17Å; Y141-Q145 HydrophobicContact CD1-CG 4.05Å; Y141-Q145 HydrophobicContact CD2-CG 4.05Å; Y141-Q145 HydrophobicContact CE1-CG 3.7Å; Y141-Q145 HydrophobicContact CE2-CG 3.7Å; Y141-Q145 HydrophobicContact CG-CG 4.22Å; Y141-Q145 WeakPolarHBondContact O-CB 3.37Å; Y141-Q145 VanDerWaalsContact O-CG 3.26Å; Y141-Q145 WeakPolarHBondContact O-CG 3.36Å; Y141-Q145 PolarHBondContact O-N 2.77Å
142V93.7Very high90.9Very high47 Ų4751.2 Ų51.229%0.28525%0.252SS..Hα-helixtrans-60.7-45.9-179.81690000111A138 I139 R144 Q145 L146 C196 V200A138-V142 WeakPolarHBondContact O-CB 3.34Å; A138-V142 VanDerWaalsContact O-CG2 3.27Å; A138-V142 WeakPolarHBondContact O-CG2 3.3Å; A138-V142 PolarHBondContact O-N 3.49Å; I139-V142 PolarHBondContact O-N 3.43Å; V142-R144 VanDerWaalsContact C-N 3.35Å; V142-R144 PolarHBondContact O-N 3.14Å; V142-Q145 PolarHBondContact O-N 3.04Å; V142-L146 HydrophobicContact CG1-CD1 3.99Å; V142-L146 HydrophobicContact CG1-CG 4.43Å; V142-L146 WeakPolarHBondContact O-CB 3.5Å; V142-L146 PolarHBondContact O-N 3.14Å; V142-C196 HydrophobicContact CG1-CB 4.33Å; V142-V200 HydrophobicContact CG1-CG2 3.99Å
143Q95.7Very high91.7Very high0 Ų049.8 Ų49.80%024%0.238CC..Hα-helixtrans-60.5-43.1178.9-74.6-174.9-16.800112.3Y124 I139 Y141 Q147 C148 W157 S174 C175Y124-Q143 PolarHBondContact OH-NE2 2.9Å; I139-Q143 HydrophobicContact CG2-CG 4.24Å; I139-Q143 WeakPolarHBondContact O-CB 3.36Å; I139-Q143 WeakPolarHBondContact O-CG 3.28Å; I139-Q143 PolarHBondContact O-N 2.91Å; Y141-Q143 PolarHBondContact O-N 3.16Å; Q143-Q147 WeakPolarHBondContact O-CA 3.32Å; Q143-Q147 PolarHBondContact O-N 3.41Å; Q143-C148 WeakPolarHBondContact CA-O 3.29Å; Q143-C148 WeakPolarHBondContact CB-O 3.33Å; Q143-C148 WeakPolarHBondContact CG-O 3.45Å; Q143-C148 PolarHBondContact O-N 2.87Å; Q143-W157 VanDerWaalsContact NE2-CZ2 3.31Å; Q143-S174 PolarHBondContact OE1-OG 3.07Å; Q143-C175 VanDerWaalsContact CD-SG 3.51Å; Q143-C175 PolarHBondContact NE2-SG 3.43Å; Q143-C175 VanDerWaalsContact NE2-SG 3.45Å; Q143-C175 PolarHBondContact OE1-SG 3.05Å
144R94.6Very high92.3Very high140 Ų14049.6 Ų49.653%0.52824%0.236SC..Hα-helixtrans-69.2-41.9176.5-70.9172.3-174.3146.29.8112.8D140 Y141 V142D140-R144 WeakPolarHBondContact O-CB 3.5Å; D140-R144 WeakPolarHBondContact O-CD 3.48Å; D140-R144 WeakPolarHBondContact O-CG 3.38Å; D140-R144 PolarHBondContact O-N 3.22Å; D140-R144 IonicContact OD2-NH2 3.87Å; Y141-R144 PolarHBondContact O-N 3.17Å; V142-R144 VanDerWaalsContact C-N 3.35Å; V142-R144 PolarHBondContact O-N 3.14Å
145Q95.1Very high92.8Very high116 Ų11650.2 Ų50.254%0.54224%0.239SC..Hα-helixtrans-72.9-40.8-176.6-74.7-62.4-18.800112.8Y141 V142Y141-Q145 HydrophobicContact CD1-CG 4.05Å; Y141-Q145 HydrophobicContact CD2-CG 4.05Å; Y141-Q145 HydrophobicContact CE1-CG 3.7Å; Y141-Q145 HydrophobicContact CE2-CG 3.7Å; Y141-Q145 HydrophobicContact CG-CG 4.22Å; Y141-Q145 WeakPolarHBondContact O-CB 3.37Å; Y141-Q145 VanDerWaalsContact O-CG 3.26Å; Y141-Q145 WeakPolarHBondContact O-CG 3.36Å; Y141-Q145 PolarHBondContact O-N 2.77Å; V142-Q145 PolarHBondContact O-N 3.04Å
146L95.1Very high93.2Very high37 Ų3750.2 Ų50.219%0.19424%0.24CC..Hα-helixtrans-95.2-4.2-178.5-59.2-172.4000112.9V142 C148 L199 V200 K203V142-L146 HydrophobicContact CG1-CD1 3.99Å; V142-L146 HydrophobicContact CG1-CG 4.43Å; V142-L146 WeakPolarHBondContact O-CB 3.5Å; V142-L146 PolarHBondContact O-N 3.14Å; L146-C148 VanDerWaalsContact C-N 3.32Å; L146-C148 PolarHBondContact O-N 3.36Å; L146-L199 HydrophobicContact CB-CB 4.42Å; L146-L199 HydrophobicContact CB-CD2 4.3Å; L146-L199 HydrophobicContact CD1-CB 4.27Å; L146-L199 WeakPolarHBondContact O-CD2 3.49Å; L146-V200 HydrophobicContact CD1-CB 4.41Å; L146-V200 HydrophobicContact CD1-CG2 3.51Å; L146-K203 HydrophobicContact CD2-CD 4.3Å; L146-K203 HydrophobicContact CD2-CG 3.78Å
147Q95.7Very high93.4Very high122 Ų12250.2 Ų50.257%0.5724%0.24SC*.THydrogen-bonded Turntrans55.848.8179.1-57.8-170.1-57.100111.7Q143 Y192Q143-Q147 WeakPolarHBondContact O-CA 3.32Å; Q143-Q147 PolarHBondContact O-N 3.41Å; Q147-Y192 HydrophobicContact CB-CD1 3.94Å; Q147-Y192 HydrophobicContact CB-CE1 3.49Å; Q147-Y192 VanDerWaalsContact CB-CE1 3.49Å; Q147-Y192 HydrophobicContact CB-CE2 4.33Å; Q147-Y192 HydrophobicContact CG-CE1 4.1Å; Q147-Y192 WeakPolarHBondContact O-CD1 3.32Å; Q147-Y192 VanDerWaalsContact O-CG 3.27Å
148C96.1Very high93.5Very high0 Ų051.8 Ų51.80%025%0.246CC..  trans-128.2163.6-176.361.30000110.6Q143 L146 E194 C196 L199Q143-C148 WeakPolarHBondContact CA-O 3.29Å; Q143-C148 WeakPolarHBondContact CB-O 3.33Å; Q143-C148 WeakPolarHBondContact CG-O 3.45Å; Q143-C148 PolarHBondContact O-N 2.87Å; L146-C148 VanDerWaalsContact C-N 3.32Å; L146-C148 PolarHBondContact O-N 3.36Å; C148-E194 CarbonylContact C-O 3.26Å; C148-E194 VanDerWaalsContact CA-O 3.27Å; C148-E194 WeakPolarHBondContact CA-O 3.41Å; C148-E194 VanDerWaalsContact CB-O 3.3Å; C148-E194 WeakPolarHBondContact CB-O 3.2Å; C148-C196 VanDerWaalsContact C-SG 3.56Å; C148-C196 HydrophobicContact CB-CB 3.94Å; C148-C196 WeakPolarHBondContact CB-SG 3.49Å; C148-C196 WeakPolarHBondContact SG-CA 3.34Å; C148-C196 WeakPolarHBondContact SG-CB 3.26Å; C148-C196 CovalentContact SG-SG 2.04Å; C148-C196 PolarHBondContact SG-SG 3.31Å; C148-L199 HydrophobicContact CB-CD2 4.35Å
149C95.6Very high93.6Very high0 Ų056.2 Ų56.20%026%0.258CS..  trans-142132.6174.9-173.40000111.8N153 F154 W157 C175 Y192 E194C149-N153 CarbonylContact O-C 3.47Å; C149-N153 WeakPolarHBondContact O-CA 3.48Å; C149-F154 HydrophobicContact CB-CB 4.11Å; C149-F154 PolarHBondContact O-N 3.21Å; C149-F154 VanDerWaalsContact O-N 3.16Å; C149-F154 VanDerWaalsContact SG-CB 3.5Å; C149-W157 PolarHBondContact SG-NE1 3.35Å; C149-C175 VanDerWaalsContact CA-SG 3.57Å; C149-C175 HydrophobicContact CB-CB 3.63Å; C149-C175 WeakPolarHBondContact CB-SG 3.26Å; C149-C175 WeakPolarHBondContact SG-CB 3.32Å; C149-C175 CovalentContact SG-SG 2.03Å; C149-C175 PolarHBondContact SG-SG 3.48Å; C149-Y192 VanDerWaalsContact CB-O 3.26Å; C149-Y192 WeakPolarHBondContact CB-O 3.49Å; C149-E194 PolarHBondContact N-O 3.49Å
150G94.3Very high93.5Very high0 Ų056.5 Ų56.50%026%0.26CS..SBendtrans70-171.4-176.700000113Y124 N153 C196Y124-G150 PolarHBondContact OH-O 3.29Å; G150-N153 WeakPolarHBondContact CA-O 3.41Å; G150-C196 VanDerWaalsContact O-CB 3.29Å; G150-C196 WeakPolarHBondContact O-CB 3.47Å; G150-C196 PolarHBondContact O-N 3.45Å; G150-C196 PolarHBondContact O-SG 2.99Å
151I93.9Very high93.3Very high22 Ų2260.8 Ų60.811%0.11328%0.279CS..SBendtrans-80.6-58-176.1-59.2173.7000108.6I120 M121 Y124 D156 G195 C196 E197I120-I151 HydrophobicContact CG2-CG1 4.19Å; I120-I151 HydrophobicContact CG2-CG2 4.21Å; M121-I151 HydrophobicContact CB-CD1 4.5Å; M121-I151 HydrophobicContact CG-CD1 4.05Å; Y124-I151 HydrophobicContact CD1-CG1 4.22Å; Y124-I151 HydrophobicContact CD2-CD1 4.46Å; Y124-I151 HydrophobicContact CD2-CG1 3.9Å; Y124-I151 HydrophobicContact CE1-CG1 4.47Å; Y124-I151 HydrophobicContact CE2-CG1 4.16Å; Y124-I151 HydrophobicContact CG-CD1 4.21Å; Y124-I151 HydrophobicContact CG-CG1 3.91Å; I151-D156 PolarHBondContact N-OD2 3.35Å; I151-G195 CarbonylContact O-C 3.36Å; I151-G195 VanDerWaalsContact O-C 3.26Å; I151-G195 VanDerWaalsContact O-CA 3.26Å; I151-G195 WeakPolarHBondContact O-CA 3.02Å; I151-C196 PolarHBondContact O-N 2.92Å; I151-C196 VanDerWaalsContact O-N 3.08Å; I151-E197 HydrophobicContact CG2-CB 4.17Å; I151-E197 WeakPolarHBondContact CG2-OE2 2.91Å; I151-E197 WeakPolarHBondContact O-CB 3.48Å; I151-E197 PolarHBondContact O-N 2.7Å
152H93.9Very high93.2Very high113 Ų11355.7 Ų55.752%0.52326%0.259SS..SBendtrans-105.2-32.2173.1-54.2-53.5000112.2D156 G195 E197H152-D156 WeakPolarHBondContact CA-OD2 3.38Å; H152-D156 PolarHBondContact N-OD2 3.23Å; H152-G195 WeakPolarHBondContact O-CA 3.41Å; H152-G195 PolarHBondContact O-N 2.9Å; H152-G195 VanDerWaalsContact O-N 3.1Å; H152-E197 IonicContact CE1-OE2 2.91Å; H152-E197 PolarHBondContact CE1-OE2 3.42Å; H152-E197 IonicContact ND1-OE2 3.38Å; H152-E197 PolarHBondContact ND1-OE2 2.97Å; H152-E197 IonicContact NE2-OE2 3.87Å
153N94Very high93Very high47 Ų4755.1 Ų55.125%0.25125%0.252SS..SBendtrans-163.5167.2175.8-168.2-4.8000111.1C149 G150 S155 D156 Q193C149-N153 CarbonylContact O-C 3.47Å; C149-N153 WeakPolarHBondContact O-CA 3.48Å; G150-N153 WeakPolarHBondContact CA-O 3.41Å; N153-S155 PolarHBondContact O-N 3.5Å; N153-D156 PolarHBondContact N-OD2 3.38Å; N153-D156 WeakPolarHBondContact O-CB 3.32Å; N153-D156 VanDerWaalsContact O-CG 3.26Å; N153-D156 PolarHBondContact O-N 2.96Å; N153-Q193 PolarHBondContact OD1-O 3.32Å
154F92.8Very high92.7Very high22 Ų2261.2 Ų61.210%0.09628%0.279CS..G310 helixtrans-51.3-25.1173.474.4-103.6000114C149 D156 W157 L185 P188 L191C149-F154 HydrophobicContact CB-CB 4.11Å; C149-F154 PolarHBondContact O-N 3.21Å; C149-F154 VanDerWaalsContact O-N 3.16Å; C149-F154 VanDerWaalsContact SG-CB 3.5Å; F154-D156 PolarHBondContact O-N 3.09Å; F154-W157 WeakPolarHBondContact O-CB 3.24Å; F154-W157 PolarHBondContact O-N 3.14Å; F154-L185 HydrophobicContact CD2-CD2 3.39Å; F154-L185 HydrophobicContact CE2-CD2 3.7Å; F154-L185 HydrophobicContact CG-CD2 4.49Å; F154-P188 HydrophobicContact CE1-CB 4.17Å; F154-P188 HydrophobicContact CZ-CB 3.96Å; F154-L191 HydrophobicContact CB-CD1 4.36Å; F154-L191 HydrophobicContact CD2-CD1 4.41Å; F154-L191 HydrophobicContact CG-CD1 4.28Å
155S92.3Very high92.4Very high44 Ų4460.7 Ų60.731%0.30828%0.282SS..G310 helixtrans-67.3-23.2179.4-67.40000113.1N153 W157 R158N153-S155 PolarHBondContact O-N 3.5Å; S155-W157 PolarHBondContact O-N 3.46Å; S155-R158 VanDerWaalsContact O-CB 3.31Å; S155-R158 WeakPolarHBondContact O-CB 3.5Å; S155-R158 WeakPolarHBondContact O-CG 3.46Å; S155-R158 PolarHBondContact O-N 3.44Å
156D92.6Very high91.8Very high36 Ų3657 Ų5719%0.19327%0.269CS..G310 helixtrans-61.9-28.4-179.7-60.7-32.5000112.3I151 H152 N153 F154 R158 H159I151-D156 PolarHBondContact N-OD2 3.35Å; H152-D156 WeakPolarHBondContact CA-OD2 3.38Å; H152-D156 PolarHBondContact N-OD2 3.23Å; N153-D156 PolarHBondContact N-OD2 3.38Å; N153-D156 WeakPolarHBondContact O-CB 3.32Å; N153-D156 VanDerWaalsContact O-CG 3.26Å; N153-D156 PolarHBondContact O-N 2.96Å; F154-D156 PolarHBondContact O-N 3.09Å; D156-R158 PolarHBondContact O-N 3.28Å; D156-R158 VanDerWaalsContact O-N 3.1Å; D156-H159 WeakPolarHBondContact O-CB 3.17Å; D156-H159 PolarHBondContact O-N 3.08Å
157W92.4Very high91Very high1 Ų164.1 Ų64.10%0.00430%0.298CS..G310 helixtrans-54.6-29.3173.4-75.5110.5000112.6Y124 Y127 I139 Q143 C149 F154 S155 H159 T160 W162 Y163 V171 P172 C175Y124-W157 AromaticContact CD1-CH2 3.89Å; Y124-W157 HydrophobicContact CD1-CH2 3.89Å; Y124-W157 AromaticContact CD1-CZ2 3.96Å; Y124-W157 HydrophobicContact CD1-CZ2 3.96Å; Y124-W157 HydrophobicContact CD1-CZ3 4.3Å; Y124-W157 AromaticContact CE1-CE2 3.85Å; Y124-W157 AromaticContact CE1-CH2 3.83Å; Y124-W157 HydrophobicContact CE1-CH2 3.83Å; Y124-W157 AromaticContact CE1-CZ2 3.44Å; Y124-W157 HydrophobicContact CE1-CZ2 3.44Å; Y124-W157 VanDerWaalsContact CE1-CZ2 3.44Å; Y127-W157 AromaticContact CD1-CH2 3.8Å; Y127-W157 HydrophobicContact CD1-CH2 3.8Å; Y127-W157 AromaticContact CD1-CZ3 3.56Å; Y127-W157 HydrophobicContact CD1-CZ3 3.56Å; Y127-W157 AromaticContact CD2-CH2 3.86Å; Y127-W157 HydrophobicContact CD2-CH2 3.86Å; Y127-W157 HydrophobicContact CD2-CZ3 4.39Å; Y127-W157 AromaticContact CE1-CH2 3.97Å; Y127-W157 HydrophobicContact CE1-CH2 3.97Å; Y127-W157 AromaticContact CE1-CZ3 3.96Å; Y127-W157 HydrophobicContact CE1-CZ3 3.96Å; Y127-W157 HydrophobicContact CE2-CH2 4.03Å; Y127-W157 AromaticContact CG-CH2 3.74Å; Y127-W157 HydrophobicContact CG-CH2 3.74Å; Y127-W157 AromaticContact CG-CZ3 3.81Å; Y127-W157 HydrophobicContact CG-CZ3 3.81Å; I139-W157 HydrophobicContact CG2-CH2 4.04Å; I139-W157 HydrophobicContact CG2-CZ2 3.99Å; Q143-W157 VanDerWaalsContact NE2-CZ2 3.31Å; C149-W157 PolarHBondContact SG-NE1 3.35Å; F154-W157 WeakPolarHBondContact O-CB 3.24Å; F154-W157 PolarHBondContact O-N 3.14Å; S155-W157 PolarHBondContact O-N 3.46Å; W157-H159 PolarHBondContact O-N 3.29Å; W157-H159 VanDerWaalsContact O-N 3.12Å; W157-T160 HydrophobicContact CE3-CG2 4.05Å; W157-T160 HydrophobicContact CZ3-CG2 4.41Å; W157-T160 PolarHBondContact O-N 2.81Å; W157-T160 PolarHBondContact O-OG1 3.3Å; W157-W162 HydrophobicContact CE3-CE3 4.2Å; W157-W162 HydrophobicContact CZ3-CE3 4.37Å; W157-Y163 WeakPolarHBondContact O-CB 3.37Å; W157-V171 HydrophobicContact CB-CG1 3.76Å; W157-V171 HydrophobicContact CG-CB 4.1Å; W157-V171 HydrophobicContact CG-CG1 3.75Å; W157-P172 HydrophobicContact CD2-CG 4.25Å; W157-P172 VanDerWaalsContact CE2-CD 3.4Å; W157-P172 HydrophobicContact CE3-CG 4.22Å; W157-P172 HydrophobicContact CH2-CG 3.48Å; W157-P172 VanDerWaalsContact CH2-CG 3.48Å; W157-P172 HydrophobicContact CZ2-CB 4.39Å; W157-P172 HydrophobicContact CZ2-CG 3.44Å; W157-P172 VanDerWaalsContact CZ2-CG 3.44Å; W157-P172 HydrophobicContact CZ3-CG 3.87Å; W157-C175 PolarHBondContact NE1-SG 2.87Å; W157-C175 VanDerWaalsContact NE1-SG 3.43Å
158R91.1Very high90.3Very high124 Ų12462.4 Ų62.447%0.46829%0.293SS..G310 helixtrans-62.2-23178.1-63.9-176.4-179.4-161.80.9113.5S155 D156 Y163 L185S155-R158 VanDerWaalsContact O-CB 3.31Å; S155-R158 WeakPolarHBondContact O-CB 3.5Å; S155-R158 WeakPolarHBondContact O-CG 3.46Å; S155-R158 PolarHBondContact O-N 3.44Å; D156-R158 PolarHBondContact O-N 3.28Å; D156-R158 VanDerWaalsContact O-N 3.1Å; R158-Y163 HydrophobicContact CB-CD1 4.37Å; R158-Y163 HydrophobicContact CB-CE1 4.14Å; R158-Y163 HydrophobicContact CG-CE1 3.99Å; R158-Y163 HydrophobicContact CG-CE2 4.44Å; R158-L185 HydrophobicContact CG-CD1 4.45Å
159H89.2Confident89.8Confident141 Ų14165.7 Ų65.765%0.65331%0.311SS*.G310 helixtrans-89.5-19.4-177.4-61-66.3000112.9D156 W157 K164D156-H159 WeakPolarHBondContact O-CB 3.17Å; D156-H159 PolarHBondContact O-N 3.08Å; W157-H159 PolarHBondContact O-N 3.29Å; W157-H159 VanDerWaalsContact O-N 3.12Å; H159-K164 WeakPolarHBondContact O-CE 2.85Å; H159-K164 PolarHBondContact O-NZ 3.14Å
160T89.1Confident89.5Confident11 Ų1166.3 Ų66.37%0.06732%0.315CS..SBendtrans-73.5156.1-176.571.70000112.4W157 Y163 K164W157-T160 HydrophobicContact CE3-CG2 4.05Å; W157-T160 HydrophobicContact CZ3-CG2 4.41Å; W157-T160 PolarHBondContact O-N 2.81Å; W157-T160 PolarHBondContact O-OG1 3.3Å; T160-Y163 PolarHBondContact OG1-N 2.94Å; T160-K164 WeakPolarHBondContact O-CG 3.36Å; T160-K164 PolarHBondContact O-N 3.48Å
161H89.2Confident89.5Confident106 Ų10666.4 Ų66.449%0.49132%0.315SS..Hα-helixtrans-62.3-45.2177.1-163.7-97.9000111.6Y163 K164 E165H161-Y163 VanDerWaalsContact C-N 3.33Å; H161-Y163 PolarHBondContact O-N 3.49Å; H161-K164 WeakPolarHBondContact O-CB 3.43Å; H161-K164 PolarHBondContact O-N 2.94Å; H161-E165 IonicContact CE1-OE1 2.97Å; H161-E165 PolarHBondContact CE1-OE1 3.31Å; H161-E165 IonicContact CE1-OE2 3.51Å; H161-E165 IonicContact ND1-OE1 3.42Å; H161-E165 PolarHBondContact ND1-OE1 2.86Å; H161-E165 IonicContact ND1-OE2 3.04Å; H161-E165 PolarHBondContact ND1-OE2 2.96Å; H161-E165 PolarHBondContact O-N 3.07Å
162W90.1Very high89.5Confident41 Ų4165.6 Ų65.616%0.15531%0.312CS..Hα-helixtrans-54-44.6-179.6177.783.6000113.6Y127 W157 K164 E165 S166 S170 P172Y127-W162 HydrophobicContact CD1-CB 4.02Å; Y127-W162 HydrophobicContact CD1-CD2 4Å; Y127-W162 AromaticContact CD1-CG 3.72Å; Y127-W162 HydrophobicContact CD1-CG 3.72Å; Y127-W162 AromaticContact CE1-CD2 3.84Å; Y127-W162 HydrophobicContact CE1-CD2 3.84Å; Y127-W162 AromaticContact CE1-CE2 3.89Å; Y127-W162 HydrophobicContact CE1-CE3 4.38Å; Y127-W162 AromaticContact CE1-CG 3.97Å; Y127-W162 HydrophobicContact CE1-CG 3.97Å; Y127-W162 HydrophobicContact CE1-CZ2 4.46Å; Y127-W162 AromaticContact CE1-NE1 3.99Å; Y127-W162 WeakPolarHBondContact O-CB 3.48Å; W157-W162 HydrophobicContact CE3-CE3 4.2Å; W157-W162 HydrophobicContact CZ3-CE3 4.37Å; W162-K164 PolarHBondContact O-N 3.19Å; W162-E165 PolarHBondContact O-N 3.39Å; W162-S166 WeakPolarHBondContact O-CB 3.41Å; W162-S166 PolarHBondContact O-N 3.16Å; W162-S166 PolarHBondContact O-OG 3.34Å; W162-S170 WeakPolarHBondContact CZ3-O 3.26Å; W162-P172 HydrophobicContact CH2-CG 4.17Å; W162-P172 HydrophobicContact CZ3-CG 4.14Å
163Y90.3Very high89.5Confident35 Ų3565.7 Ų65.714%0.13732%0.315CS..Hα-helixtrans-67.1-37.9179.5177-88.5000112.3W157 R158 T160 H161 E165 S166 K167 N169 S170 L185W157-Y163 WeakPolarHBondContact O-CB 3.37Å; R158-Y163 HydrophobicContact CB-CD1 4.37Å; R158-Y163 HydrophobicContact CB-CE1 4.14Å; R158-Y163 HydrophobicContact CG-CE1 3.99Å; R158-Y163 HydrophobicContact CG-CE2 4.44Å; T160-Y163 PolarHBondContact OG1-N 2.94Å; H161-Y163 VanDerWaalsContact C-N 3.33Å; H161-Y163 PolarHBondContact O-N 3.49Å; Y163-E165 VanDerWaalsContact C-N 3.29Å; Y163-E165 PolarHBondContact O-N 3.32Å; Y163-S166 PolarHBondContact O-OG 3.3Å; Y163-K167 PolarHBondContact O-N 3.24Å; Y163-N169 PolarHBondContact OH-OD1 2.99Å; Y163-S170 WeakPolarHBondContact CD2-O 3.37Å; Y163-L185 HydrophobicContact CE2-CD1 3.63Å; Y163-L185 WeakPolarHBondContact OH-CD1 3.42Å
164K88.8Confident89.5Confident128 Ų12863.6 Ų63.656%0.55730%0.304SS*.Hα-helixtrans-66.2-34.5177.2-66.5171.1-170.4159.70111.5H159 T160 H161 W162H159-K164 WeakPolarHBondContact O-CE 2.85Å; H159-K164 PolarHBondContact O-NZ 3.14Å; T160-K164 WeakPolarHBondContact O-CG 3.36Å; T160-K164 PolarHBondContact O-N 3.48Å; H161-K164 WeakPolarHBondContact O-CB 3.43Å; H161-K164 PolarHBondContact O-N 2.94Å; W162-K164 PolarHBondContact O-N 3.19Å
165E87.9Confident89.6Confident128 Ų12862.5 Ų62.560%0.59830%0.299SS*.Hα-helixtrans-77.6-40.2177.3-69.7-173.2132.100113.1H161 W162 Y163 K167H161-E165 IonicContact CE1-OE1 2.97Å; H161-E165 PolarHBondContact CE1-OE1 3.31Å; H161-E165 IonicContact CE1-OE2 3.51Å; H161-E165 IonicContact ND1-OE1 3.42Å; H161-E165 PolarHBondContact ND1-OE1 2.86Å; H161-E165 IonicContact ND1-OE2 3.04Å; H161-E165 PolarHBondContact ND1-OE2 2.96Å; H161-E165 PolarHBondContact O-N 3.07Å; W162-E165 PolarHBondContact O-N 3.39Å; Y163-E165 VanDerWaalsContact C-N 3.29Å; Y163-E165 PolarHBondContact O-N 3.32Å; E165-K167 VanDerWaalsContact C-N 3.3Å; E165-K167 PolarHBondContact O-N 3.34Å
166S83.4Confident89.8Confident38 Ų3861.3 Ų61.327%0.26629%0.291SS..Hα-helixtrans-67.1-30-175.271.80000113.1W162 Y163 N168W162-S166 WeakPolarHBondContact O-CB 3.41Å; W162-S166 PolarHBondContact O-N 3.16Å; W162-S166 PolarHBondContact O-OG 3.34Å; Y163-S166 PolarHBondContact O-OG 3.3Å; S166-N168 PolarHBondContact O-N 3.11Å; S166-N168 PolarHBondContact OG-OD1 3.37Å; S166-N168 VanDerWaalsContact OG-OD1 3.08Å
167K77.6Confident89.8Confident187 Ų18766.1 Ų66.181%0.81331%0.31SS*.  trans51.316.8178.5-62.7-176.9-178.21790115.2Y163 E165Y163-K167 PolarHBondContact O-N 3.24Å; E165-K167 VanDerWaalsContact C-N 3.3Å; E165-K167 PolarHBondContact O-N 3.34Å
168N81.1Confident89.8Confident87 Ų8770.2 Ų70.247%0.46533%0.331SS..SBendtrans-99.74.1-172.9659000113.3S166 S170S166-N168 PolarHBondContact O-N 3.11Å; S166-N168 PolarHBondContact OG-OD1 3.37Å; S166-N168 VanDerWaalsContact OG-OD1 3.08Å; N168-S170 PolarHBondContact ND2-OG 3.28Å; N168-S170 PolarHBondContact O-N 3.38Å; N168-S170 VanDerWaalsContact O-N 3.14Å; N168-S170 PolarHBondContact OD1-N 3.1Å; N168-S170 VanDerWaalsContact OD1-N 3.09Å; N168-S170 PolarHBondContact OD1-OG 3.33Å
169N86.3Confident89.6Confident68 Ų6869.3 Ų69.336%0.36435%0.35SS..SBendtrans5035.6-177.6-163.843.1000113.2Y163 L185Y163-N169 PolarHBondContact OH-OD1 2.99Å; N169-L185 WeakPolarHBondContact O-CB 3.27Å; N169-L185 WeakPolarHBondContact O-CG 3.14Å; N169-L185 PolarHBondContact O-N 3.25Å; N169-L185 WeakPolarHBondContact OD1-CD1 3.35Å
170S90.3Very high89.5Confident13 Ų1366.3 Ų66.39%0.09136%0.357CS..BIsolated β-bridgetrans-126.3154.7179.470.30000111.9W162 Y163 N168 G183W162-S170 WeakPolarHBondContact CZ3-O 3.26Å; Y163-S170 WeakPolarHBondContact CD2-O 3.37Å; N168-S170 PolarHBondContact ND2-OG 3.28Å; N168-S170 PolarHBondContact O-N 3.38Å; N168-S170 VanDerWaalsContact O-N 3.14Å; N168-S170 PolarHBondContact OD1-N 3.1Å; N168-S170 VanDerWaalsContact OD1-N 3.09Å; N168-S170 PolarHBondContact OD1-OG 3.33Å; S170-G183 CarbonylContact C-O 3.03Å; S170-G183 WeakPolarHBondContact CA-O 3.4Å; S170-G183 VanDerWaalsContact CB-O 3.31Å; S170-G183 WeakPolarHBondContact CB-O 3.2Å
171V93.3Very high89.6Confident2 Ų266.6 Ų66.61%0.01236%0.359CS..  trans-96.9166.8169.2-58.40000109.9W157 C175 G183 L185 L191W157-V171 HydrophobicContact CB-CG1 3.76Å; W157-V171 HydrophobicContact CG-CB 4.1Å; W157-V171 HydrophobicContact CG-CG1 3.75Å; V171-C175 HydrophobicContact CB-CB 4.48Å; V171-C175 HydrophobicContact CG2-CB 3.65Å; V171-G183 WeakPolarHBondContact CG2-O 3.35Å; V171-G183 PolarHBondContact N-O 3.05Å; V171-L185 HydrophobicContact CG1-CD2 3.8Å; V171-L185 HydrophobicContact CG1-CG 4.36Å; V171-L191 HydrophobicContact CG2-CD1 3.81Å; V171-L191 HydrophobicContact CG2-CD2 3.77Å; V171-L191 HydrophobicContact CG2-CG 4.42Å
172P93.9Very high89.6Confident5 Ų566.5 Ų66.53%0.03237%0.366CS..  trans-54.3145.9174.6-32.242.1000113.6Y127 W157 W162 S174 C175Y127-P172 HydrophobicContact CE1-CG 3.7Å; Y127-P172 HydrophobicContact CE2-CG 4.43Å; Y127-P172 WeakPolarHBondContact OH-CB 3.5Å; Y127-P172 VanDerWaalsContact OH-CG 3.32Å; Y127-P172 WeakPolarHBondContact OH-CG 3.13Å; W157-P172 HydrophobicContact CD2-CG 4.25Å; W157-P172 VanDerWaalsContact CE2-CD 3.4Å; W157-P172 HydrophobicContact CE3-CG 4.22Å; W157-P172 HydrophobicContact CH2-CG 3.48Å; W157-P172 VanDerWaalsContact CH2-CG 3.48Å; W157-P172 HydrophobicContact CZ2-CB 4.39Å; W157-P172 HydrophobicContact CZ2-CG 3.44Å; W157-P172 VanDerWaalsContact CZ2-CG 3.44Å; W157-P172 HydrophobicContact CZ3-CG 3.87Å; W162-P172 HydrophobicContact CH2-CG 4.17Å; W162-P172 HydrophobicContact CZ3-CG 4.14Å; P172-S174 VanDerWaalsContact CB-OG 3.25Å; P172-S174 WeakPolarHBondContact CB-OG 3.49Å; P172-S174 PolarHBondContact O-N 3.41Å; P172-S174 VanDerWaalsContact O-N 3.13Å; P172-C175 VanDerWaalsContact O-CB 3.27Å; P172-C175 WeakPolarHBondContact O-CB 3.43Å; P172-C175 PolarHBondContact O-N 2.76Å
173I93.5Very high89.6Confident116 Ų11664.5 Ų64.560%0.59536%0.359SS*.G310 helixtrans-63.1-22.9-179.2-59169.6000111.3C175 C176I173-C175 PolarHBondContact O-N 3.42Å; I173-C176 WeakPolarHBondContact O-CB 3.27Å; I173-C176 PolarHBondContact O-N 2.85Å
174S94.4Very high89.6Confident2 Ų264.2 Ų64.21%0.01436%0.362CS..G310 helixtrans-58.9-22.1170.640.20000114D140 Q143 P172 C176D140-S174 VanDerWaalsContact CG-OG 3.32Å; D140-S174 WeakPolarHBondContact OD1-CB 3.39Å; D140-S174 PolarHBondContact OD1-OG 3Å; Q143-S174 PolarHBondContact OE1-OG 3.07Å; P172-S174 VanDerWaalsContact CB-OG 3.25Å; P172-S174 WeakPolarHBondContact CB-OG 3.49Å; P172-S174 PolarHBondContact O-N 3.41Å; P172-S174 VanDerWaalsContact O-N 3.13Å; S174-C176 VanDerWaalsContact C-N 3.32Å
175C95.1Very high89.6Confident0 Ų058.9 Ų58.90%034%0.339CS..G310 helixtrans-79.1-7.5172.5-75.70000114.8Q143 C149 W157 V171 P172 I173 L191 Y192Q143-C175 VanDerWaalsContact CD-SG 3.51Å; Q143-C175 PolarHBondContact NE2-SG 3.43Å; Q143-C175 VanDerWaalsContact NE2-SG 3.45Å; Q143-C175 PolarHBondContact OE1-SG 3.05Å; C149-C175 VanDerWaalsContact CA-SG 3.57Å; C149-C175 HydrophobicContact CB-CB 3.63Å; C149-C175 WeakPolarHBondContact CB-SG 3.26Å; C149-C175 WeakPolarHBondContact SG-CB 3.32Å; C149-C175 CovalentContact SG-SG 2.03Å; C149-C175 PolarHBondContact SG-SG 3.48Å; W157-C175 PolarHBondContact NE1-SG 2.87Å; W157-C175 VanDerWaalsContact NE1-SG 3.43Å; V171-C175 HydrophobicContact CB-CB 4.48Å; V171-C175 HydrophobicContact CG2-CB 3.65Å; P172-C175 VanDerWaalsContact O-CB 3.27Å; P172-C175 WeakPolarHBondContact O-CB 3.43Å; P172-C175 PolarHBondContact O-N 2.76Å; I173-C175 PolarHBondContact O-N 3.42Å; C175-L191 HydrophobicContact CB-CD2 4.41Å; C175-L191 WeakPolarHBondContact O-CA 3.41Å; C175-Y192 WeakPolarHBondContact O-CD2 3.26Å; C175-Y192 PolarHBondContact O-N 3.15Å
176C95.4Very high89.7Confident19 Ų1957 Ų5713%0.12834%0.336CS..BIsolated β-bridgetrans-75.7131.2-175.7-74.20000112.2I173 S174 C181 Y192I173-C176 WeakPolarHBondContact O-CB 3.27Å; I173-C176 PolarHBondContact O-N 2.85Å; S174-C176 VanDerWaalsContact C-N 3.32Å; C176-C181 HydrophobicContact CB-CB 3.46Å; C176-C181 VanDerWaalsContact CB-CB 3.46Å; C176-C181 WeakPolarHBondContact CB-SG 3.5Å; C176-C181 VanDerWaalsContact SG-C 3.52Å; C176-C181 WeakPolarHBondContact SG-CB 3.42Å; C176-C181 PolarHBondContact SG-O 2.95Å; C176-C181 VanDerWaalsContact SG-O 3.41Å; C176-C181 CovalentContact SG-SG 2.04Å; C176-C181 PolarHBondContact SG-SG 3.38Å; C176-Y192 WeakPolarHBondContact O-CE2 3.29Å
177K94.5Very high89.9Confident137 Ų13759.6 Ų59.660%0.59634%0.344SS*.SBendtrans-84.8-29.6176.4-176.9179.3177.8-176.60113.2D190 Y192K177-D190 VanDerWaalsContact CB-O 3.31Å; K177-D190 WeakPolarHBondContact CB-O 3.39Å; K177-D190 PolarHBondContact N-O 2.91Å; K177-Y192 HydrophobicContact CB-CD1 4.08Å; K177-Y192 HydrophobicContact CB-CE1 3.79Å; K177-Y192 HydrophobicContact CG-CD1 4.28Å; K177-Y192 HydrophobicContact CG-CE1 3.81Å
178I91.7Very high90.4Very high86 Ų8652.7 Ų52.744%0.44132%0.319SS..SBendtrans-117.9157-175.365.3164.8000112.3C181 D190I178-C181 HydrophobicContact CG1-CB 3.97Å; I178-C181 WeakPolarHBondContact O-CB 3.12Å; I178-D190 HydrophobicContact CD1-CB 4.16Å; I178-D190 VanDerWaalsContact CD1-CG 3.49Å; I178-D190 VanDerWaalsContact CD1-OD1 3.24Å; I178-D190 WeakPolarHBondContact CD1-OD1 3.49Å; I178-D190 HydrophobicContact CG1-CB 4.08Å
179A86.8Confident90.9Very high105 Ų10554.2 Ų54.287%0.86832%0.323SS*.THydrogen-bonded Turntrans-68.9137.5172.300000110.8C181A179-C181 VanDerWaalsContact C-N 3.34Å
180G86.7Confident91.3Very high79 Ų7953 Ų5381%0.81432%0.317SS*.THydrogen-bonded Turntrans86-0.8-178.500000115
181C90.5Very high91.5Very high16 Ų1652.6 Ų52.611%0.10831%0.313CS..  trans-65.7135.5170.7160.40000111.1C176 I178 A179 G183 D190C176-C181 HydrophobicContact CB-CB 3.46Å; C176-C181 VanDerWaalsContact CB-CB 3.46Å; C176-C181 WeakPolarHBondContact CB-SG 3.5Å; C176-C181 VanDerWaalsContact SG-C 3.52Å; C176-C181 WeakPolarHBondContact SG-CB 3.42Å; C176-C181 PolarHBondContact SG-O 2.95Å; C176-C181 VanDerWaalsContact SG-O 3.41Å; C176-C181 CovalentContact SG-SG 2.04Å; C176-C181 PolarHBondContact SG-SG 3.38Å; I178-C181 HydrophobicContact CG1-CB 3.97Å; I178-C181 WeakPolarHBondContact O-CB 3.12Å; A179-C181 VanDerWaalsContact C-N 3.34Å; C181-G183 PolarHBondContact SG-N 2.96Å; C181-G183 VanDerWaalsContact SG-N 3.43Å; C181-D190 HydrophobicContact CB-CB 4.33Å
182T89.5Confident91.6Very high104 Ų10454 Ų5464%0.63832%0.319SS*.  trans-1002.9-178.355.90000113S184T182-S184 VanDerWaalsContact C-N 3.25Å; T182-S184 PolarHBondContact O-N 3.47Å
183G90.6Very high91.6Very high0 Ų058.3 Ų58.30%034%0.338CS..  trans77.26.5-173.500000114S170 V171 C181 L185S170-G183 CarbonylContact C-O 3.03Å; S170-G183 WeakPolarHBondContact CA-O 3.4Å; S170-G183 VanDerWaalsContact CB-O 3.31Å; S170-G183 WeakPolarHBondContact CB-O 3.2Å; V171-G183 WeakPolarHBondContact CG2-O 3.35Å; V171-G183 PolarHBondContact N-O 3.05Å; C181-G183 PolarHBondContact SG-N 2.96Å; C181-G183 VanDerWaalsContact SG-N 3.43Å; G183-L185 PolarHBondContact O-N 3.4Å
184S91.2Very high91.6Very high28 Ų2858.6 Ų58.620%0.19634%0.337CS..BIsolated β-bridgetrans-62.4132.1-176-175.10000112.6T182 T186 H187T182-S184 VanDerWaalsContact C-N 3.25Å; T182-S184 PolarHBondContact O-N 3.47Å; S184-T186 PolarHBondContact O-N 3.43Å; S184-T186 PolarHBondContact OG-N 3.15Å; S184-T186 PolarHBondContact OG-OG1 3.39Å; S184-H187 PolarHBondContact O-N 2.92Å
185L89.1Confident91.6Very high17 Ų1758.8 Ų58.89%0.08934%0.339CS..THydrogen-bonded Turntrans-71.9-4.5173.7-68.4174.1000113.7F154 R158 Y163 N169 V171 G183 H187 L191F154-L185 HydrophobicContact CD2-CD2 3.39Å; F154-L185 HydrophobicContact CE2-CD2 3.7Å; F154-L185 HydrophobicContact CG-CD2 4.49Å; R158-L185 HydrophobicContact CG-CD1 4.45Å; Y163-L185 HydrophobicContact CE2-CD1 3.63Å; Y163-L185 WeakPolarHBondContact OH-CD1 3.42Å; N169-L185 WeakPolarHBondContact O-CB 3.27Å; N169-L185 WeakPolarHBondContact O-CG 3.14Å; N169-L185 PolarHBondContact O-N 3.25Å; N169-L185 WeakPolarHBondContact OD1-CD1 3.35Å; V171-L185 HydrophobicContact CG1-CD2 3.8Å; V171-L185 HydrophobicContact CG1-CG 4.36Å; G183-L185 PolarHBondContact O-N 3.4Å; L185-H187 VanDerWaalsContact C-N 3.32Å; L185-L191 HydrophobicContact CD2-CD1 4.16Å
186T88.1Confident91.6Very high87 Ų8758.9 Ų58.953%0.53434%0.34SS..THydrogen-bonded Turntrans-75.7-21.9173.960.70000113.1S184 P188S184-T186 PolarHBondContact O-N 3.43Å; S184-T186 PolarHBondContact OG-N 3.15Å; S184-T186 PolarHBondContact OG-OG1 3.39Å; T186-P188 VanDerWaalsContact C-CD 3.43Å; T186-P188 WeakPolarHBondContact O-CD 3.44Å
187H88.4Confident91.4Very high93 Ų9359.3 Ų59.343%0.43134%0.34SS..  trans-123.166.9178.9-65.9-64.6000110.1S184 L185 E189 D190S184-H187 PolarHBondContact O-N 2.92Å; L185-H187 VanDerWaalsContact C-N 3.32Å; H187-E189 VanDerWaalsContact C-OE2 3.28Å; H187-E189 WeakPolarHBondContact CA-OE2 3.26Å; H187-E189 IonicContact CG-OE1 3.71Å; H187-E189 IonicContact ND1-OE1 3.04Å; H187-E189 PolarHBondContact ND1-OE1 2.81Å; H187-E189 PolarHBondContact O-N 3.21Å; H187-E189 VanDerWaalsContact O-N 3.17Å; H187-D190 PolarHBondContact O-N 2.99Å; H187-D190 VanDerWaalsContact O-N 3.13Å
188P89Confident91.2Very high43 Ų4356 Ų5628%0.27934%0.338SS..G310 helixtrans-61.8-22-178.128-36.3000113.1F154 T186 D190 L191 Q193F154-P188 HydrophobicContact CE1-CB 4.17Å; F154-P188 HydrophobicContact CZ-CB 3.96Å; T186-P188 VanDerWaalsContact C-CD 3.43Å; T186-P188 WeakPolarHBondContact O-CD 3.44Å; P188-D190 PolarHBondContact O-N 3.29Å; P188-L191 PolarHBondContact O-N 2.88Å; P188-L191 VanDerWaalsContact O-N 3.13Å; P188-Q193 PolarHBondContact O-NE2 3Å
189E91.4Very high91.3Very high118 Ų11854 Ų5455%0.55133%0.328SS*.G310 helixtrans-60-25.2174.862.2-83.8-166.900113.9H187 L191H187-E189 VanDerWaalsContact C-OE2 3.28Å; H187-E189 WeakPolarHBondContact CA-OE2 3.26Å; H187-E189 IonicContact CG-OE1 3.71Å; H187-E189 IonicContact ND1-OE1 3.04Å; H187-E189 PolarHBondContact ND1-OE1 2.81Å; H187-E189 PolarHBondContact O-N 3.21Å; H187-E189 VanDerWaalsContact O-N 3.17Å; E189-L191 VanDerWaalsContact C-N 3.34Å
190D93.6Very high91.5Very high44 Ų4450.4 Ų50.424%0.23530%0.295CS..G310 helixtrans-86.6-7179.7-66.8-19.4000112.8K177 I178 C181 H187 P188K177-D190 VanDerWaalsContact CB-O 3.31Å; K177-D190 WeakPolarHBondContact CB-O 3.39Å; K177-D190 PolarHBondContact N-O 2.91Å; I178-D190 HydrophobicContact CD1-CB 4.16Å; I178-D190 VanDerWaalsContact CD1-CG 3.49Å; I178-D190 VanDerWaalsContact CD1-OD1 3.24Å; I178-D190 WeakPolarHBondContact CD1-OD1 3.49Å; I178-D190 HydrophobicContact CG1-CB 4.08Å; C181-D190 HydrophobicContact CB-CB 4.33Å; H187-D190 PolarHBondContact O-N 2.99Å; H187-D190 VanDerWaalsContact O-N 3.13Å; P188-D190 PolarHBondContact O-N 3.29Å
191L95.3Very high91.6Very high4 Ų447.9 Ų47.92%0.02126%0.264CS..BIsolated β-bridgetrans-102.2153-177.6-55.4179.1000111.5F154 V171 C175 L185 P188 E189 Q193F154-L191 HydrophobicContact CB-CD1 4.36Å; F154-L191 HydrophobicContact CD2-CD1 4.41Å; F154-L191 HydrophobicContact CG-CD1 4.28Å; V171-L191 HydrophobicContact CG2-CD1 3.81Å; V171-L191 HydrophobicContact CG2-CD2 3.77Å; V171-L191 HydrophobicContact CG2-CG 4.42Å; C175-L191 HydrophobicContact CB-CD2 4.41Å; C175-L191 WeakPolarHBondContact O-CA 3.41Å; L185-L191 HydrophobicContact CD2-CD1 4.16Å; P188-L191 PolarHBondContact O-N 2.88Å; P188-L191 VanDerWaalsContact O-N 3.13Å; E189-L191 VanDerWaalsContact C-N 3.34Å; L191-Q193 PolarHBondContact O-N 2.83Å
192Y95.3Very high91.6Very high31 Ų3153 Ų5312%0.12229%0.285CS..  trans-64.9129.7166.7-61.6-59.6000110.5Q147 C149 C175 C176 K177Q147-Y192 HydrophobicContact CB-CD1 3.94Å; Q147-Y192 HydrophobicContact CB-CE1 3.49Å; Q147-Y192 VanDerWaalsContact CB-CE1 3.49Å; Q147-Y192 HydrophobicContact CB-CE2 4.33Å; Q147-Y192 HydrophobicContact CG-CE1 4.1Å; Q147-Y192 WeakPolarHBondContact O-CD1 3.32Å; Q147-Y192 VanDerWaalsContact O-CG 3.27Å; C149-Y192 VanDerWaalsContact CB-O 3.26Å; C149-Y192 WeakPolarHBondContact CB-O 3.49Å; C175-Y192 WeakPolarHBondContact O-CD2 3.26Å; C175-Y192 PolarHBondContact O-N 3.15Å; C176-Y192 WeakPolarHBondContact O-CE2 3.29Å; K177-Y192 HydrophobicContact CB-CD1 4.08Å; K177-Y192 HydrophobicContact CB-CE1 3.79Å; K177-Y192 HydrophobicContact CG-CD1 4.28Å; K177-Y192 HydrophobicContact CG-CE1 3.81Å
193Q93.1Very high91.7Very high95 Ų9552.6 Ų52.644%0.44427%0.274SS..  trans-92.1-23.5-177.4-65.4-70.3-35.400112.5N153 P188 L191N153-Q193 PolarHBondContact OD1-O 3.32Å; P188-Q193 PolarHBondContact O-NE2 3Å; L191-Q193 PolarHBondContact O-N 2.83Å
194E94.7Very high91.5Very high123 Ų12355.8 Ų55.858%0.57529%0.291SS*.SBendtrans-80.3134.7-179.3-62.6-67.1161.800110.4C148 C149 L199C148-E194 CarbonylContact C-O 3.26Å; C148-E194 VanDerWaalsContact CA-O 3.27Å; C148-E194 WeakPolarHBondContact CA-O 3.41Å; C148-E194 VanDerWaalsContact CB-O 3.3Å; C148-E194 WeakPolarHBondContact CB-O 3.2Å; C149-E194 PolarHBondContact N-O 3.49Å; E194-L199 HydrophobicContact CB-CD1 3.88Å
195G93.8Very high91.3Very high5 Ų559 Ų595%0.05230%0.303CS..  trans-71.8144.317300000112.9I151 H152 E197 L199I151-G195 CarbonylContact O-C 3.36Å; I151-G195 VanDerWaalsContact O-C 3.26Å; I151-G195 VanDerWaalsContact O-CA 3.26Å; I151-G195 WeakPolarHBondContact O-CA 3.02Å; H152-G195 WeakPolarHBondContact O-CA 3.41Å; H152-G195 PolarHBondContact O-N 2.9Å; H152-G195 VanDerWaalsContact O-N 3.1Å; G195-E197 VanDerWaalsContact C-N 3.35Å; G195-E197 PolarHBondContact O-N 2.91Å; G195-L199 WeakPolarHBondContact O-CD1 3.37Å
196C94.5Very high91.3Very high2 Ų261.7 Ų61.71%0.01432%0.315CS..Hα-helixtrans-70.5-27.7-178.1-66.10000113.8V142 C148 G150 I151 L199 V200V142-C196 HydrophobicContact CG1-CB 4.33Å; C148-C196 VanDerWaalsContact C-SG 3.56Å; C148-C196 HydrophobicContact CB-CB 3.94Å; C148-C196 WeakPolarHBondContact CB-SG 3.49Å; C148-C196 WeakPolarHBondContact SG-CA 3.34Å; C148-C196 WeakPolarHBondContact SG-CB 3.26Å; C148-C196 CovalentContact SG-SG 2.04Å; C148-C196 PolarHBondContact SG-SG 3.31Å; G150-C196 VanDerWaalsContact O-CB 3.29Å; G150-C196 WeakPolarHBondContact O-CB 3.47Å; G150-C196 PolarHBondContact O-N 3.45Å; G150-C196 PolarHBondContact O-SG 2.99Å; I151-C196 PolarHBondContact O-N 2.92Å; I151-C196 VanDerWaalsContact O-N 3.08Å; C196-L199 PolarHBondContact O-N 3.02Å; C196-V200 WeakPolarHBondContact O-CB 3.37Å; C196-V200 WeakPolarHBondContact O-CG2 3.48Å; C196-V200 PolarHBondContact O-N 3.27Å
197E91.4Very high91.4Very high29 Ų2962.3 Ų62.314%0.13631%0.313CS..Hα-helixtrans-58.5-53.8-178.5-176.9-172.114300111.6N117 I120 I151 H152 G195 L199 V200 V201N117-E197 PolarHBondContact ND2-OE1 3.36Å; N117-E197 VanDerWaalsContact OD1-CG 3.28Å; N117-E197 WeakPolarHBondContact OD1-CG 3.33Å; N117-E197 PolarHBondContact OD1-OE1 3.48Å; I120-E197 HydrophobicContact CD1-CG 4.5Å; I151-E197 HydrophobicContact CG2-CB 4.17Å; I151-E197 WeakPolarHBondContact CG2-OE2 2.91Å; I151-E197 WeakPolarHBondContact O-CB 3.48Å; I151-E197 PolarHBondContact O-N 2.7Å; H152-E197 IonicContact CE1-OE2 2.91Å; H152-E197 PolarHBondContact CE1-OE2 3.42Å; H152-E197 IonicContact ND1-OE2 3.38Å; H152-E197 PolarHBondContact ND1-OE2 2.97Å; H152-E197 IonicContact NE2-OE2 3.87Å; G195-E197 VanDerWaalsContact C-N 3.35Å; G195-E197 PolarHBondContact O-N 2.91Å; E197-L199 VanDerWaalsContact C-N 3.28Å; E197-L199 PolarHBondContact O-N 2.87Å; E197-V200 PolarHBondContact O-N 3.4Å; E197-V201 WeakPolarHBondContact O-CG2 3.34Å; E197-V201 PolarHBondContact O-N 3.04Å
198A90.8Very high91.3Very high67 Ų6761.7 Ų61.755%0.55431%0.312SS*.Hα-helixtrans-60.9-38.1-178.100000112K202A198-K202 VanDerWaalsContact O-CB 3.26Å; A198-K202 WeakPolarHBondContact O-CB 3.32Å; A198-K202 PolarHBondContact O-N 3.48Å
199L93Very high91.1Very high44 Ų4465.5 Ų65.523%0.2333%0.328CS..Hα-helixtrans-73.8-37.9178.5-84.876.5000112.2L146 C148 E194 G195 C196 E197 K202 K203L146-L199 HydrophobicContact CB-CB 4.42Å; L146-L199 HydrophobicContact CB-CD2 4.3Å; L146-L199 HydrophobicContact CD1-CB 4.27Å; L146-L199 WeakPolarHBondContact O-CD2 3.49Å; C148-L199 HydrophobicContact CB-CD2 4.35Å; E194-L199 HydrophobicContact CB-CD1 3.88Å; G195-L199 WeakPolarHBondContact O-CD1 3.37Å; C196-L199 PolarHBondContact O-N 3.02Å; E197-L199 VanDerWaalsContact C-N 3.28Å; E197-L199 PolarHBondContact O-N 2.87Å; L199-K202 PolarHBondContact O-N 2.92Å; L199-K203 WeakPolarHBondContact O-CB 3.44Å; L199-K203 VanDerWaalsContact O-CG 3.26Å; L199-K203 WeakPolarHBondContact O-CG 3.4Å; L199-K203 PolarHBondContact O-N 3.24Å
200V91.4Very high91.1Very high29 Ų2968 Ų6818%0.17633%0.333CS..Hα-helixtrans-62.9-49.1173.7169.30000109.8V116 I120 V142 L146 C196 E197 K202 K203 L204V116-V200 HydrophobicContact CG1-CG1 4.16Å; I120-V200 HydrophobicContact CD1-CB 4.25Å; I120-V200 HydrophobicContact CD1-CG1 4.17Å; I120-V200 HydrophobicContact CD1-CG2 4.45Å; V142-V200 HydrophobicContact CG1-CG2 3.99Å; L146-V200 HydrophobicContact CD1-CB 4.41Å; L146-V200 HydrophobicContact CD1-CG2 3.51Å; C196-V200 WeakPolarHBondContact O-CB 3.37Å; C196-V200 WeakPolarHBondContact O-CG2 3.48Å; C196-V200 PolarHBondContact O-N 3.27Å; E197-V200 PolarHBondContact O-N 3.4Å; V200-K202 VanDerWaalsContact C-N 3.34Å; V200-K202 PolarHBondContact O-N 3.36Å; V200-K203 PolarHBondContact O-N 3.14Å; V200-K203 VanDerWaalsContact O-N 3.15Å; V200-L204 HydrophobicContact CG1-CD1 3.94Å; V200-L204 HydrophobicContact CG1-CG 4.29Å; V200-L204 WeakPolarHBondContact O-CB 3.26Å; V200-L204 VanDerWaalsContact O-CG 3.32Å; V200-L204 WeakPolarHBondContact O-CG 3.22Å; V200-L204 PolarHBondContact O-N 3.32Å
201V89.4Confident90.9Very high27 Ų2769.9 Ų69.916%0.16435%0.346CS..Hα-helixtrans-59.4-45.8177.3172.60000110.8E197 K203 L204 Q205E197-V201 WeakPolarHBondContact O-CG2 3.34Å; E197-V201 PolarHBondContact O-N 3.04Å; V201-K203 VanDerWaalsContact C-N 3.33Å; V201-K203 PolarHBondContact O-N 2.95Å; V201-L204 PolarHBondContact O-N 3.5Å; V201-Q205 WeakPolarHBondContact O-CG 3.48Å; V201-Q205 PolarHBondContact O-N 3.26Å
202K90.4Very high90.6Very high124 Ų12474 Ų7454%0.53937%0.367SS..Hα-helixtrans-58.7-44.1175.3-177.4-179.4177.4-178.10112A198 L199 V200 Q205 E206A198-K202 VanDerWaalsContact O-CB 3.26Å; A198-K202 WeakPolarHBondContact O-CB 3.32Å; A198-K202 PolarHBondContact O-N 3.48Å; L199-K202 PolarHBondContact O-N 2.92Å; V200-K202 VanDerWaalsContact C-N 3.34Å; V200-K202 PolarHBondContact O-N 3.36Å; K202-Q205 PolarHBondContact O-N 3.32Å; K202-E206 WeakPolarHBondContact O-CG 3.35Å; K202-E206 PolarHBondContact O-N 2.89Å
203K90.3Very high90.4Very high94 Ų9480.3 Ų80.341%0.40939%0.391SS..Hα-helixtrans-65.9-40.1177.6-77.6-75.1166.6-153.40112.3L146 L199 V200 V201 Q205 E206 I207L146-K203 HydrophobicContact CD2-CD 4.3Å; L146-K203 HydrophobicContact CD2-CG 3.78Å; L199-K203 WeakPolarHBondContact O-CB 3.44Å; L199-K203 VanDerWaalsContact O-CG 3.26Å; L199-K203 WeakPolarHBondContact O-CG 3.4Å; L199-K203 PolarHBondContact O-N 3.24Å; V200-K203 PolarHBondContact O-N 3.14Å; V200-K203 VanDerWaalsContact O-N 3.15Å; V201-K203 VanDerWaalsContact C-N 3.33Å; V201-K203 PolarHBondContact O-N 2.95Å; K203-Q205 VanDerWaalsContact C-N 3.32Å; K203-Q205 PolarHBondContact O-N 3.47Å; K203-E206 IonicContact NZ-OE2 2.76Å; K203-E206 PolarHBondContact NZ-OE2 3.2Å; K203-E206 PolarHBondContact O-N 3.28Å; K203-I207 VanDerWaalsContact O-CG1 3.26Å; K203-I207 WeakPolarHBondContact O-CG1 3.47Å; K203-I207 PolarHBondContact O-N 2.93Å
204L87.5Confident90.4Very high68 Ų6880 Ų8036%0.35640%0.396SS..Hα-helixtrans-61.6-41.8174-72.1173.5000111.2V116 V200 V201 I207 M208V116-L204 HydrophobicContact CG1-CD1 4.05Å; V116-L204 HydrophobicContact CG2-CD1 3.91Å; V200-L204 HydrophobicContact CG1-CD1 3.94Å; V200-L204 HydrophobicContact CG1-CG 4.29Å; V200-L204 WeakPolarHBondContact O-CB 3.26Å; V200-L204 VanDerWaalsContact O-CG 3.32Å; V200-L204 WeakPolarHBondContact O-CG 3.22Å; V200-L204 PolarHBondContact O-N 3.32Å; V201-L204 PolarHBondContact O-N 3.5Å; L204-I207 PolarHBondContact O-N 2.87Å; L204-M208 WeakPolarHBondContact O-CB 3.32Å; L204-M208 WeakPolarHBondContact O-CG 3.41Å; L204-M208 PolarHBondContact O-N 3.15Å
205Q86.8Confident90.2Very high96 Ų9675 Ų7545%0.44938%0.376SS..Hα-helixtrans-63.4-42.3175.4-71.7177.2-10.100112.6E113 V201 K202 K203 M208 M209E113-Q205 PolarHBondContact OE1-NE2 3.02Å; V201-Q205 WeakPolarHBondContact O-CG 3.48Å; V201-Q205 PolarHBondContact O-N 3.26Å; K202-Q205 PolarHBondContact O-N 3.32Å; K203-Q205 VanDerWaalsContact C-N 3.32Å; K203-Q205 PolarHBondContact O-N 3.47Å; Q205-M208 HydrophobicContact CG-CE 4.05Å; Q205-M208 PolarHBondContact O-N 2.93Å; Q205-M209 PolarHBondContact O-N 2.68Å; Q205-M209 VanDerWaalsContact O-N 3.15Å
206E89.4Confident90.2Very high73 Ų7379.7 Ų79.734%0.34140%0.399SS..Hα-helixtrans-59.2-47.9172.6-73.3173.8-175.100110.9K202 K203 M208 M209 Y210K202-E206 WeakPolarHBondContact O-CG 3.35Å; K202-E206 PolarHBondContact O-N 2.89Å; K203-E206 IonicContact NZ-OE2 2.76Å; K203-E206 PolarHBondContact NZ-OE2 3.2Å; K203-E206 PolarHBondContact O-N 3.28Å; E206-M208 PolarHBondContact O-N 3.48Å; E206-M209 WeakPolarHBondContact O-CB 3.31Å; E206-M209 PolarHBondContact O-N 3.21Å; E206-Y210 WeakPolarHBondContact O-CD2 3.26Å; E206-Y210 PolarHBondContact O-N 3.3Å
207I89.3Confident90.1Very high99 Ų9983.4 Ų83.451%0.50842%0.421SS..Hα-helixtrans-62-43.5178.2-68.2165.6000111.2K203 L204 M209 Y210 V211K203-I207 VanDerWaalsContact O-CG1 3.26Å; K203-I207 WeakPolarHBondContact O-CG1 3.47Å; K203-I207 PolarHBondContact O-N 2.93Å; L204-I207 PolarHBondContact O-N 2.87Å; I207-M209 VanDerWaalsContact C-N 3.25Å; I207-M209 PolarHBondContact O-N 3.35Å; I207-Y210 WeakPolarHBondContact O-CB 3.44Å; I207-Y210 PolarHBondContact O-N 2.75Å; I207-Y210 VanDerWaalsContact O-N 3.07Å; I207-V211 HydrophobicContact CG2-CG2 4.28Å; I207-V211 WeakPolarHBondContact O-CG2 3.44Å; I207-V211 PolarHBondContact O-N 2.98Å
208M86.3Confident90.2Very high81 Ų8185.1 Ų85.140%0.39943%0.428SS..Hα-helixtrans-58.3-38.1177.5-78.1-162.1-66.900112L204 Q205 E206 V211 I212L204-M208 WeakPolarHBondContact O-CB 3.32Å; L204-M208 WeakPolarHBondContact O-CG 3.41Å; L204-M208 PolarHBondContact O-N 3.15Å; Q205-M208 HydrophobicContact CG-CE 4.05Å; Q205-M208 PolarHBondContact O-N 2.93Å; E206-M208 PolarHBondContact O-N 3.48Å; M208-V211 PolarHBondContact O-N 3.12Å; M208-I212 WeakPolarHBondContact O-CG1 3.3Å; M208-I212 PolarHBondContact O-N 3.43Å
209M86.4Confident90.4Very high123 Ų12382.7 Ų82.761%0.60641%0.409SS*.Hα-helixtrans-60.6-46.2174.8-176.3-178.9-119.700111.3Q205 E206 I207 V211 I212 W213Q205-M209 PolarHBondContact O-N 2.68Å; Q205-M209 VanDerWaalsContact O-N 3.15Å; E206-M209 WeakPolarHBondContact O-CB 3.31Å; E206-M209 PolarHBondContact O-N 3.21Å; I207-M209 VanDerWaalsContact C-N 3.25Å; I207-M209 PolarHBondContact O-N 3.35Å; M209-V211 VanDerWaalsContact C-N 3.35Å; M209-V211 PolarHBondContact O-N 3.1Å; M209-I212 PolarHBondContact O-N 2.93Å; M209-W213 PolarHBondContact O-N 3.35Å; M209-W213 VanDerWaalsContact O-N 3.14Å
210Y90.2Very high90.4Very high170 Ų17083.5 Ų83.567%0.66742%0.422SS*.Hα-helixtrans-61.5-42.7175.9-71.6-73.1000112E206 I207 I212 W213 T214E206-Y210 WeakPolarHBondContact O-CD2 3.26Å; E206-Y210 PolarHBondContact O-N 3.3Å; I207-Y210 WeakPolarHBondContact O-CB 3.44Å; I207-Y210 PolarHBondContact O-N 2.75Å; I207-Y210 VanDerWaalsContact O-N 3.07Å; Y210-I212 VanDerWaalsContact C-N 3.32Å; Y210-I212 PolarHBondContact O-N 2.68Å; Y210-W213 PolarHBondContact O-N 2.96Å; Y210-T214 WeakPolarHBondContact O-CG2 3.47Å; Y210-T214 PolarHBondContact O-N 2.95Å; Y210-T214 PolarHBondContact O-OG1 3.1Å
211V89.1Confident90.5Very high83 Ų8384.7 Ų84.750%0.50343%0.426SS..Hα-helixtrans-57.7-45.1176.8173.50000110.9I207 M208 M209 W213 T214 A215I207-V211 HydrophobicContact CG2-CG2 4.28Å; I207-V211 WeakPolarHBondContact O-CG2 3.44Å; I207-V211 PolarHBondContact O-N 2.98Å; M208-V211 PolarHBondContact O-N 3.12Å; M209-V211 VanDerWaalsContact C-N 3.35Å; M209-V211 PolarHBondContact O-N 3.1Å; V211-W213 PolarHBondContact O-N 2.98Å; V211-T214 WeakPolarHBondContact CA-OG1 3.38Å; V211-T214 PolarHBondContact O-N 3.44Å; V211-T214 PolarHBondContact O-OG1 3.2Å; V211-A215 WeakPolarHBondContact O-CB 3.27Å; V211-A215 PolarHBondContact O-N 3.08Å
212I89.2Confident90.6Very high92 Ų9283.8 Ų83.847%0.47242%0.42SS..Hα-helixtrans-60-46177.2-68.2165.2000111.3M208 M209 Y210 T214 A215 L216M208-I212 WeakPolarHBondContact O-CG1 3.3Å; M208-I212 PolarHBondContact O-N 3.43Å; M209-I212 PolarHBondContact O-N 2.93Å; Y210-I212 VanDerWaalsContact C-N 3.32Å; Y210-I212 PolarHBondContact O-N 2.68Å; I212-T214 VanDerWaalsContact C-N 3.33Å; I212-T214 PolarHBondContact O-N 3.04Å; I212-A215 PolarHBondContact O-N 3.15Å; I212-L216 HydrophobicContact CG2-CD1 4.11Å; I212-L216 HydrophobicContact CG2-CG 4.44Å; I212-L216 WeakPolarHBondContact O-CG 3.45Å; I212-L216 PolarHBondContact O-N 3.01Å
213W92.6Very high90.7Very high162 Ų16282.6 Ų82.661%0.61442%0.418SS*.Hα-helixtrans-62.5-39.3177.5-79.9110.1000112.7M209 Y210 V211 T217M209-W213 PolarHBondContact O-N 3.35Å; M209-W213 VanDerWaalsContact O-N 3.14Å; Y210-W213 PolarHBondContact O-N 2.96Å; V211-W213 PolarHBondContact O-N 2.98Å; W213-T217 PolarHBondContact O-N 2.93Å; W213-T217 PolarHBondContact O-OG1 2.76Å
214T91.4Very high90.8Very high90 Ų9082 Ų8255%0.55242%0.419SS*.Hα-helixtrans-66.5-41176.257.60000112.2Y210 V211 I212 T217 F218Y210-T214 WeakPolarHBondContact O-CG2 3.47Å; Y210-T214 PolarHBondContact O-N 2.95Å; Y210-T214 PolarHBondContact O-OG1 3.1Å; V211-T214 WeakPolarHBondContact CA-OG1 3.38Å; V211-T214 PolarHBondContact O-N 3.44Å; V211-T214 PolarHBondContact O-OG1 3.2Å; I212-T214 VanDerWaalsContact C-N 3.33Å; I212-T214 PolarHBondContact O-N 3.04Å; T214-T217 PolarHBondContact O-N 3.35Å; T214-F218 WeakPolarHBondContact O-CB 3.48Å; T214-F218 PolarHBondContact O-N 3.49Å
215A91.5Very high91Very high18 Ų1879 Ų7915%0.14941%0.405CS..Hα-helixtrans-61.8-50.3174.600000110.9E98 V102 V211 I212 T217 F218 A219E98-A215 VanDerWaalsContact OE1-C 3.23Å; E98-A215 VanDerWaalsContact OE1-CA 3.28Å; E98-A215 WeakPolarHBondContact OE1-CA 3.48Å; E98-A215 WeakPolarHBondContact OE1-CB 3.42Å; V102-A215 HydrophobicContact CG2-CB 4.39Å; V211-A215 WeakPolarHBondContact O-CB 3.27Å; V211-A215 PolarHBondContact O-N 3.08Å; I212-A215 PolarHBondContact O-N 3.15Å; A215-T217 PolarHBondContact O-N 3.46Å; A215-T217 VanDerWaalsContact O-N 3.16Å; A215-F218 WeakPolarHBondContact O-CA 3.06Å; A215-F218 WeakPolarHBondContact O-CB 3.09Å; A215-F218 PolarHBondContact O-N 3.45Å; A215-A219 WeakPolarHBondContact O-CB 2.95Å; A215-A219 PolarHBondContact O-N 3.02Å
216L93.1Very high91.2Very high103 Ų10375.4 Ų75.454%0.53939%0.388SS..Hα-helixtrans-55.8-39.3176.8-71.3174.6000113I212 A220I212-L216 HydrophobicContact CG2-CD1 4.11Å; I212-L216 HydrophobicContact CG2-CG 4.44Å; I212-L216 WeakPolarHBondContact O-CG 3.45Å; I212-L216 PolarHBondContact O-N 3.01Å; L216-A220 WeakPolarHBondContact O-CB 3.48Å; L216-A220 PolarHBondContact O-N 3.19Å
217T93.7Very high91.3Very high79 Ų7977.3 Ų77.349%0.48540%0.4SS..Hα-helixtrans-66.7-44.4175.9-55.70000111.3W213 T214 A215 A220 I221W213-T217 PolarHBondContact O-N 2.93Å; W213-T217 PolarHBondContact O-OG1 2.76Å; T214-T217 PolarHBondContact O-N 3.35Å; A215-T217 PolarHBondContact O-N 3.46Å; A215-T217 VanDerWaalsContact O-N 3.16Å; T217-A220 PolarHBondContact O-N 3.43Å; T217-I221 HydrophobicContact CG2-CD1 4.09Å; T217-I221 VanDerWaalsContact O-CG1 3.31Å; T217-I221 WeakPolarHBondContact O-CG1 3.35Å; T217-I221 PolarHBondContact O-N 3.45Å
218F92.5Very high91.3Very high65 Ų6573.1 Ų73.129%0.28538%0.379SS..Hα-helixtrans-62.5-48.9177.8-176.1-100.9000111.7F21 V94 E98 T214 A215 A220 I221 Q222F21-F218 HydrophobicContact CD1-CE2 4.32Å; F21-F218 AromaticContact CE1-CD2 3.87Å; F21-F218 HydrophobicContact CE1-CD2 3.87Å; F21-F218 AromaticContact CE1-CE2 3.63Å; F21-F218 HydrophobicContact CE1-CE2 3.63Å; F21-F218 HydrophobicContact CZ-CD2 4.28Å; F21-F218 HydrophobicContact CZ-CE2 4.11Å; V94-F218 HydrophobicContact CG1-CE1 4.01Å; V94-F218 HydrophobicContact CG1-CZ 4.33Å; E98-F218 WeakPolarHBondContact OE2-CD1 3.47Å; T214-F218 WeakPolarHBondContact O-CB 3.48Å; T214-F218 PolarHBondContact O-N 3.49Å; A215-F218 WeakPolarHBondContact O-CA 3.06Å; A215-F218 WeakPolarHBondContact O-CB 3.09Å; A215-F218 PolarHBondContact O-N 3.45Å; F218-A220 VanDerWaalsContact C-N 3.32Å; F218-A220 PolarHBondContact O-N 3.48Å; F218-I221 PolarHBondContact O-N 3.5Å; F218-I221 VanDerWaalsContact O-N 3.15Å; F218-Q222 WeakPolarHBondContact O-CB 3.03Å; F218-Q222 PolarHBondContact O-N 3.07Å
219A94.4Very high91.4Very high17 Ų1769.3 Ų69.314%0.1436%0.36CS..Hα-helixtrans-54.5-43.9173.300000112.5F95 A215 Q222 M223F95-A219 HydrophobicContact CD2-CB 4.42Å; F95-A219 HydrophobicContact CE2-CB 4.08Å; A215-A219 WeakPolarHBondContact O-CB 2.95Å; A215-A219 PolarHBondContact O-N 3.02Å; A219-Q222 PolarHBondContact O-N 3.5Å; A219-M223 WeakPolarHBondContact O-CB 3.18Å; A219-M223 VanDerWaalsContact O-CG 3.29Å; A219-M223 WeakPolarHBondContact O-CG 3.16Å; A219-M223 PolarHBondContact O-N 2.88Å
220A94.4Very high91.5Very high61 Ų6166 Ų6650%0.50435%0.349SS..Hα-helixtrans-63.8-42.7177.600000112.3L216 T217 F218 Q222 M223 L224L216-A220 WeakPolarHBondContact O-CB 3.48Å; L216-A220 PolarHBondContact O-N 3.19Å; T217-A220 PolarHBondContact O-N 3.43Å; F218-A220 VanDerWaalsContact C-N 3.32Å; F218-A220 PolarHBondContact O-N 3.48Å; A220-Q222 VanDerWaalsContact C-N 3.33Å; A220-M223 PolarHBondContact O-N 3.36Å; A220-L224 PolarHBondContact O-N 2.92Å
221I92.4Very high91.3Very high54 Ų5460.1 Ų60.128%0.27733%0.331SS..Hα-helixtrans-65.6-39.5176.7-63.6164.1000110.7L17 F21 T217 F218 L224 G225L17-I221 HydrophobicContact CD1-CG2 4.41Å; L17-I221 HydrophobicContact CD2-CG2 4.05Å; F21-I221 HydrophobicContact CE2-CG2 3.51Å; F21-I221 HydrophobicContact CZ-CB 4.14Å; F21-I221 HydrophobicContact CZ-CD1 4.44Å; F21-I221 HydrophobicContact CZ-CG2 3.42Å; F21-I221 VanDerWaalsContact CZ-CG2 3.42Å; T217-I221 HydrophobicContact CG2-CD1 4.09Å; T217-I221 VanDerWaalsContact O-CG1 3.31Å; T217-I221 WeakPolarHBondContact O-CG1 3.35Å; T217-I221 PolarHBondContact O-N 3.45Å; F218-I221 PolarHBondContact O-N 3.5Å; F218-I221 VanDerWaalsContact O-N 3.15Å; I221-L224 WeakPolarHBondContact O-CB 3.27Å; I221-L224 PolarHBondContact O-N 3.33Å; I221-G225 PolarHBondContact O-N 2.04Å
222Q92.4Very high91.1Very high7 Ų756.8 Ų56.83%0.03331%0.311CS..Hα-helixtrans-64.1-43.8177.2-174.1167.325.600112.2L91 V94 E98 F218 A219 A220 L224 G225 M226L91-Q222 HydrophobicContact CB-CG 4.24Å; L91-Q222 HydrophobicContact CD2-CG 4.31Å; L91-Q222 PolarHBondContact O-NE2 2.84Å; V94-Q222 VanDerWaalsContact CB-NE2 3.26Å; V94-Q222 VanDerWaalsContact CG1-NE2 3.3Å; E98-Q222 PolarHBondContact OE2-OE1 3.01Å; F218-Q222 WeakPolarHBondContact O-CB 3.03Å; F218-Q222 PolarHBondContact O-N 3.07Å; A219-Q222 PolarHBondContact O-N 3.5Å; A220-Q222 VanDerWaalsContact C-N 3.33Å; Q222-L224 VanDerWaalsContact C-N 3.33Å; Q222-L224 PolarHBondContact O-N 3.42Å; Q222-G225 PolarHBondContact O-N 3.43Å; Q222-M226 HydrophobicContact CG-CE 4.37Å; Q222-M226 WeakPolarHBondContact O-CG 3.21Å; Q222-M226 PolarHBondContact O-N 3.31Å
223M92.8Very high90.8Very high100 Ų10053.4 Ų53.449%0.49329%0.293SS..Hα-helixtrans-60.3-41.8173.4-73.6-64.1-62.900111.8F95 A219 A220 M226 L227F95-M223 HydrophobicContact CE2-CG 4.43Å; F95-M223 HydrophobicContact CE2-SD 4.42Å; A219-M223 WeakPolarHBondContact O-CB 3.18Å; A219-M223 VanDerWaalsContact O-CG 3.29Å; A219-M223 WeakPolarHBondContact O-CG 3.16Å; A219-M223 PolarHBondContact O-N 2.88Å; A220-M223 PolarHBondContact O-N 3.36Å; M223-M226 HydrophobicContact CG-CE 4.22Å; M223-M226 PolarHBondContact O-N 3.47Å; M223-M226 HydrophobicContact SD-CE 3.27Å; M223-M226 WeakPolarHBondContact SD-CE 3.45Å; M223-L227 WeakPolarHBondContact O-CB 3.25Å; M223-L227 PolarHBondContact O-N 3Å
224L91.9Very high90.4Very high81 Ų8149.9 Ų49.942%0.42429%0.292SS..Hα-helixtrans-62.1-44.9174-18063.9000111.4L17 A220 I221 Q222 M226 L227 C228L17-L224 HydrophobicContact CD1-CD2 4.27Å; A220-L224 PolarHBondContact O-N 2.92Å; I221-L224 WeakPolarHBondContact O-CB 3.27Å; I221-L224 PolarHBondContact O-N 3.33Å; Q222-L224 VanDerWaalsContact C-N 3.33Å; Q222-L224 PolarHBondContact O-N 3.42Å; L224-M226 PolarHBondContact O-N 2.97Å; L224-L227 PolarHBondContact O-N 2.88Å; L224-C228 WeakPolarHBondContact O-CB 3.4Å; L224-C228 PolarHBondContact O-N 3.19Å; L224-C228 PolarHBondContact O-SG 3.15Å; L224-C228 VanDerWaalsContact O-SG 3.36Å
225G90.3Very high89.8Confident6 Ų650.6 Ų50.66%0.06229%0.285CS..Hα-helixtrans-59.3-45.7176.500000112.6I221 Q222 C228 A229I221-G225 PolarHBondContact O-N 2.04Å; Q222-G225 PolarHBondContact O-N 3.43Å; G225-C228 PolarHBondContact O-N 3.4Å; G225-A229 VanDerWaalsContact O-CB 3.31Å; G225-A229 WeakPolarHBondContact O-CB 3.39Å; G225-A229 PolarHBondContact O-N 3.07Å
226M91.8Very high88.9Confident20 Ų2053.5 Ų53.510%0.09929%0.292CS..Hα-helixtrans-62.3-45.3175-71.7-171-66.600111.7L91 L92 Q222 M223 L224 A229 C230L91-M226 HydrophobicContact CB-CG 3.7Å; L91-M226 HydrophobicContact CB-SD 4.09Å; L91-M226 HydrophobicContact CD1-CG 3.85Å; L91-M226 HydrophobicContact CG-CG 4.47Å; L92-M226 HydrophobicContact CB-SD 4.39Å; Q222-M226 HydrophobicContact CG-CE 4.37Å; Q222-M226 WeakPolarHBondContact O-CG 3.21Å; Q222-M226 PolarHBondContact O-N 3.31Å; M223-M226 HydrophobicContact CG-CE 4.22Å; M223-M226 PolarHBondContact O-N 3.47Å; M223-M226 HydrophobicContact SD-CE 3.27Å; M223-M226 WeakPolarHBondContact SD-CE 3.45Å; L224-M226 PolarHBondContact O-N 2.97Å; M226-A229 PolarHBondContact O-N 2.66Å; M226-C230 WeakPolarHBondContact O-CB 3.31Å; M226-C230 PolarHBondContact O-N 3.47Å; M226-C230 PolarHBondContact O-SG 2.87Å
227L91.3Very high87.9Confident112 Ų11251.2 Ų51.259%0.58628%0.284SS*.Hα-helixtrans-60.8-47.7178-175.5118000111.4M223 L224 A229 C230 V231M223-L227 WeakPolarHBondContact O-CB 3.25Å; M223-L227 PolarHBondContact O-N 3Å; L224-L227 PolarHBondContact O-N 2.88Å; L227-A229 PolarHBondContact O-N 3.3Å; L227-C230 PolarHBondContact O-N 3.32Å; L227-V231 VanDerWaalsContact O-CG2 3.3Å; L227-V231 WeakPolarHBondContact O-CG2 3.14Å; L227-V231 PolarHBondContact O-N 2.9Å
228C89.4Confident86.7Confident12 Ų1258 Ų588%0.08130%0.301CS..Hα-helixtrans-60.7-45176.8-71.90000111.9L14 L224 G225 V231 V232L14-C228 HydrophobicContact CD1-CB 4.37Å; L224-C228 WeakPolarHBondContact O-CB 3.4Å; L224-C228 PolarHBondContact O-N 3.19Å; L224-C228 PolarHBondContact O-SG 3.15Å; L224-C228 VanDerWaalsContact O-SG 3.36Å; G225-C228 PolarHBondContact O-N 3.4Å; C228-V231 PolarHBondContact O-N 3.19Å; C228-V232 WeakPolarHBondContact O-CG2 3.4Å; C228-V232 PolarHBondContact O-N 3.23Å
229A88.3Confident85.6Confident0 Ų059.5 Ų59.50%031%0.312CS..Hα-helixtrans-63-44.4177.500000112L14 L84 V88 G225 M226 L227 V231 V232 L233L14-A229 HydrophobicContact CD2-CB 4.26Å; L84-A229 HydrophobicContact CD1-CB 3.76Å; L84-A229 HydrophobicContact CG-CB 4.31Å; V88-A229 HydrophobicContact CG2-CB 3.45Å; V88-A229 VanDerWaalsContact CG2-CB 3.45Å; G225-A229 VanDerWaalsContact O-CB 3.31Å; G225-A229 WeakPolarHBondContact O-CB 3.39Å; G225-A229 PolarHBondContact O-N 3.07Å; M226-A229 PolarHBondContact O-N 2.66Å; L227-A229 PolarHBondContact O-N 3.3Å; A229-V231 PolarHBondContact O-N 3.17Å; A229-V232 PolarHBondContact O-N 3.16Å; A229-L233 WeakPolarHBondContact O-CG 3.4Å; A229-L233 PolarHBondContact O-N 2.71Å
230C87.9Confident83.8Confident54 Ų5463.2 Ų63.237%0.36534%0.335SS..Hα-helixtrans-62.2-41.2175.4-73.20000112.2M226 L227 V232 L233 C234M226-C230 WeakPolarHBondContact O-CB 3.31Å; M226-C230 PolarHBondContact O-N 3.47Å; M226-C230 PolarHBondContact O-SG 2.87Å; L227-C230 PolarHBondContact O-N 3.32Å; C230-V232 VanDerWaalsContact C-N 3.32Å; C230-V232 PolarHBondContact O-N 2.89Å; C230-L233 PolarHBondContact O-N 2.84Å; C230-C234 VanDerWaalsContact O-CB 3.29Å; C230-C234 WeakPolarHBondContact O-CB 3.31Å; C230-C234 PolarHBondContact O-N 3.25Å; C230-C234 PolarHBondContact O-SG 3.19Å
231V86.6Confident82.2Confident46 Ų4663.5 Ų63.528%0.27934%0.337SS..Hα-helixtrans-61.5-41.8175.3168.60000111.1L227 C228 A229 R235L227-V231 VanDerWaalsContact O-CG2 3.3Å; L227-V231 WeakPolarHBondContact O-CG2 3.14Å; L227-V231 PolarHBondContact O-N 2.9Å; C228-V231 PolarHBondContact O-N 3.19Å; A229-V231 PolarHBondContact O-N 3.17Å; V231-R235 WeakPolarHBondContact O-CB 3.01Å; V231-R235 WeakPolarHBondContact O-CG 3Å; V231-R235 PolarHBondContact O-N 3.44Å
232V84.4Confident80.5Confident14 Ų1463 Ų639%0.08533%0.332CS..Hα-helixtrans-65.5-44176.4173.30000111.1K11 L84 C228 A229 C230 R236K11-V232 HydrophobicContact CG-CG2 4.08Å; L84-V232 HydrophobicContact CD2-CB 3.96Å; L84-V232 HydrophobicContact CD2-CG1 3.6Å; C228-V232 WeakPolarHBondContact O-CG2 3.4Å; C228-V232 PolarHBondContact O-N 3.23Å; A229-V232 PolarHBondContact O-N 3.16Å; C230-V232 VanDerWaalsContact C-N 3.32Å; C230-V232 PolarHBondContact O-N 2.89Å; V232-R236 WeakPolarHBondContact O-CB 3.47Å; V232-R236 PolarHBondContact O-N 2.89Å; V232-R236 VanDerWaalsContact O-N 3.15Å
233L84Confident78.8Confident21 Ų2169 Ų6911%0.1136%0.36CS..Hα-helixtrans-62.2-52.7176.1-74.5171.1000112.1L84 V88 A229 C230 R235 R236 S237L84-L233 HydrophobicContact CB-CD2 3.93Å; L84-L233 HydrophobicContact CB-CG 4.37Å; L84-L233 HydrophobicContact CD2-CD1 4.48Å; L84-L233 HydrophobicContact CD2-CD2 3.74Å; L84-L233 HydrophobicContact CD2-CG 3.61Å; L84-L233 HydrophobicContact CG-CD1 4.17Å; L84-L233 HydrophobicContact CG-CD2 3.91Å; L84-L233 HydrophobicContact CG-CG 3.81Å; V88-L233 HydrophobicContact CG2-CD1 4.21Å; A229-L233 WeakPolarHBondContact O-CG 3.4Å; A229-L233 PolarHBondContact O-N 2.71Å; C230-L233 PolarHBondContact O-N 2.84Å; L233-R235 PolarHBondContact O-N 2.03Å; L233-R236 PolarHBondContact O-N 3.08Å; L233-R236 VanDerWaalsContact O-N 3.16Å; L233-S237 PolarHBondContact O-N 2.93Å
234C83.3Confident77.1Confident87 Ų8770.5 Ų70.559%0.58837%0.369SS*.Hα-helixtrans-62.4-41.4-177.8-72.10000112.4C230 R236 R238C230-C234 VanDerWaalsContact O-CB 3.29Å; C230-C234 WeakPolarHBondContact O-CB 3.31Å; C230-C234 PolarHBondContact O-N 3.25Å; C230-C234 PolarHBondContact O-SG 3.19Å; C234-R236 VanDerWaalsContact C-N 3.3Å; C234-R236 PolarHBondContact O-N 2.69Å; C234-R238 PolarHBondContact O-N 3.13Å
235R78.6Confident75.5Confident106 Ų10673.1 Ų73.140%0.438%0.383SS..Hα-helixtrans-67-34.6177.1-75.7-173.1-178164.46.6112G3 I7 V231 L233 R238G3-R235 PolarHBondContact O-NH1 2.91Å; I7-R235 HydrophobicContact CD1-CB 4.18Å; I7-R235 HydrophobicContact CG1-CB 4.46Å; I7-R235 VanDerWaalsContact CG1-CD 3.49Å; V231-R235 WeakPolarHBondContact O-CB 3.01Å; V231-R235 WeakPolarHBondContact O-CG 3Å; V231-R235 PolarHBondContact O-N 3.44Å; L233-R235 PolarHBondContact O-N 2.03Å; R235-R238 PolarHBondContact O-N 3.24Å
236R73.5Confident73.9Confident78 Ų7877.4 Ų77.429%0.29440%0.404SS..Hα-helixtrans-74.9-38.1178-169.4177.8-169.81773.1113.3E79 V232 L233 C234 R238 D239E79-R236 PolarHBondContact O-NH1 2.98Å; E79-R236 PolarHBondContact O-NH2 3.4Å; V232-R236 WeakPolarHBondContact O-CB 3.47Å; V232-R236 PolarHBondContact O-N 2.89Å; V232-R236 VanDerWaalsContact O-N 3.15Å; L233-R236 PolarHBondContact O-N 3.08Å; L233-R236 VanDerWaalsContact O-N 3.16Å; C234-R236 VanDerWaalsContact C-N 3.3Å; C234-R236 PolarHBondContact O-N 2.69Å; R236-R238 PolarHBondContact O-N 2.82Å; R236-R238 VanDerWaalsContact O-N 3.14Å; R236-D239 VanDerWaalsContact O-CB 3.25Å; R236-D239 WeakPolarHBondContact O-CB 3.21Å; R236-D239 PolarHBondContact O-N 3.09Å
237S71.2Confident72.1Confident55 Ų5579.5 Ų79.539%0.38542%0.42SS..Hα-helixtrans-58.3-25.3172.5-178.70000112.1L233 D239L233-S237 PolarHBondContact O-N 2.93Å; S237-D239 VanDerWaalsContact C-N 3.34Å
238R70.3Confident70.3Confident223 Ų22376.2 Ų76.284%0.84241%0.414SS*.THydrogen-bonded Turntrans-85.8-2.9178.3-130.9173.3177.5156.6-1.2113.9C234 R235 R236C234-R238 PolarHBondContact O-N 3.13Å; R235-R238 PolarHBondContact O-N 3.24Å; R236-R238 PolarHBondContact O-N 2.82Å; R236-R238 VanDerWaalsContact O-N 3.14Å
239D67.9Low68.5Low95 Ų9578.3 Ų78.351%0.50844%0.438SS..SBendtrans-83.3119.2179.2-146.6-19.8000109.1R236 S237 A241 Y242R236-D239 VanDerWaalsContact O-CB 3.25Å; R236-D239 WeakPolarHBondContact O-CB 3.21Å; R236-D239 PolarHBondContact O-N 3.09Å; S237-D239 VanDerWaalsContact C-N 3.34Å; D239-A241 PolarHBondContact O-N 3.42Å; D239-Y242 WeakPolarHBondContact O-CB 3.43Å; D239-Y242 PolarHBondContact O-N 3.07Å
240P57.4Low66.7Low95 Ų9583.8 Ų83.862%0.61747%0.471SS*.Hα-helixtrans-60.6-18.8-168.718.6-31.8000115.4Y242P240-Y242 VanDerWaalsContact C-N 3.29Å; P240-Y242 PolarHBondContact O-N 3.44Å
241A60.3Low64.8Low67 Ų6787.9 Ų87.955%0.55449%0.488SS*.Hα-helixtrans-70.3-22.4173.100000113.5D239D239-A241 PolarHBondContact O-N 3.42Å
242Y57.7Low62.7Low45 Ų4592.8 Ų92.818%0.17653%0.533CS..Hα-helixtrans-82.4-39.3-180-179.9-101.8000112.7H81 D239 P240 L244 L245 I246H81-Y242 HydrophobicContact CB-CE2 4.35Å; H81-Y242 AromaticContact CD2-CZ 3.73Å; H81-Y242 PolarHBondContact CD2-OH 3.2Å; H81-Y242 VanDerWaalsContact CD2-OH 3.26Å; H81-Y242 PolarHBondContact CE1-OH 2.82Å; H81-Y242 VanDerWaalsContact CE1-OH 3.27Å; H81-Y242 PolarHBondContact ND1-OH 3Å; H81-Y242 AromaticContact NE2-CZ 3.96Å; H81-Y242 PolarHBondContact NE2-OH 2.75Å; D239-Y242 WeakPolarHBondContact O-CB 3.43Å; D239-Y242 PolarHBondContact O-N 3.07Å; P240-Y242 VanDerWaalsContact C-N 3.29Å; P240-Y242 PolarHBondContact O-N 3.44Å; Y242-L244 PolarHBondContact O-N 3.34Å; Y242-L245 PolarHBondContact O-N 3.14Å; Y242-L245 VanDerWaalsContact O-N 3.09Å; Y242-I246 HydrophobicContact CD1-CD1 4.14Å; Y242-I246 HydrophobicContact CE1-CD1 3.34Å; Y242-I246 HydrophobicContact CE1-CG1 4.13Å; Y242-I246 HydrophobicContact CE2-CD1 4.43Å; Y242-I246 PolarHBondContact O-N 3.43Å; Y242-I246 VanDerWaalsContact O-N 3.17Å; Y242-I246 WeakPolarHBondContact OH-CD1 3.43Å
243E56.5Low61.6Low131 Ų13196.7 Ų96.761%0.61256%0.555SS**Hα-helixtrans-53.1-40.1171-84.1-88.2154.600111.8L245 S247E243-L245 PolarHBondContact O-N 3.47Å; E243-S247 WeakPolarHBondContact O-CB 3.24Å; E243-S247 PolarHBondContact O-N 2.04Å
244L56.2Low60.4Low132 Ų132100.7 Ų100.769%0.69158%0.579SS**Hα-helixtrans-67.6-32177.6-84.1155.7000113.9Y242 G248Y242-L244 PolarHBondContact O-N 3.34Å; L244-G248 PolarHBondContact O-N 3.41Å
245L58.2Low59.1Low136 Ų136101.4 Ų101.471%0.71258%0.578SS**Hα-helixtrans-79-35179.1-77.8167.7000112.8Y242 E243 G249Y242-L245 PolarHBondContact O-N 3.14Å; Y242-L245 VanDerWaalsContact O-N 3.09Å; E243-L245 PolarHBondContact O-N 3.47Å; L245-G249 PolarHBondContact O-N 3.17Å
246I58Low58Low96 Ų96101.2 Ų101.249%0.49259%0.589SS.*Hα-helixtrans-69.5-49.6171.7-68.5-175.4000109.9Y242 G248 G249 T250Y242-I246 HydrophobicContact CD1-CD1 4.14Å; Y242-I246 HydrophobicContact CE1-CD1 3.34Å; Y242-I246 HydrophobicContact CE1-CG1 4.13Å; Y242-I246 HydrophobicContact CE2-CD1 4.43Å; Y242-I246 PolarHBondContact O-N 3.43Å; Y242-I246 VanDerWaalsContact O-N 3.17Å; Y242-I246 WeakPolarHBondContact OH-CD1 3.43Å; I246-G248 VanDerWaalsContact C-N 3.32Å; I246-G248 PolarHBondContact O-N 3.04Å; I246-G249 PolarHBondContact O-N 3.26Å; I246-G249 VanDerWaalsContact O-N 3.12Å; I246-T250 PolarHBondContact O-N 2.73Å; I246-T250 PolarHBondContact O-OG1 3.13Å
247S53.6Low57Low64 Ų64102.6 Ų102.645%0.44861%0.607SS.*Hα-helixtrans-59.9-41.5-179.6-1740000112E243 G249 T250 I251E243-S247 WeakPolarHBondContact O-CB 3.24Å; E243-S247 PolarHBondContact O-N 2.04Å; S247-G249 PolarHBondContact O-N 3.13Å; S247-T250 PolarHBondContact O-N 3.24Å; S247-T250 PolarHBondContact O-OG1 3.04Å; S247-I251 WeakPolarHBondContact O-CG1 3.46Å
248G52.8Low56.1Low44 Ų44105.8 Ų105.845%0.45462%0.622SS.*Hα-helixtrans-68.9-25.7175.900000115.2L244 I246L244-G248 PolarHBondContact O-N 3.41Å; I246-G248 VanDerWaalsContact C-N 3.32Å; I246-G248 PolarHBondContact O-N 3.04Å
249G52.1Low55Low56 Ų5697.4 Ų97.458%0.57761%0.606SS**Hα-helixtrans-79.9-19.7175.800000114.3L245 I246 S247L245-G249 PolarHBondContact O-N 3.17Å; I246-G249 PolarHBondContact O-N 3.26Å; I246-G249 VanDerWaalsContact O-N 3.12Å; S247-G249 PolarHBondContact O-N 3.13Å
250T49.5Very low54.1Low114 Ų11497.6 Ų97.670%0.69961%0.614SS**SBendtrans-85.9-8.8174.96.90000114.2I246 S247I246-T250 PolarHBondContact O-N 2.73Å; I246-T250 PolarHBondContact O-OG1 3.13Å; S247-T250 PolarHBondContact O-N 3.24Å; S247-T250 PolarHBondContact O-OG1 3.04Å
251I49.6Very low53.8Low141 Ų14197.8 Ų97.872%0.72361%0.613SS**  trans-109.31-176.6-57.9171.6000111.7S247S247-I251 WeakPolarHBondContact O-CG1 3.46Å
252A40.9Very low53.2Low148 Ų148100.6 Ų100.6100%1.22362%0.619SS**  trans-106.10175.900000112.1

Retrieved 252 of 252 residues in 121.4 ms (Link to these results)

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