A0A3B3UZE5_9TELE Loading...

Calcium release-activated calcium channel protein 1

AlphaFold DB , UniProt , Accession A0A3B3UZE5, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 223 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
1M51.8Low67.9Low224 Ų224108.7 Ų108.7100%1.10358%0.583SS**  0-19.80-142.2154.1160.700113.3
2S57.8Low68.5Low75 Ų75103.7 Ų103.752%0.52456%0.563SS.*Hα-helixtrans-72.4-25.4-177.167.70000116.9N4 E5 H6S2-N4 PolarHBondContact O-N 3.06Å; S2-E5 PolarHBondContact O-N 3.34Å; S2-H6 PolarHBondContact O-N 3.15Å
3L60.3Low69Low153 Ų153105.9 Ų105.980%0.80156%0.558SS**Hα-helixtrans-62.7-30.4177.2-86166.5000113S7L3-S7 PolarHBondContact O-N 3.22Å; L3-S7 PolarHBondContact O-OG 3.44Å
4N67Low69.9Low109 Ų109112.6 Ų112.658%0.58357%0.572SS**Hα-helixtrans-76.1-31.6179.2-150.338.6000111.5S2 S7 L8S2-N4 PolarHBondContact O-N 3.06Å; N4-S7 WeakPolarHBondContact CA-OG 3.28Å; N4-S7 PolarHBondContact O-OG 2.79Å; N4-L8 WeakPolarHBondContact O-CB 3.44Å; N4-L8 WeakPolarHBondContact O-CG 3.4Å; N4-L8 PolarHBondContact O-N 3.37Å
5E66.6Low70.5Confident125 Ų125115.2 Ų115.258%0.58458%0.578SS**Hα-helixtrans-72.7-43.8177.8-65.1-170.7138.600112S2 S7 L8 Q9S2-E5 PolarHBondContact O-N 3.34Å; E5-S7 VanDerWaalsContact C-N 3.33Å; E5-S7 PolarHBondContact O-N 3.15Å; E5-L8 PolarHBondContact O-N 3.41Å; E5-Q9 VanDerWaalsContact O-CB 3.29Å; E5-Q9 WeakPolarHBondContact O-CB 3.35Å; E5-Q9 PolarHBondContact O-N 3.44Å
6H67.3Low70.9Confident132 Ų132109.6 Ų109.661%0.61155%0.55SS**Hα-helixtrans-62.1-38.5175.1-83.6-72.2000112.8S2 A10S2-H6 PolarHBondContact O-N 3.15Å; H6-A10 WeakPolarHBondContact O-CB 3.44Å; H6-A10 PolarHBondContact O-N 3.31Å
7S75.2Confident71.5Confident53 Ų53112.4 Ų112.437%0.37155%0.554SS.*Hα-helixtrans-71-39.7176.952.40000112.4L3 N4 E5 A10 L11L3-S7 PolarHBondContact O-N 3.22Å; L3-S7 PolarHBondContact O-OG 3.44Å; N4-S7 WeakPolarHBondContact CA-OG 3.28Å; N4-S7 PolarHBondContact O-OG 2.79Å; E5-S7 VanDerWaalsContact C-N 3.33Å; E5-S7 PolarHBondContact O-N 3.15Å; S7-A10 PolarHBondContact O-N 2.72Å; S7-L11 VanDerWaalsContact O-CG 3.32Å; S7-L11 WeakPolarHBondContact O-CG 3.45Å; S7-L11 PolarHBondContact O-N 3.31Å
8L74.3Confident72.2Confident91 Ų91111.8 Ų111.848%0.47655%0.553SS.*Hα-helixtrans-64.5-39.8174.1-72.8175.3000112.4N4 E5 L11 S12N4-L8 WeakPolarHBondContact O-CB 3.44Å; N4-L8 WeakPolarHBondContact O-CG 3.4Å; N4-L8 PolarHBondContact O-N 3.37Å; E5-L8 PolarHBondContact O-N 3.41Å; L8-L11 PolarHBondContact O-N 2.69Å; L8-S12 PolarHBondContact O-N 2.96Å; L8-S12 PolarHBondContact O-OG 3.07Å
9Q72.8Confident72.6Confident79 Ų79107.2 Ų107.237%0.36953%0.533SS..Hα-helixtrans-65.6-40.5175172.3158.225.400112.4E5 L11 S12 W13 L94E5-Q9 VanDerWaalsContact O-CB 3.29Å; E5-Q9 WeakPolarHBondContact O-CB 3.35Å; E5-Q9 PolarHBondContact O-N 3.44Å; Q9-L11 VanDerWaalsContact C-N 3.34Å; Q9-L11 PolarHBondContact O-N 3.01Å; Q9-S12 PolarHBondContact O-OG 3.11Å; Q9-W13 PolarHBondContact O-N 3.27Å; Q9-W13 VanDerWaalsContact O-N 3.15Å; Q9-L94 HydrophobicContact CB-CD1 3.72Å; Q9-L94 VanDerWaalsContact CD-CD1 3.44Å; Q9-L94 HydrophobicContact CG-CD1 3.32Å
10A75.8Confident73.1Confident60 Ų60105.5 Ų105.550%0.49652%0.52SS..Hα-helixtrans-64.3-38.5174.100000112.2H6 S7 R14H6-A10 WeakPolarHBondContact O-CB 3.44Å; H6-A10 PolarHBondContact O-N 3.31Å; S7-A10 PolarHBondContact O-N 2.72Å; A10-R14 PolarHBondContact O-N 2.95Å; A10-R14 VanDerWaalsContact O-N 3.09Å
11L77.7Confident73.6Confident95 Ų95103 Ų10350%0.49752%0.516SS..Hα-helixtrans-68.4-41.9177.4-74.2169.4000112.7S7 L8 Q9 R14 K15S7-L11 VanDerWaalsContact O-CG 3.32Å; S7-L11 WeakPolarHBondContact O-CG 3.45Å; S7-L11 PolarHBondContact O-N 3.31Å; L8-L11 PolarHBondContact O-N 2.69Å; Q9-L11 VanDerWaalsContact C-N 3.34Å; Q9-L11 PolarHBondContact O-N 3.01Å; L11-R14 PolarHBondContact O-N 3.11Å; L11-K15 WeakPolarHBondContact O-CG 3.41Å; L11-K15 PolarHBondContact O-N 3.35Å
12S75.1Confident75.3Confident48 Ų4895.9 Ų95.934%0.33648%0.479SS..Hα-helixtrans-64.1-41.2177.563.70000111.5L8 Q9 R14 K15 L16L8-S12 PolarHBondContact O-N 2.96Å; L8-S12 PolarHBondContact O-OG 3.07Å; Q9-S12 PolarHBondContact O-OG 3.11Å; S12-R14 PolarHBondContact O-N 3.29Å; S12-K15 PolarHBondContact O-N 3.33Å; S12-L16 WeakPolarHBondContact O-CB 3.47Å; S12-L16 PolarHBondContact O-N 3.46Å
13W75.4Confident76.5Confident133 Ų13392.8 Ų92.850%0.50446%0.457SS..Hα-helixtrans-62-43.8174.7-165.9-99.9000112.4Q9 L16 Y17Q9-W13 PolarHBondContact O-N 3.27Å; Q9-W13 VanDerWaalsContact O-N 3.15Å; W13-L16 PolarHBondContact O-N 3.34Å; W13-Y17 PolarHBondContact O-N 2.94Å
14R81.5Confident77.7Confident200 Ų20090.8 Ų90.876%0.75544%0.441SS*.Hα-helixtrans-61.4-44.9175.5-115179.4178.6168.3-0.1112.2A10 L11 S12 L16 Y17 L18A10-R14 PolarHBondContact O-N 2.95Å; A10-R14 VanDerWaalsContact O-N 3.09Å; L11-R14 PolarHBondContact O-N 3.11Å; S12-R14 PolarHBondContact O-N 3.29Å; R14-L16 VanDerWaalsContact C-N 3.35Å; R14-Y17 PolarHBondContact O-N 3.01Å; R14-L18 VanDerWaalsContact O-CB 3.25Å; R14-L18 WeakPolarHBondContact O-CB 3.42Å; R14-L18 PolarHBondContact O-N 3.2Å
15K79.1Confident78.7Confident151 Ų15188.2 Ų88.266%0.65744%0.435SS*.Hα-helixtrans-59.8-46.1175.9-77.2-177.7179.8-176.60111.1L11 S12 Y17 L18 S19L11-K15 WeakPolarHBondContact O-CG 3.41Å; L11-K15 PolarHBondContact O-N 3.35Å; S12-K15 PolarHBondContact O-N 3.33Å; K15-Y17 PolarHBondContact O-N 3.01Å; K15-L18 PolarHBondContact O-N 3.43Å; K15-S19 PolarHBondContact O-N 3.27Å; K15-S19 PolarHBondContact O-OG 2.91Å
16L77.7Confident79.6Confident26 Ų2682.5 Ų82.514%0.13641%0.409CS..Hα-helixtrans-60.4-47.6179.5-176.6140.9000112S12 W13 R14 L18 S19 R20 I85 V88S12-L16 WeakPolarHBondContact O-CB 3.47Å; S12-L16 PolarHBondContact O-N 3.46Å; W13-L16 PolarHBondContact O-N 3.34Å; R14-L16 VanDerWaalsContact C-N 3.35Å; L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 PolarHBondContact O-N 3Å; L16-S19 PolarHBondContact O-N 2.76Å; L16-R20 PolarHBondContact O-N 3.29Å; L16-I85 HydrophobicContact CD2-CG2 4.35Å; L16-I85 HydrophobicContact CG-CG2 4.05Å; L16-V88 HydrophobicContact CD1-CB 3.98Å; L16-V88 HydrophobicContact CD1-CG1 3.69Å
17Y80.9Confident80.6Confident157 Ų15778.7 Ų78.762%0.61640%0.397SS*.Hα-helixtrans-63.7-39.4179.5-153.6-91.3000111.7W13 R14 K15 R20 A21W13-Y17 PolarHBondContact O-N 2.94Å; R14-Y17 PolarHBondContact O-N 3.01Å; K15-Y17 PolarHBondContact O-N 3.01Å; Y17-R20 PolarHBondContact O-N 2.94Å; Y17-A21 WeakPolarHBondContact O-CB 3.41Å; Y17-A21 PolarHBondContact O-N 3.27Å
18L84Confident81.3Confident102 Ų10285 Ų8553%0.53441%0.413SS..Hα-helixtrans-67.1-42.4176.9-173.5145.4000111.8R14 K15 L16 A21 K22R14-L18 VanDerWaalsContact O-CB 3.25Å; R14-L18 WeakPolarHBondContact O-CB 3.42Å; R14-L18 PolarHBondContact O-N 3.2Å; K15-L18 PolarHBondContact O-N 3.43Å; L16-L18 VanDerWaalsContact C-N 3.3Å; L16-L18 PolarHBondContact O-N 3Å; L18-A21 PolarHBondContact O-N 2.96Å; L18-K22 HydrophobicContact CD2-CD 3.4Å; L18-K22 HydrophobicContact CD2-CG 4.2Å; L18-K22 HydrophobicContact CG-CD 4.38Å; L18-K22 WeakPolarHBondContact O-CB 3.43Å; L18-K22 WeakPolarHBondContact O-CG 3.5Å; L18-K22 PolarHBondContact O-N 3.43Å
19S79.8Confident82.1Confident24 Ų2483.8 Ų83.817%0.16841%0.409CS..Hα-helixtrans-62.7-43174.2-660000111.8K15 L16 A21 K22 L23K15-S19 PolarHBondContact O-N 3.27Å; K15-S19 PolarHBondContact O-OG 2.91Å; L16-S19 PolarHBondContact O-N 2.76Å; S19-A21 VanDerWaalsContact C-N 3.34Å; S19-A21 PolarHBondContact O-N 3.49Å; S19-K22 PolarHBondContact O-N 3.48Å; S19-L23 WeakPolarHBondContact O-CG 3.43Å; S19-L23 PolarHBondContact O-N 2.98Å
20R81.8Confident82.9Confident73 Ų7380 Ų8028%0.27539%0.392SS..Hα-helixtrans-58.3-44.9173.4-177.9-179.2174.880.2-3.6112L16 Y17 K24 I85 E86L16-R20 PolarHBondContact O-N 3.29Å; Y17-R20 PolarHBondContact O-N 2.94Å; R20-K24 PolarHBondContact O-N 2.72Å; R20-I85 HydrophobicContact CB-CG2 4.22Å; R20-E86 IonicContact CZ-OE1 3.08Å; R20-E86 IonicContact NH1-OE1 3.67Å; R20-E86 PolarHBondContact NH1-OE1 2.94Å; R20-E86 IonicContact NH2-OE1 2.7Å
21A84.8Confident83.6Confident54 Ų5479.6 Ų79.645%0.44639%0.388SS..Hα-helixtrans-65.3-44.2177.800000112.1Y17 L18 S19 L23 K24 A25Y17-A21 WeakPolarHBondContact O-CB 3.41Å; Y17-A21 PolarHBondContact O-N 3.27Å; L18-A21 PolarHBondContact O-N 2.96Å; S19-A21 VanDerWaalsContact C-N 3.34Å; S19-A21 PolarHBondContact O-N 3.49Å; A21-L23 PolarHBondContact O-N 3.45Å; A21-K24 PolarHBondContact O-N 2.89Å; A21-A25 WeakPolarHBondContact O-CB 3.29Å; A21-A25 PolarHBondContact O-N 3.49Å
22K85.9Confident84.3Confident74 Ų7479.4 Ų79.432%0.32239%0.387SS..Hα-helixtrans-57-46.7176.2-77.7171.270.4-1740111.8L18 S19 A25 S26 E110 W113L18-K22 HydrophobicContact CD2-CD 3.4Å; L18-K22 HydrophobicContact CD2-CG 4.2Å; L18-K22 HydrophobicContact CG-CD 4.38Å; L18-K22 WeakPolarHBondContact O-CB 3.43Å; L18-K22 WeakPolarHBondContact O-CG 3.5Å; L18-K22 PolarHBondContact O-N 3.43Å; S19-K22 PolarHBondContact O-N 3.48Å; K22-A25 PolarHBondContact O-N 3.07Å; K22-S26 VanDerWaalsContact O-CB 3.25Å; K22-S26 WeakPolarHBondContact O-CB 3.46Å; K22-S26 PolarHBondContact O-N 3.26Å; K22-E110 IonicContact NZ-OE1 3.74Å; K22-E110 PolarHBondContact NZ-OE1 3Å; K22-E110 VanDerWaalsContact NZ-OE1 3.08Å; K22-W113 HydrophobicContact CB-CH2 4.01Å; K22-W113 HydrophobicContact CB-CZ2 4.37Å; K22-W113 HydrophobicContact CD-CH2 4.48Å; K22-W113 VanDerWaalsContact CE-CH2 3.42Å; K22-W113 VanDerWaalsContact CE-CZ3 3.44Å; K22-W113 HydrophobicContact CG-CH2 4.48Å
23L83.7Confident85.1Confident10 Ų1079.1 Ų79.15%0.05238%0.381CS..Hα-helixtrans-63.9-44179.8-68.3177.7000112.7S19 A21 A25 S26 S27 I81 L82 I85S19-L23 WeakPolarHBondContact O-CG 3.43Å; S19-L23 PolarHBondContact O-N 2.98Å; A21-L23 PolarHBondContact O-N 3.45Å; L23-A25 PolarHBondContact O-N 2.98Å; L23-S26 PolarHBondContact O-N 3.32Å; L23-S27 WeakPolarHBondContact O-CB 3.32Å; L23-S27 PolarHBondContact O-N 3.04Å; L23-I81 HydrophobicContact CD1-CB 3.87Å; L23-I81 HydrophobicContact CD1-CG2 3.47Å; L23-I81 VanDerWaalsContact CD1-CG2 3.47Å; L23-I81 HydrophobicContact CD2-CB 4.39Å; L23-I81 HydrophobicContact CD2-CD1 4.08Å; L23-I81 HydrophobicContact CD2-CG2 4.36Å; L23-I81 HydrophobicContact CG-CG2 4.44Å; L23-L82 HydrophobicContact CD1-CD1 4.42Å; L23-I85 HydrophobicContact CD1-CD1 3.61Å
24K86Confident85.8Confident111 Ų11173.2 Ų73.248%0.48336%0.361SS..Hα-helixtrans-63.3-43.3177.2-72.8-173.7178.6-172.20111.8R20 A21 S27 R28R20-K24 PolarHBondContact O-N 2.72Å; A21-K24 PolarHBondContact O-N 2.89Å; K24-S27 PolarHBondContact O-N 2.93Å; K24-R28 PolarHBondContact O-N 3.35Å; K24-R28 VanDerWaalsContact O-N 3.15Å
25A87.6Confident86.3Confident55 Ų5565.2 Ų65.246%0.45534%0.341SS..Hα-helixtrans-64.4-44.817600000111.5A21 K22 L23 S27 R28 T29A21-A25 WeakPolarHBondContact O-CB 3.29Å; A21-A25 PolarHBondContact O-N 3.49Å; K22-A25 PolarHBondContact O-N 3.07Å; L23-A25 PolarHBondContact O-N 2.98Å; A25-S27 VanDerWaalsContact C-N 3.32Å; A25-S27 PolarHBondContact O-N 3.3Å; A25-R28 PolarHBondContact O-N 2.91Å; A25-T29 WeakPolarHBondContact O-CB 3.39Å; A25-T29 VanDerWaalsContact O-CG2 3.31Å; A25-T29 WeakPolarHBondContact O-CG2 3.48Å; A25-T29 PolarHBondContact O-N 3.42Å; A25-T29 PolarHBondContact O-OG1 2.95Å
26S86.5Confident87Confident5 Ų564.4 Ų64.44%0.03534%0.337CS..Hα-helixtrans-61.1-40.5177.1-1690000112.9K22 L23 T29 S30 W113K22-S26 VanDerWaalsContact O-CB 3.25Å; K22-S26 WeakPolarHBondContact O-CB 3.46Å; K22-S26 PolarHBondContact O-N 3.26Å; L23-S26 PolarHBondContact O-N 3.32Å; S26-T29 VanDerWaalsContact CA-OG1 3.3Å; S26-T29 WeakPolarHBondContact CA-OG1 3.45Å; S26-T29 PolarHBondContact O-OG1 3.47Å; S26-T29 VanDerWaalsContact O-OG1 3.05Å; S26-S30 VanDerWaalsContact O-CB 3.23Å; S26-S30 WeakPolarHBondContact O-CB 3.47Å; S26-S30 PolarHBondContact O-N 3.21Å; S26-S30 PolarHBondContact O-OG 3.3Å; S26-W113 VanDerWaalsContact CB-NE1 3.34Å; S26-W113 PolarHBondContact OG-NE1 3.33Å
27S88Confident87.7Confident51 Ų5163.3 Ų63.336%0.35733%0.332SS..Hα-helixtrans-64.3-50.2179.51720000110.6L23 K24 A25 T29 S30 A31 L75L23-S27 WeakPolarHBondContact O-CB 3.32Å; L23-S27 PolarHBondContact O-N 3.04Å; K24-S27 PolarHBondContact O-N 2.93Å; A25-S27 VanDerWaalsContact C-N 3.32Å; A25-S27 PolarHBondContact O-N 3.3Å; S27-T29 PolarHBondContact O-N 3.49Å; S27-S30 PolarHBondContact O-N 2.85Å; S27-A31 WeakPolarHBondContact O-CB 3.42Å; S27-A31 PolarHBondContact O-N 2.96Å; S27-L75 VanDerWaalsContact CA-CD2 3.48Å; S27-L75 WeakPolarHBondContact O-CD2 3.49Å
28R88.9Confident88.2Confident187 Ų18760.7 Ų60.771%0.70633%0.326SS*.Hα-helixtrans-61.1-46.9178.1-171.1-176.3-64.8168.6-2.4112.1K24 A25 A31 L32K24-R28 PolarHBondContact O-N 3.35Å; K24-R28 VanDerWaalsContact O-N 3.15Å; A25-R28 PolarHBondContact O-N 2.91Å; R28-A31 PolarHBondContact O-N 2.97Å; R28-L32 HydrophobicContact CG-CD1 4.06Å; R28-L32 WeakPolarHBondContact O-CB 3.24Å; R28-L32 VanDerWaalsContact O-CG 3.29Å; R28-L32 WeakPolarHBondContact O-CG 3.3Å; R28-L32 PolarHBondContact O-N 3.31Å
29T90.6Very high88.7Confident65 Ų6559.7 Ų59.740%0.39932%0.324SS..Hα-helixtrans-65.1-44.4-179.148.40000112.1A25 S26 S27 A31 L32 L33A25-T29 WeakPolarHBondContact O-CB 3.39Å; A25-T29 VanDerWaalsContact O-CG2 3.31Å; A25-T29 WeakPolarHBondContact O-CG2 3.48Å; A25-T29 PolarHBondContact O-N 3.42Å; A25-T29 PolarHBondContact O-OG1 2.95Å; S26-T29 VanDerWaalsContact CA-OG1 3.3Å; S26-T29 WeakPolarHBondContact CA-OG1 3.45Å; S26-T29 PolarHBondContact O-OG1 3.47Å; S26-T29 VanDerWaalsContact O-OG1 3.05Å; S27-T29 PolarHBondContact O-N 3.49Å; T29-A31 VanDerWaalsContact C-N 3.35Å; T29-A31 PolarHBondContact O-N 3.03Å; T29-L32 PolarHBondContact O-N 2.93Å; T29-L33 WeakPolarHBondContact O-CB 3.49Å; T29-L33 VanDerWaalsContact O-CG 3.3Å; T29-L33 WeakPolarHBondContact O-CG 3.18Å; T29-L33 PolarHBondContact O-N 2.98Å
30S91.1Very high89.2Confident0 Ų060 Ų600%033%0.329CS..Hα-helixtrans-64.3-39.4179.2-60.40000112.3S26 S27 S34 H71S26-S30 VanDerWaalsContact O-CB 3.23Å; S26-S30 WeakPolarHBondContact O-CB 3.47Å; S26-S30 PolarHBondContact O-N 3.21Å; S26-S30 PolarHBondContact O-OG 3.3Å; S27-S30 PolarHBondContact O-N 2.85Å; S30-S34 WeakPolarHBondContact O-CB 3.45Å; S30-S34 PolarHBondContact O-N 3.32Å; S30-S34 VanDerWaalsContact O-N 3.1Å; S30-S34 PolarHBondContact O-OG 3.32Å; S30-H71 WeakPolarHBondContact CB-ND1 3.24Å; S30-H71 PolarHBondContact OG-ND1 3.3Å
31A89.9Confident89.7Confident51 Ų5159.3 Ų59.342%0.42133%0.329SS..Hα-helixtrans-64.6-44.5175.300000111.9S27 R28 T29 G35S27-A31 WeakPolarHBondContact O-CB 3.42Å; S27-A31 PolarHBondContact O-N 2.96Å; R28-A31 PolarHBondContact O-N 2.97Å; T29-A31 VanDerWaalsContact C-N 3.35Å; T29-A31 PolarHBondContact O-N 3.03Å; A31-G35 PolarHBondContact O-N 3.32Å
32L92.5Very high90.1Very high91 Ų9161.9 Ų61.948%0.47634%0.339SS..Hα-helixtrans-65.5-48.9178.6-72.2172.2000112.3R28 T29 S34 G35 F36R28-L32 HydrophobicContact CG-CD1 4.06Å; R28-L32 WeakPolarHBondContact O-CB 3.24Å; R28-L32 VanDerWaalsContact O-CG 3.29Å; R28-L32 WeakPolarHBondContact O-CG 3.3Å; R28-L32 PolarHBondContact O-N 3.31Å; T29-L32 PolarHBondContact O-N 2.93Å; L32-S34 PolarHBondContact O-N 2.85Å; L32-G35 PolarHBondContact O-N 2.94Å; L32-F36 HydrophobicContact CB-CD2 4.44Å; L32-F36 HydrophobicContact CB-CE2 4.26Å; L32-F36 HydrophobicContact CD2-CE2 4.37Å; L32-F36 WeakPolarHBondContact O-CD2 3.37Å; L32-F36 WeakPolarHBondContact O-CG 3.44Å; L32-F36 PolarHBondContact O-N 3.25Å
33L91.1Very high90.5Very high41 Ų4164.6 Ų64.622%0.21535%0.353CS..Hα-helixtrans-62.7-43.7-178.6-69173.9000111.8T29 F36 A37 F124T29-L33 WeakPolarHBondContact O-CB 3.49Å; T29-L33 VanDerWaalsContact O-CG 3.3Å; T29-L33 WeakPolarHBondContact O-CG 3.18Å; T29-L33 PolarHBondContact O-N 2.98Å; L33-F36 PolarHBondContact O-N 3.21Å; L33-A37 WeakPolarHBondContact O-CB 3.22Å; L33-A37 PolarHBondContact O-N 3.15Å; L33-F124 HydrophobicContact CB-CD2 4.17Å; L33-F124 HydrophobicContact CB-CE2 4.38Å; L33-F124 HydrophobicContact CD2-CD1 4.04Å; L33-F124 HydrophobicContact CD2-CD2 3.97Å; L33-F124 HydrophobicContact CD2-CE1 3.86Å; L33-F124 HydrophobicContact CD2-CE2 3.79Å; L33-F124 HydrophobicContact CD2-CG 4.1Å; L33-F124 HydrophobicContact CD2-CZ 3.73Å
34S91.2Very high90.8Very high10 Ų1065.5 Ų65.57%0.0736%0.359CS..Hα-helixtrans-64.2-42.4175.8-53.50000111.9S30 L32 A37 M38 H71S30-S34 WeakPolarHBondContact O-CB 3.45Å; S30-S34 PolarHBondContact O-N 3.32Å; S30-S34 VanDerWaalsContact O-N 3.1Å; S30-S34 PolarHBondContact O-OG 3.32Å; L32-S34 PolarHBondContact O-N 2.85Å; S34-A37 PolarHBondContact O-N 2.87Å; S34-M38 VanDerWaalsContact O-CB 3.31Å; S34-M38 WeakPolarHBondContact O-CB 3.45Å; S34-M38 PolarHBondContact O-N 3.32Å; S34-H71 WeakPolarHBondContact OG-CB 3.38Å
35G92.3Very high90.8Very high32 Ų3268.6 Ų68.633%0.3338%0.375SS..Hα-helixtrans-61.9-47.2177.400000111.8A31 L32 M38 V39A31-G35 PolarHBondContact O-N 3.32Å; L32-G35 PolarHBondContact O-N 2.94Å; G35-M38 PolarHBondContact O-N 3.39Å; G35-V39 VanDerWaalsContact O-CG2 3.3Å; G35-V39 WeakPolarHBondContact O-CG2 3.47Å; G35-V39 PolarHBondContact O-N 3.28Å
36F92.5Very high90.7Very high134 Ų13469.5 Ų69.559%0.58837%0.371SS*.Hα-helixtrans-64.7-40.7178-73-51.6000112.9L32 L33 V39 A40L32-F36 HydrophobicContact CB-CD2 4.44Å; L32-F36 HydrophobicContact CB-CE2 4.26Å; L32-F36 HydrophobicContact CD2-CE2 4.37Å; L32-F36 WeakPolarHBondContact O-CD2 3.37Å; L32-F36 WeakPolarHBondContact O-CG 3.44Å; L32-F36 PolarHBondContact O-N 3.25Å; L33-F36 PolarHBondContact O-N 3.21Å; F36-V39 PolarHBondContact O-N 3.4Å; F36-A40 WeakPolarHBondContact O-CB 3.36Å; F36-A40 PolarHBondContact O-N 3.38Å
37A91.9Very high90.7Very high2 Ų273 Ų732%0.01739%0.39CS..Hα-helixtrans-64.2-42.5175.800000111.7L33 S34 A40 M41 L67 E127L33-A37 WeakPolarHBondContact O-CB 3.22Å; L33-A37 PolarHBondContact O-N 3.15Å; S34-A37 PolarHBondContact O-N 2.87Å; A37-A40 PolarHBondContact O-N 3.36Å; A37-M41 PolarHBondContact O-N 3.36Å; A37-L67 HydrophobicContact CB-CD2 3.44Å; A37-L67 VanDerWaalsContact CB-CD2 3.44Å; A37-E127 HydrophobicContact CB-CG 4.44Å
38M92.6Very high90.5Very high103 Ų10378.3 Ų78.351%0.50741%0.414SS..Hα-helixtrans-63-43.4176.3-173.7178.8-6700112S34 G35 M41 V42 V68S34-M38 VanDerWaalsContact O-CB 3.31Å; S34-M38 WeakPolarHBondContact O-CB 3.45Å; S34-M38 PolarHBondContact O-N 3.32Å; G35-M38 PolarHBondContact O-N 3.39Å; M38-M41 PolarHBondContact O-N 2.67Å; M38-V42 PolarHBondContact O-N 3.4Å; M38-V42 VanDerWaalsContact O-N 3.15Å; M38-V68 HydrophobicContact CE-CG1 4.21Å; M38-V68 HydrophobicContact CE-CG2 4.39Å
39V93.9Very high90.3Very high81 Ų8178.5 Ų78.549%0.49142%0.42SS..Hα-helixtrans-62.7-45.9174.9171.30000110.8G35 F36 M41 V42 E43G35-V39 VanDerWaalsContact O-CG2 3.3Å; G35-V39 WeakPolarHBondContact O-CG2 3.47Å; G35-V39 PolarHBondContact O-N 3.28Å; F36-V39 PolarHBondContact O-N 3.4Å; V39-M41 VanDerWaalsContact C-N 3.27Å; V39-M41 PolarHBondContact O-N 3.14Å; V39-V42 VanDerWaalsContact O-CG2 3.22Å; V39-V42 WeakPolarHBondContact O-CG2 3.42Å; V39-V42 PolarHBondContact O-N 2.87Å; V39-E43 HydrophobicContact CG1-CG 4.01Å; V39-E43 VanDerWaalsContact O-CB 3.32Å; V39-E43 WeakPolarHBondContact O-CB 3.39Å; V39-E43 VanDerWaalsContact O-CG 3.26Å; V39-E43 WeakPolarHBondContact O-CG 3.15Å; V39-E43 PolarHBondContact O-N 2.79Å
40A91.4Very high90Very high31 Ų3179 Ų7926%0.25642%0.416SS..Hα-helixtrans-60.7-37.2178.200000112.4F36 A37 V44 L131F36-A40 WeakPolarHBondContact O-CB 3.36Å; F36-A40 PolarHBondContact O-N 3.38Å; A37-A40 PolarHBondContact O-N 3.36Å; A40-V44 PolarHBondContact O-N 3Å; A40-V44 VanDerWaalsContact O-N 3.09Å; A40-L131 HydrophobicContact CB-CD1 3.76Å; A40-L131 HydrophobicContact CB-CD2 4.46Å
41M91.9Very high89.8Confident58 Ų5884.3 Ų84.329%0.28645%0.45SS..Hα-helixtrans-65.4-40.5175.1167.9171.7-94.400112.9A37 M38 V39 V44 F60 T64A37-M41 PolarHBondContact O-N 3.36Å; M38-M41 PolarHBondContact O-N 2.67Å; V39-M41 VanDerWaalsContact C-N 3.27Å; V39-M41 PolarHBondContact O-N 3.14Å; M41-V44 VanDerWaalsContact O-CG1 3.26Å; M41-V44 WeakPolarHBondContact O-CG1 3.29Å; M41-F60 HydrophobicContact CB-CZ 4.23Å; M41-F60 HydrophobicContact CE-CD1 4.25Å; M41-F60 HydrophobicContact CE-CE1 3.87Å; M41-F60 HydrophobicContact CE-CZ 4.23Å; M41-F60 HydrophobicContact CG-CE1 4.42Å; M41-F60 HydrophobicContact CG-CZ 4.49Å; M41-T64 HydrophobicContact CB-CG2 4.1Å; M41-T64 VanDerWaalsContact CE-CB 3.4Å; M41-T64 HydrophobicContact CE-CG2 3.77Å; M41-T64 WeakPolarHBondContact CE-OG1 3.44Å; M41-T64 HydrophobicContact SD-CG2 3.7Å
42V93.1Very high89.7Confident108 Ų10883.1 Ų83.166%0.65543%0.434SS*.Hα-helixtrans-78.9-26.1179.2-60.30000112.7M38 V39M38-V42 PolarHBondContact O-N 3.4Å; M38-V42 VanDerWaalsContact O-N 3.15Å; V39-V42 VanDerWaalsContact O-CG2 3.22Å; V39-V42 WeakPolarHBondContact O-CG2 3.42Å; V39-V42 PolarHBondContact O-N 2.87Å
43E92.9Very high89.7Confident130 Ų13081.8 Ų81.861%0.60743%0.431SS*.Hα-helixtrans-84.2-8.7177.2-69.7-67.6155.800113.2V39 Q45V39-E43 HydrophobicContact CG1-CG 4.01Å; V39-E43 VanDerWaalsContact O-CB 3.32Å; V39-E43 WeakPolarHBondContact O-CB 3.39Å; V39-E43 VanDerWaalsContact O-CG 3.26Å; V39-E43 WeakPolarHBondContact O-CG 3.15Å; V39-E43 PolarHBondContact O-N 2.79Å; E43-Q45 PolarHBondContact O-N 2.81Å
44V90Very high89.7Confident30 Ų3084.5 Ų84.518%0.18245%0.452CS..  trans-71.5115.5178.881.50000110A40 M41 F60 L131 V134A40-V44 PolarHBondContact O-N 3Å; A40-V44 VanDerWaalsContact O-N 3.09Å; M41-V44 VanDerWaalsContact O-CG1 3.26Å; M41-V44 WeakPolarHBondContact O-CG1 3.29Å; V44-F60 HydrophobicContact CG1-CE1 4.02Å; V44-F60 HydrophobicContact CG1-CZ 4.34Å; V44-L131 HydrophobicContact CG2-CD2 4.39Å; V44-V134 HydrophobicContact CG2-CG1 3.71Å
45Q86.9Confident89.8Confident176 Ų17687.6 Ų87.682%0.82248%0.477SS*.  trans-91.3108.6178.6-64.6-176.64.400109.6E43E43-Q45 PolarHBondContact O-N 2.81Å
46L86.2Confident89.8Confident73 Ų7387.2 Ų87.238%0.38247%0.468SS..  trans-86.7126.6174.9-61.7176.4000110.2N48 Y52 L57 V134L46-N48 PolarHBondContact O-N 3.3Å; L46-Y52 HydrophobicContact CB-CE2 4.27Å; L46-Y52 HydrophobicContact CD2-CE1 4.37Å; L46-Y52 HydrophobicContact CD2-CE2 4.27Å; L46-L57 HydrophobicContact CD1-CD2 4.12Å; L46-L57 HydrophobicContact CD2-CD2 4.25Å; L46-V134 HydrophobicContact CD2-CG1 3.3Å
47D86.3Confident89.8Confident78 Ų7883.7 Ų83.742%0.41746%0.455SS..  trans-71.8109.8170.1-173.5-10.4000111.5K49 Y50 Y52D47-K49 PolarHBondContact O-N 3.46Å; D47-K49 VanDerWaalsContact O-N 3.08Å; D47-K49 WeakPolarHBondContact OD1-CB 3.27Å; D47-K49 PolarHBondContact OD1-N 3.15Å; D47-Y50 PolarHBondContact O-N 2.92Å; D47-Y52 PolarHBondContact N-OH 3.18Å; D47-Y52 VanDerWaalsContact N-OH 3.11Å; D47-Y52 WeakPolarHBondContact O-CE2 3.32Å
48N82.8Confident89.9Confident163 Ų16389.2 Ų89.287%0.87248%0.483SS*.THydrogen-bonded Turntrans-59.2-19.9178.7-69.8-32.3000114.4L46L46-N48 PolarHBondContact O-N 3.3Å
49K84.5Confident90Very high191 Ų19186.3 Ų86.383%0.8348%0.475SS*.THydrogen-bonded Turntrans-90.2-15.7179.2-63.6177.2-179.3176.10112.5D47D47-K49 PolarHBondContact O-N 3.46Å; D47-K49 VanDerWaalsContact O-N 3.08Å; D47-K49 WeakPolarHBondContact OD1-CB 3.27Å; D47-K49 PolarHBondContact OD1-N 3.15Å
50Y84.9Confident90.1Very high77 Ų7783.1 Ų83.130%0.30246%0.455SS..SBendtrans-87.6122.8180-171.2-93000110.2D47 Y52 L137 P138D47-Y50 PolarHBondContact O-N 2.92Å; Y50-Y52 VanDerWaalsContact C-N 3.33Å; Y50-Y52 AromaticContact CD1-CD1 3.76Å; Y50-Y52 HydrophobicContact CD1-CD1 3.76Å; Y50-Y52 AromaticContact CD1-CD2 3.92Å; Y50-Y52 HydrophobicContact CD1-CD2 3.92Å; Y50-Y52 AromaticContact CD1-CE1 3.76Å; Y50-Y52 HydrophobicContact CD1-CE1 3.76Å; Y50-Y52 AromaticContact CD1-CE2 3.92Å; Y50-Y52 HydrophobicContact CD1-CE2 3.92Å; Y50-Y52 AromaticContact CD1-CG 3.84Å; Y50-Y52 HydrophobicContact CD1-CG 3.84Å; Y50-Y52 AromaticContact CD1-CZ 3.83Å; Y50-Y52 HydrophobicContact CE1-CD1 4.09Å; Y50-Y52 HydrophobicContact CE1-CE1 4.28Å; Y50-Y52 HydrophobicContact CE1-CG 4.4Å; Y50-Y52 HydrophobicContact CG-CE2 4.41Å; Y50-Y52 WeakPolarHBondContact O-CD2 3.49Å; Y50-Y52 PolarHBondContact O-N 3.41Å; Y50-L137 HydrophobicContact CE1-CB 4.45Å; Y50-L137 HydrophobicContact CE1-CD2 3.75Å; Y50-L137 HydrophobicContact CE1-CG 3.84Å; Y50-L137 WeakPolarHBondContact OH-CG 3.39Å; Y50-L137 PolarHBondContact OH-O 3.27Å; Y50-P138 HydrophobicContact CD1-CG 4.21Å; Y50-P138 HydrophobicContact CD2-CB 4.01Å; Y50-P138 HydrophobicContact CE2-CB 4.48Å; Y50-P138 HydrophobicContact CG-CB 4.03Å; Y50-P138 HydrophobicContact CG-CG 4.18Å
51P86.7Confident90.2Very high111 Ų11184.7 Ų84.772%0.72146%0.464SS*.  trans-77.283.4178.831.8-34.1000110.2
52Y89Confident90.4Very high25 Ų2584.2 Ų84.210%0.09847%0.469CS..  trans-61.7139.6174.8-65.6-88.1000110.9L46 D47 Y50 P54 L57 V134 L137 P138L46-Y52 HydrophobicContact CB-CE2 4.27Å; L46-Y52 HydrophobicContact CD2-CE1 4.37Å; L46-Y52 HydrophobicContact CD2-CE2 4.27Å; D47-Y52 PolarHBondContact N-OH 3.18Å; D47-Y52 VanDerWaalsContact N-OH 3.11Å; D47-Y52 WeakPolarHBondContact O-CE2 3.32Å; Y50-Y52 VanDerWaalsContact C-N 3.33Å; Y50-Y52 AromaticContact CD1-CD1 3.76Å; Y50-Y52 HydrophobicContact CD1-CD1 3.76Å; Y50-Y52 AromaticContact CD1-CD2 3.92Å; Y50-Y52 HydrophobicContact CD1-CD2 3.92Å; Y50-Y52 AromaticContact CD1-CE1 3.76Å; Y50-Y52 HydrophobicContact CD1-CE1 3.76Å; Y50-Y52 AromaticContact CD1-CE2 3.92Å; Y50-Y52 HydrophobicContact CD1-CE2 3.92Å; Y50-Y52 AromaticContact CD1-CG 3.84Å; Y50-Y52 HydrophobicContact CD1-CG 3.84Å; Y50-Y52 AromaticContact CD1-CZ 3.83Å; Y50-Y52 HydrophobicContact CE1-CD1 4.09Å; Y50-Y52 HydrophobicContact CE1-CE1 4.28Å; Y50-Y52 HydrophobicContact CE1-CG 4.4Å; Y50-Y52 HydrophobicContact CG-CE2 4.41Å; Y50-Y52 WeakPolarHBondContact O-CD2 3.49Å; Y50-Y52 PolarHBondContact O-N 3.41Å; Y52-P54 WeakPolarHBondContact O-CD 3.5Å; Y52-L57 HydrophobicContact CG-CD2 4.42Å; Y52-V134 WeakPolarHBondContact CE1-O 2.94Å; Y52-L137 HydrophobicContact CD1-CD2 4.3Å; Y52-P138 HydrophobicContact CE1-CG 3.72Å; Y52-P138 WeakPolarHBondContact OH-CG 3.33Å
53P91Very high90.6Very high63 Ų6379.8 Ų79.841%0.40944%0.443SS..  trans-57.1127172-23.433.2000110.6A55 L56 L57 L137P53-A55 PolarHBondContact O-N 3.24Å; P53-L56 HydrophobicContact CB-CB 4.24Å; P53-L56 WeakPolarHBondContact O-CB 3.44Å; P53-L56 PolarHBondContact O-N 2.97Å; P53-L57 PolarHBondContact O-N 3.16Å; P53-L137 HydrophobicContact CG-CD2 4.26Å
54P91.3Very high90.6Very high99 Ų9973.8 Ų73.864%0.64342%0.415SS*.Hα-helixtrans-56.4-38.8-178.7-27.134.1000112.8Y52 L56 L57 I58Y52-P54 WeakPolarHBondContact O-CD 3.5Å; P54-L56 VanDerWaalsContact C-N 3.27Å; P54-L56 PolarHBondContact O-N 3.32Å; P54-L57 PolarHBondContact O-N 2.97Å; P54-I58 WeakPolarHBondContact O-CD1 3.29Å; P54-I58 VanDerWaalsContact O-CG1 3.25Å; P54-I58 WeakPolarHBondContact O-CG1 3.42Å; P54-I58 PolarHBondContact O-N 3.4Å
55A93.3Very high90.9Very high74 Ų7476.6 Ų76.661%0.61243%0.433SS*.Hα-helixtrans-60.4-34.7177.900000113P53 A59P53-A55 PolarHBondContact O-N 3.24Å; A55-A59 WeakPolarHBondContact O-CB 3.37Å; A55-A59 PolarHBondContact O-N 3.04Å
56L92.6Very high91.3Very high24 Ų2471.6 Ų71.613%0.12641%0.414CS..Hα-helixtrans-68.6-45.5178.8178.364.9000111P53 P54 A59 F60 L130 W133 V134 L137P53-L56 HydrophobicContact CB-CB 4.24Å; P53-L56 WeakPolarHBondContact O-CB 3.44Å; P53-L56 PolarHBondContact O-N 2.97Å; P54-L56 VanDerWaalsContact C-N 3.27Å; P54-L56 PolarHBondContact O-N 3.32Å; L56-A59 PolarHBondContact O-N 3.12Å; L56-F60 VanDerWaalsContact O-CB 3.32Å; L56-F60 WeakPolarHBondContact O-CB 3Å; L56-F60 PolarHBondContact O-N 2.85Å; L56-L130 HydrophobicContact CD1-CD2 3.94Å; L56-W133 HydrophobicContact CD1-CB 3.76Å; L56-W133 HydrophobicContact CD1-CG 4.47Å; L56-W133 HydrophobicContact CD2-CB 4.19Å; L56-V134 HydrophobicContact CD1-CG2 4.44Å; L56-V134 HydrophobicContact CD2-CG2 4.13Å; L56-V134 HydrophobicContact CG-CG2 4.06Å; L56-L137 HydrophobicContact CD2-CD2 3.94Å
57L92.3Very high91.8Very high61 Ų6168.1 Ų68.132%0.31940%0.396SS..Hα-helixtrans-65.5-41.3178.6-65.5176.6000111.7L46 Y52 P53 P54 F60 S61L46-L57 HydrophobicContact CD1-CD2 4.12Å; L46-L57 HydrophobicContact CD2-CD2 4.25Å; Y52-L57 HydrophobicContact CG-CD2 4.42Å; P53-L57 PolarHBondContact O-N 3.16Å; P54-L57 PolarHBondContact O-N 2.97Å; L57-F60 PolarHBondContact O-N 3.11Å; L57-S61 WeakPolarHBondContact O-CB 3.32Å; L57-S61 PolarHBondContact O-N 3.36Å
58I94.8Very high92.2Very high118 Ų11865.5 Ų65.561%0.60538%0.382SS*.Hα-helixtrans-64-46.5175.7-65.9165.1000110.3P54 F60 S61 A62P54-I58 WeakPolarHBondContact O-CD1 3.29Å; P54-I58 VanDerWaalsContact O-CG1 3.25Å; P54-I58 WeakPolarHBondContact O-CG1 3.42Å; P54-I58 PolarHBondContact O-N 3.4Å; I58-F60 PolarHBondContact O-N 3.15Å; I58-S61 PolarHBondContact O-N 3.44Å; I58-A62 VanDerWaalsContact O-CB 3.24Å; I58-A62 WeakPolarHBondContact O-CB 3.47Å; I58-A62 PolarHBondContact O-N 2.88Å
59A95.3Very high92.7Very high42 Ų4260.2 Ų60.235%0.34736%0.362SS..Hα-helixtrans-62.1-43.4178.700000111.8A55 L56 C63 L130A55-A59 WeakPolarHBondContact O-CB 3.37Å; A55-A59 PolarHBondContact O-N 3.04Å; L56-A59 PolarHBondContact O-N 3.12Å; A59-C63 WeakPolarHBondContact O-CB 3.26Å; A59-C63 PolarHBondContact O-N 3.23Å; A59-L130 HydrophobicContact CB-CD2 4.22Å
60F94.6Very high93.2Very high13 Ų1352.4 Ų52.46%0.05733%0.33CS..Hα-helixtrans-58.9-55.7174.8179.1-117.5000111.3M41 V44 L56 L57 I58 A62 C63 T64 E127 L130 L131 V134M41-F60 HydrophobicContact CB-CZ 4.23Å; M41-F60 HydrophobicContact CE-CD1 4.25Å; M41-F60 HydrophobicContact CE-CE1 3.87Å; M41-F60 HydrophobicContact CE-CZ 4.23Å; M41-F60 HydrophobicContact CG-CE1 4.42Å; M41-F60 HydrophobicContact CG-CZ 4.49Å; V44-F60 HydrophobicContact CG1-CE1 4.02Å; V44-F60 HydrophobicContact CG1-CZ 4.34Å; L56-F60 VanDerWaalsContact O-CB 3.32Å; L56-F60 WeakPolarHBondContact O-CB 3Å; L56-F60 PolarHBondContact O-N 2.85Å; L57-F60 PolarHBondContact O-N 3.11Å; I58-F60 PolarHBondContact O-N 3.15Å; F60-A62 PolarHBondContact O-N 2.85Å; F60-C63 PolarHBondContact O-N 2.93Å; F60-T64 PolarHBondContact O-N 2.87Å; F60-T64 PolarHBondContact O-OG1 3.03Å; F60-E127 WeakPolarHBondContact CE2-OE1 3.32Å; F60-L130 HydrophobicContact CB-CB 4.49Å; F60-L130 HydrophobicContact CD2-CB 3.94Å; F60-L131 HydrophobicContact CD2-CD2 4.47Å; F60-L131 HydrophobicContact CE2-CD2 3.36Å; F60-L131 HydrophobicContact CE2-CG 3.73Å; F60-L131 HydrophobicContact CZ-CD2 3.48Å; F60-L131 VanDerWaalsContact CZ-CD2 3.48Å; F60-L131 HydrophobicContact CZ-CG 4.35Å; F60-V134 HydrophobicContact CB-CG2 4.32Å; F60-V134 HydrophobicContact CD1-CG2 4.46Å; F60-V134 HydrophobicContact CG-CG2 4.2Å
61S94Very high93.6Very high64 Ų6448.8 Ų48.845%0.44832%0.316SS..Hα-helixtrans-56.2-46.8178.2168.60000113.3L57 I58 T65L57-S61 WeakPolarHBondContact O-CB 3.32Å; L57-S61 PolarHBondContact O-N 3.36Å; I58-S61 PolarHBondContact O-N 3.44Å; S61-T65 WeakPolarHBondContact O-CB 3.43Å; S61-T65 PolarHBondContact O-N 3.33Å; S61-T65 VanDerWaalsContact O-N 3.13Å; S61-T65 PolarHBondContact O-OG1 3.41Å
62A96.5Very high93.9Very high49 Ų4948.1 Ų48.141%0.40531%0.306SS..Hα-helixtrans-66.2-43.2179.700000111.4I58 F60 T65 V66I58-A62 VanDerWaalsContact O-CB 3.24Å; I58-A62 WeakPolarHBondContact O-CB 3.47Å; I58-A62 PolarHBondContact O-N 2.88Å; F60-A62 PolarHBondContact O-N 2.85Å; A62-T65 PolarHBondContact O-N 3.37Å; A62-V66 VanDerWaalsContact O-CG2 3.28Å; A62-V66 WeakPolarHBondContact O-CG2 3.08Å; A62-V66 PolarHBondContact O-N 3.42Å
63C95.9Very high94Very high14 Ų1451.1 Ų51.110%0.09532%0.319CS..Hα-helixtrans-59.1-51.9178.4-177.70000111.3A59 F60 T65 V66 L67 E127 L130A59-C63 WeakPolarHBondContact O-CB 3.26Å; A59-C63 PolarHBondContact O-N 3.23Å; F60-C63 PolarHBondContact O-N 2.93Å; C63-T65 VanDerWaalsContact C-N 3.3Å; C63-T65 PolarHBondContact O-N 3.16Å; C63-V66 PolarHBondContact O-N 2.8Å; C63-L67 WeakPolarHBondContact O-CB 3.41Å; C63-L67 PolarHBondContact O-N 3.24Å; C63-E127 PolarHBondContact SG-OE2 3.42Å; C63-L130 HydrophobicContact CB-CD1 3.51Å
64T94.8Very high94Very high4 Ų448.1 Ų48.13%0.02530%0.3CS..Hα-helixtrans-59.8-41.7178.7-37.70000111.8M41 F60 L67 V68 E127M41-T64 HydrophobicContact CB-CG2 4.1Å; M41-T64 VanDerWaalsContact CE-CB 3.4Å; M41-T64 HydrophobicContact CE-CG2 3.77Å; M41-T64 WeakPolarHBondContact CE-OG1 3.44Å; M41-T64 HydrophobicContact SD-CG2 3.7Å; F60-T64 PolarHBondContact O-N 2.87Å; F60-T64 PolarHBondContact O-OG1 3.03Å; T64-L67 WeakPolarHBondContact O-CB 3.35Å; T64-L67 PolarHBondContact O-N 2.9Å; T64-V68 WeakPolarHBondContact O-CG2 3.47Å; T64-V68 PolarHBondContact O-N 3.12Å; T64-E127 WeakPolarHBondContact CB-OE1 3.04Å; T64-E127 WeakPolarHBondContact CG2-OE1 3.18Å; T64-E127 PolarHBondContact N-OE2 2.96Å; T64-E127 PolarHBondContact OG1-OE1 3.39Å; T64-E127 PolarHBondContact OG1-OE2 3.2Å
65T95.3Very high93.8Very high90 Ų9045.1 Ų45.155%0.55228%0.278SS*.Hα-helixtrans-64.7-48.4-179.2-56.70000111.1S61 A62 C63 L67 V68 A69S61-T65 WeakPolarHBondContact O-CB 3.43Å; S61-T65 PolarHBondContact O-N 3.33Å; S61-T65 VanDerWaalsContact O-N 3.13Å; S61-T65 PolarHBondContact O-OG1 3.41Å; A62-T65 PolarHBondContact O-N 3.37Å; C63-T65 VanDerWaalsContact C-N 3.3Å; C63-T65 PolarHBondContact O-N 3.16Å; T65-L67 VanDerWaalsContact C-N 3.34Å; T65-V68 PolarHBondContact O-N 2.92Å; T65-A69 WeakPolarHBondContact O-CB 3.25Å; T65-A69 PolarHBondContact O-N 3.02Å
66V96.2Very high93.7Very high71 Ų7146.5 Ų46.543%0.4327%0.273SS..Hα-helixtrans-66.6-38.5178.6179.90000110.5A62 C63 A69 V70 L123A62-V66 VanDerWaalsContact O-CG2 3.28Å; A62-V66 WeakPolarHBondContact O-CG2 3.08Å; A62-V66 PolarHBondContact O-N 3.42Å; C63-V66 PolarHBondContact O-N 2.8Å; V66-A69 PolarHBondContact O-N 3.28Å; V66-V70 HydrophobicContact CG1-CG2 4.07Å; V66-V70 WeakPolarHBondContact O-CB 3.4Å; V66-V70 VanDerWaalsContact O-CG2 3.28Å; V66-V70 WeakPolarHBondContact O-CG2 3.2Å; V66-V70 PolarHBondContact O-N 3Å; V66-L123 HydrophobicContact CB-CD1 4.22Å; V66-L123 HydrophobicContact CG1-CD1 3.58Å
67L94.9Very high93.4Very high0 Ų045.9 Ų45.90%027%0.27CS..Hα-helixtrans-55.9-53.4175.817364000111.5A37 C63 T64 T65 V70 H71 G120 L123 F124 E127A37-L67 HydrophobicContact CB-CD2 3.44Å; A37-L67 VanDerWaalsContact CB-CD2 3.44Å; C63-L67 WeakPolarHBondContact O-CB 3.41Å; C63-L67 PolarHBondContact O-N 3.24Å; T64-L67 WeakPolarHBondContact O-CB 3.35Å; T64-L67 PolarHBondContact O-N 2.9Å; T65-L67 VanDerWaalsContact C-N 3.34Å; L67-V70 PolarHBondContact O-N 3.46Å; L67-H71 PolarHBondContact O-CD2 3.48Å; L67-H71 PolarHBondContact O-N 3.45Å; L67-H71 VanDerWaalsContact O-N 3.11Å; L67-G120 WeakPolarHBondContact CD1-O 3.37Å; L67-L123 HydrophobicContact CB-CB 4Å; L67-L123 HydrophobicContact CD1-CB 3.64Å; L67-L123 HydrophobicContact CG-CB 4.41Å; L67-F124 HydrophobicContact CD1-CB 3.92Å; L67-F124 HydrophobicContact CD2-CB 4.46Å; L67-F124 HydrophobicContact CD2-CD2 4.25Å; L67-E127 HydrophobicContact CD2-CB 4.05Å; L67-E127 HydrophobicContact CD2-CG 4.11Å
68V94.8Very high93Very high22 Ų2243.3 Ų43.313%0.13326%0.257CS..Hα-helixtrans-61.7-46.3178.4173.30000109.9M38 T64 T65 V70 H71 L72M38-V68 HydrophobicContact CE-CG1 4.21Å; M38-V68 HydrophobicContact CE-CG2 4.39Å; T64-V68 WeakPolarHBondContact O-CG2 3.47Å; T64-V68 PolarHBondContact O-N 3.12Å; T65-V68 PolarHBondContact O-N 2.92Å; V68-V70 PolarHBondContact O-N 2.93Å; V68-H71 PolarHBondContact O-N 2.81Å; V68-L72 HydrophobicContact CG1-CD1 3.97Å; V68-L72 HydrophobicContact CG1-CG 4.2Å; V68-L72 WeakPolarHBondContact O-CB 3.18Å; V68-L72 VanDerWaalsContact O-CG 3.28Å; V68-L72 WeakPolarHBondContact O-CG 3.32Å; V68-L72 PolarHBondContact O-N 3.4Å
69A95.1Very high92.6Very high53 Ų5342.4 Ų42.444%0.43826%0.257SS..Hα-helixtrans-58.7-45179.700000112.8T65 V66 L72 F73T65-A69 WeakPolarHBondContact O-CB 3.25Å; T65-A69 PolarHBondContact O-N 3.02Å; V66-A69 PolarHBondContact O-N 3.28Å; A69-L72 PolarHBondContact O-N 3.08Å; A69-F73 WeakPolarHBondContact O-CB 3.33Å; A69-F73 PolarHBondContact O-N 3.34Å
70V94.4Very high91.7Very high27 Ų2744.1 Ų44.116%0.16427%0.266CS..Hα-helixtrans-66.1-40.5-180168.70000111.6V66 L67 V68 F73 A74 S116 I119 L123V66-V70 HydrophobicContact CG1-CG2 4.07Å; V66-V70 WeakPolarHBondContact O-CB 3.4Å; V66-V70 VanDerWaalsContact O-CG2 3.28Å; V66-V70 WeakPolarHBondContact O-CG2 3.2Å; V66-V70 PolarHBondContact O-N 3Å; L67-V70 PolarHBondContact O-N 3.46Å; V68-V70 PolarHBondContact O-N 2.93Å; V70-F73 WeakPolarHBondContact O-CB 3.43Å; V70-F73 PolarHBondContact O-N 3.45Å; V70-A74 PolarHBondContact O-N 2.93Å; V70-S116 WeakPolarHBondContact CG1-O 3.1Å; V70-I119 HydrophobicContact CG1-CB 4.17Å; V70-I119 HydrophobicContact CG1-CG2 4Å; V70-I119 HydrophobicContact CG2-CG2 4.06Å; V70-L123 HydrophobicContact CG2-CD1 4.15Å
71H93.6Very high91Very high1 Ų143.7 Ų43.71%0.00527%0.265CS..Hα-helixtrans-69.6-38.1176-83.3-59000112.7S30 S34 L67 V68 F73 A74 L75S30-H71 WeakPolarHBondContact CB-ND1 3.24Å; S30-H71 PolarHBondContact OG-ND1 3.3Å; S34-H71 WeakPolarHBondContact OG-CB 3.38Å; L67-H71 PolarHBondContact O-CD2 3.48Å; L67-H71 PolarHBondContact O-N 3.45Å; L67-H71 VanDerWaalsContact O-N 3.11Å; V68-H71 PolarHBondContact O-N 2.81Å; H71-F73 VanDerWaalsContact C-N 3.28Å; H71-F73 PolarHBondContact O-N 2.93Å; H71-A74 PolarHBondContact O-N 3.47Å; H71-L75 WeakPolarHBondContact O-CG 3.44Å; H71-L75 PolarHBondContact O-N 2.98Å
72L92.1Very high90.1Very high97 Ų9743 Ų4351%0.50826%0.255SS..Hα-helixtrans-61.7-38.3171.4-69.4-178.5000111.4V68 A69 L75 M76V68-L72 HydrophobicContact CG1-CD1 3.97Å; V68-L72 HydrophobicContact CG1-CG 4.2Å; V68-L72 WeakPolarHBondContact O-CB 3.18Å; V68-L72 VanDerWaalsContact O-CG 3.28Å; V68-L72 WeakPolarHBondContact O-CG 3.32Å; V68-L72 PolarHBondContact O-N 3.4Å; A69-L72 PolarHBondContact O-N 3.08Å; L72-L75 HydrophobicContact CD2-CD1 4.14Å; L72-L75 WeakPolarHBondContact O-CB 3.4Å; L72-L75 PolarHBondContact O-N 3.15Å; L72-M76 PolarHBondContact O-N 2.88Å
73F91.8Very high88.9Confident87 Ų8744.3 Ų44.338%0.38226%0.26SS..Hα-helixtrans-62.9-44.1173-179.3-94.9000111.7A69 V70 H71 L75 M76 V77 S116A69-F73 WeakPolarHBondContact O-CB 3.33Å; A69-F73 PolarHBondContact O-N 3.34Å; V70-F73 WeakPolarHBondContact O-CB 3.43Å; V70-F73 PolarHBondContact O-N 3.45Å; H71-F73 VanDerWaalsContact C-N 3.28Å; H71-F73 PolarHBondContact O-N 2.93Å; F73-L75 VanDerWaalsContact C-N 3.28Å; F73-L75 PolarHBondContact O-N 3.33Å; F73-M76 HydrophobicContact CD2-CE 3.58Å; F73-M76 HydrophobicContact CE2-CE 3.68Å; F73-M76 PolarHBondContact O-N 3.5Å; F73-V77 HydrophobicContact CD1-CG2 4.11Å; F73-V77 HydrophobicContact CE1-CG2 3.71Å; F73-V77 HydrophobicContact CE2-CG2 4.26Å; F73-V77 HydrophobicContact CZ-CG2 3.79Å; F73-V77 WeakPolarHBondContact O-CG2 3.36Å; F73-V77 PolarHBondContact O-N 2.94Å; F73-S116 WeakPolarHBondContact CD1-OG 3.5Å; F73-S116 WeakPolarHBondContact CE1-OG 3.43Å
74A89.6Confident87.7Confident0 Ų046.8 Ų46.80%027%0.272CS..Hα-helixtrans-60.8-35.7174.800000112.8V70 H71 S78V70-A74 PolarHBondContact O-N 2.93Å; H71-A74 PolarHBondContact O-N 3.47Å; A74-S78 WeakPolarHBondContact O-CB 3.25Å; A74-S78 PolarHBondContact O-N 3.39Å; A74-S78 PolarHBondContact O-OG 2.97Å
75L88.7Confident86.5Confident36 Ų3647.1 Ų47.119%0.18827%0.274CS..Hα-helixtrans-65.7-48.6172.7-68.3-179000111.9S27 H71 L72 F73 V77 S78 T79S27-L75 VanDerWaalsContact CA-CD2 3.48Å; S27-L75 WeakPolarHBondContact O-CD2 3.49Å; H71-L75 WeakPolarHBondContact O-CG 3.44Å; H71-L75 PolarHBondContact O-N 2.98Å; L72-L75 HydrophobicContact CD2-CD1 4.14Å; L72-L75 WeakPolarHBondContact O-CB 3.4Å; L72-L75 PolarHBondContact O-N 3.15Å; F73-L75 VanDerWaalsContact C-N 3.28Å; F73-L75 PolarHBondContact O-N 3.33Å; L75-V77 VanDerWaalsContact C-N 3.31Å; L75-V77 PolarHBondContact O-N 3.2Å; L75-S78 WeakPolarHBondContact O-CB 3.24Å; L75-S78 PolarHBondContact O-N 3.21Å; L75-S78 VanDerWaalsContact O-N 3.09Å; L75-T79 PolarHBondContact O-N 3.17Å; L75-T79 PolarHBondContact O-OG1 2.68Å; L75-T79 VanDerWaalsContact O-OG1 3.12Å
76M89.4Confident85.3Confident103 Ų10346.8 Ų46.851%0.50727%0.266SS..Hα-helixtrans-56.3-48177.5-176.7-176.772.900110.6L72 F73 S78 T79 C80L72-M76 PolarHBondContact O-N 2.88Å; F73-M76 HydrophobicContact CD2-CE 3.58Å; F73-M76 HydrophobicContact CE2-CE 3.68Å; F73-M76 PolarHBondContact O-N 3.5Å; M76-S78 VanDerWaalsContact C-N 3.31Å; M76-S78 PolarHBondContact O-N 3.21Å; M76-T79 WeakPolarHBondContact O-CB 3.25Å; M76-T79 PolarHBondContact O-N 3.34Å; M76-T79 VanDerWaalsContact O-N 3.16Å; M76-C80 PolarHBondContact O-N 2.93Å; M76-C80 PolarHBondContact O-SG 3.43Å
77V86.8Confident83.9Confident11 Ų1146.1 Ų46.17%0.06727%0.268CS..Hα-helixtrans-61.8-40.2177.4179.80000111.2F73 L75 T79 C80 I81 I109 W113F73-V77 HydrophobicContact CD1-CG2 4.11Å; F73-V77 HydrophobicContact CE1-CG2 3.71Å; F73-V77 HydrophobicContact CE2-CG2 4.26Å; F73-V77 HydrophobicContact CZ-CG2 3.79Å; F73-V77 WeakPolarHBondContact O-CG2 3.36Å; F73-V77 PolarHBondContact O-N 2.94Å; L75-V77 VanDerWaalsContact C-N 3.31Å; L75-V77 PolarHBondContact O-N 3.2Å; V77-T79 VanDerWaalsContact C-N 3.33Å; V77-T79 PolarHBondContact O-N 2.99Å; V77-C80 PolarHBondContact O-N 3.4Å; V77-I81 HydrophobicContact CG1-CD1 3.69Å; V77-I81 HydrophobicContact CG1-CG1 4.15Å; V77-I81 VanDerWaalsContact O-CG1 3.25Å; V77-I81 WeakPolarHBondContact O-CG1 3.49Å; V77-I81 PolarHBondContact O-N 3.16Å; V77-I109 HydrophobicContact CG1-CG2 3.49Å; V77-I109 VanDerWaalsContact CG1-CG2 3.49Å; V77-W113 HydrophobicContact CB-CB 4.4Å; V77-W113 HydrophobicContact CG1-CB 3.67Å
78S85.4Confident82.4Confident7 Ų749.7 Ų49.75%0.04929%0.289CS..Hα-helixtrans-62.2-39.7175.8-58.40000112.6A74 L75 M76 C80 I81 L82A74-S78 WeakPolarHBondContact O-CB 3.25Å; A74-S78 PolarHBondContact O-N 3.39Å; A74-S78 PolarHBondContact O-OG 2.97Å; L75-S78 WeakPolarHBondContact O-CB 3.24Å; L75-S78 PolarHBondContact O-N 3.21Å; L75-S78 VanDerWaalsContact O-N 3.09Å; M76-S78 VanDerWaalsContact C-N 3.31Å; M76-S78 PolarHBondContact O-N 3.21Å; S78-C80 VanDerWaalsContact C-N 3.35Å; S78-I81 PolarHBondContact O-N 3.45Å; S78-L82 WeakPolarHBondContact O-CB 3.28Å; S78-L82 PolarHBondContact O-N 3.16Å
79T84.4Confident80.8Confident99 Ų9950.6 Ų50.661%0.60730%0.297SS*.Hα-helixtrans-65.2-36.9175-57.80000111.9L75 M76 V77 P83L75-T79 PolarHBondContact O-N 3.17Å; L75-T79 PolarHBondContact O-OG1 2.68Å; L75-T79 VanDerWaalsContact O-OG1 3.12Å; M76-T79 WeakPolarHBondContact O-CB 3.25Å; M76-T79 PolarHBondContact O-N 3.34Å; M76-T79 VanDerWaalsContact O-N 3.16Å; V77-T79 VanDerWaalsContact C-N 3.33Å; V77-T79 PolarHBondContact O-N 2.99Å; T79-P83 WeakPolarHBondContact O-CD 3.07Å
80C78.2Confident79.2Confident78 Ų7854.7 Ų54.753%0.52731%0.311SS..Hα-helixtrans-75.7-28.4178.5-62.20000113.5M76 V77 S78M76-C80 PolarHBondContact O-N 2.93Å; M76-C80 PolarHBondContact O-SG 3.43Å; V77-C80 PolarHBondContact O-N 3.4Å; S78-C80 VanDerWaalsContact C-N 3.35Å
81I79.8Confident77.6Confident5 Ų557.6 Ų57.63%0.02633%0.329CS..Hα-helixtrans-80.9-36.2-179.9-66.8172.3000111.6L23 V77 S78 N84 I85 I109 W113L23-I81 HydrophobicContact CD1-CB 3.87Å; L23-I81 HydrophobicContact CD1-CG2 3.47Å; L23-I81 VanDerWaalsContact CD1-CG2 3.47Å; L23-I81 HydrophobicContact CD2-CB 4.39Å; L23-I81 HydrophobicContact CD2-CD1 4.08Å; L23-I81 HydrophobicContact CD2-CG2 4.36Å; L23-I81 HydrophobicContact CG-CG2 4.44Å; V77-I81 HydrophobicContact CG1-CD1 3.69Å; V77-I81 HydrophobicContact CG1-CG1 4.15Å; V77-I81 VanDerWaalsContact O-CG1 3.25Å; V77-I81 WeakPolarHBondContact O-CG1 3.49Å; V77-I81 PolarHBondContact O-N 3.16Å; S78-I81 PolarHBondContact O-N 3.45Å; I81-N84 PolarHBondContact O-N 3.22Å; I81-I85 HydrophobicContact CG2-CD1 3.54Å; I81-I85 HydrophobicContact CG2-CG1 3.94Å; I81-I85 PolarHBondContact O-N 3.45Å; I81-I85 VanDerWaalsContact O-N 3.16Å; I81-I109 HydrophobicContact CD1-CG2 3.7Å; I81-I109 HydrophobicContact CG1-CB 4.44Å; I81-I109 HydrophobicContact CG1-CG2 3.46Å; I81-I109 VanDerWaalsContact CG1-CG2 3.46Å; I81-W113 HydrophobicContact CD1-CB 4.35Å
82L74.3Confident75.8Confident49 Ų4965 Ų6526%0.25736%0.363SS..Hα-helixtrans-58.8-44.5-169.9-171.366.1000114.5L23 S78 N84 I85 E86L23-L82 HydrophobicContact CD1-CD1 4.42Å; S78-L82 WeakPolarHBondContact O-CB 3.28Å; S78-L82 PolarHBondContact O-N 3.16Å; L82-N84 VanDerWaalsContact C-N 3.31Å; L82-N84 PolarHBondContact O-N 3.23Å; L82-I85 PolarHBondContact O-N 3.17Å; L82-E86 WeakPolarHBondContact O-CG 3.28Å; L82-E86 PolarHBondContact O-N 3.2Å
83P72.1Confident73.9Confident77 Ų7765.2 Ų65.250%0.537%0.365SS..Hα-helixtrans-61.8-38178.7-23.434.1000112.9T79 E86 A87T79-P83 WeakPolarHBondContact O-CD 3.07Å; P83-E86 PolarHBondContact O-N 3.47Å; P83-A87 WeakPolarHBondContact O-CB 3.41Å; P83-A87 PolarHBondContact O-N 3.2Å
84N69.3Low72Confident66 Ų6664.5 Ų64.535%0.35337%0.365SS..Hα-helixtrans-67-38.8177.5-77.1-27.9000111.7I81 L82 V88I81-N84 PolarHBondContact O-N 3.22Å; L82-N84 VanDerWaalsContact C-N 3.31Å; L82-N84 PolarHBondContact O-N 3.23Å; N84-V88 WeakPolarHBondContact O-CG2 3.45Å; N84-V88 PolarHBondContact O-N 3.37Å
85I71.1Confident70Confident10 Ų1071.3 Ų71.35%0.05140%0.401CS..Hα-helixtrans-66.8-40.5175-70.2-177.2000111.3L16 R20 L23 I81 L82 S89L16-I85 HydrophobicContact CD2-CG2 4.35Å; L16-I85 HydrophobicContact CG-CG2 4.05Å; R20-I85 HydrophobicContact CB-CG2 4.22Å; L23-I85 HydrophobicContact CD1-CD1 3.61Å; I81-I85 HydrophobicContact CG2-CD1 3.54Å; I81-I85 HydrophobicContact CG2-CG1 3.94Å; I81-I85 PolarHBondContact O-N 3.45Å; I81-I85 VanDerWaalsContact O-N 3.16Å; L82-I85 PolarHBondContact O-N 3.17Å; I85-S89 PolarHBondContact O-N 3.36Å; I85-S89 VanDerWaalsContact O-N 3.17Å
86E68.5Low67.9Low83 Ų8374.6 Ų74.639%0.38843%0.427SS..Hα-helixtrans-68.1-40.8179.1-71.5-175.716500111.9R20 L82 P83 V88 S89 N90R20-E86 IonicContact CZ-OE1 3.08Å; R20-E86 IonicContact NH1-OE1 3.67Å; R20-E86 PolarHBondContact NH1-OE1 2.94Å; R20-E86 IonicContact NH2-OE1 2.7Å; L82-E86 WeakPolarHBondContact O-CG 3.28Å; L82-E86 PolarHBondContact O-N 3.2Å; P83-E86 PolarHBondContact O-N 3.47Å; E86-V88 PolarHBondContact O-N 2.97Å; E86-S89 PolarHBondContact O-N 2.89Å; E86-S89 PolarHBondContact O-OG 3.23Å; E86-N90 PolarHBondContact O-N 3.46Å
87A67Low66Low57 Ų5774.1 Ų74.147%0.47143%0.43SS..Hα-helixtrans-60.4-43.3175.600000112.7P83 S89 N90P83-A87 WeakPolarHBondContact O-CB 3.41Å; P83-A87 PolarHBondContact O-N 3.2Å; A87-S89 VanDerWaalsContact C-N 3.31Å; A87-S89 PolarHBondContact O-N 3.5Å; A87-N90 PolarHBondContact O-N 3.32Å
88V64.8Low64.2Low75 Ų7582.8 Ų82.846%0.45547%0.466SS..Hα-helixtrans-67.6-30.9177.1175.20000112L16 N84 E86 N90L16-V88 HydrophobicContact CD1-CB 3.98Å; L16-V88 HydrophobicContact CD1-CG1 3.69Å; N84-V88 WeakPolarHBondContact O-CG2 3.45Å; N84-V88 PolarHBondContact O-N 3.37Å; E86-V88 PolarHBondContact O-N 2.97Å; V88-N90 VanDerWaalsContact C-N 3.32Å; V88-N90 PolarHBondContact O-N 2.93Å
89S59.9Low62.3Low41 Ų4191.6 Ų91.629%0.28751%0.507SS..Hα-helixtrans-73.4-23.1177.675.80000114.1I85 E86 A87I85-S89 PolarHBondContact O-N 3.36Å; I85-S89 VanDerWaalsContact O-N 3.17Å; E86-S89 PolarHBondContact O-N 2.89Å; E86-S89 PolarHBondContact O-OG 3.23Å; A87-S89 VanDerWaalsContact C-N 3.31Å; A87-S89 PolarHBondContact O-N 3.5Å
90N62.4Low60.3Low140 Ų14090.2 Ų90.275%0.74950%0.501SS*.Hα-helixtrans-88.4-25.5-174.3-160.926.2000112.9E86 A87 V88 H92E86-N90 PolarHBondContact O-N 3.46Å; A87-N90 PolarHBondContact O-N 3.32Å; V88-N90 VanDerWaalsContact C-N 3.32Å; V88-N90 PolarHBondContact O-N 2.93Å; N90-H92 PolarHBondContact O-N 2.99Å
91V60.2Low59Low88 Ų8892.2 Ų92.253%0.53351%0.514SS..  trans-92.699.6178.31780000109.5N93V91-N93 HydrophobicContact CG1-CB 4.12Å; V91-N93 PolarHBondContact O-N 3.27Å
92H56.4Low57.9Low155 Ų15595.1 Ų95.172%0.71853%0.527SS*.  trans-69.119.7179.4-127.782.1000114.8N90N90-H92 PolarHBondContact O-N 2.99Å
93N50.8Low57.2Low102 Ų102100 Ų10055%0.54555%0.548SS..  trans-123.385.1-172.8-159.8-27.2000110.8V91 N95V91-N93 HydrophobicContact CG1-CB 4.12Å; V91-N93 PolarHBondContact O-N 3.27Å; N93-N95 PolarHBondContact O-N 3.21Å; N93-N95 VanDerWaalsContact O-N 3.11Å
94L53.4Low56.7Low73 Ų73103.1 Ų103.138%0.38255%0.55SS..THydrogen-bonded Turntrans-70.50.1-174.5-70174.7000114.8Q9Q9-L94 HydrophobicContact CB-CD1 3.72Å; Q9-L94 VanDerWaalsContact CD-CD1 3.44Å; Q9-L94 HydrophobicContact CG-CD1 3.32Å
95N46.2Very low56.5Low143 Ų143104.6 Ų104.677%0.76556%0.556SS**THydrogen-bonded Turntrans-93.1-1.2-172.4-75.3-13.8000115N93N93-N95 PolarHBondContact O-N 3.21Å; N93-N95 VanDerWaalsContact O-N 3.11Å
96S45.9Very low56.5Low105 Ų105106 Ų10673%0.73456%0.562SS**SBendtrans-1220.4-178.1-156.40000115.2
97V49.2Very low56.7Low93 Ų93110.5 Ų110.556%0.56458%0.576SS**SBendtrans-102.411.8-174.7-178.20000112.6
98K47.9Very low57.1Low192 Ų192110.1 Ų110.184%0.83556%0.564SS**SBendtrans-90.41.7-177.5-117.1-179.5-178.9-177.60115.1
99E45.9Very low57.8Low192 Ų192109 Ų10990%0.89756%0.555SS**SBendtrans-128.330-165.3-134.1175.9-145.300115.2
100S44Very low58.8Low70 Ų70110 Ų11049%0.4956%0.555SS.*SBendtrans-124144.616786.50000112.5H102S100-H102 PolarHBondContact O-N 3.42Å; S100-H102 WeakPolarHBondContact OG-CB 3.34Å
101P49.6Very low59.7Low121 Ų121105.3 Ų105.379%0.78653%0.53SS*.THydrogen-bonded Turntrans-60.46.5175.823.1-32.5000114.7
102H56.4Low60.9Low66 Ų66102.3 Ų102.331%0.30652%0.515SS..Hα-helixtrans-68.5-32.8-179.9-172.1-86.4000114.2S100 R104 M105 H106S100-H102 PolarHBondContact O-N 3.42Å; S100-H102 WeakPolarHBondContact OG-CB 3.34Å; H102-R104 VanDerWaalsContact C-N 3.32Å; H102-R104 PolarHBondContact O-N 2.86Å; H102-M105 WeakPolarHBondContact O-CB 3.43Å; H102-M105 PolarHBondContact O-N 2.81Å; H102-M105 VanDerWaalsContact O-N 3.14Å; H102-H106 PolarHBondContact O-N 3.44Å
103E60.8Low62.4Low152 Ų15296.1 Ų96.171%0.7149%0.485SS*.Hα-helixtrans-60.3-42.8179.9-170.878.5-176.600111.4H106 R107E103-H106 PolarHBondContact O-N 3.19Å; E103-R107 PolarHBondContact O-N 3.34Å; E103-R107 VanDerWaalsContact O-N 3.15Å
104R61Low64.1Low141 Ų14192.2 Ų92.253%0.53247%0.467SS..Hα-helixtrans-63.9-46.5174.5-96.9-178.2160.9173.9-8.6110.4H102 H106 R107 H108H102-R104 VanDerWaalsContact C-N 3.32Å; H102-R104 PolarHBondContact O-N 2.86Å; R104-H106 VanDerWaalsContact C-N 3.32Å; R104-H106 PolarHBondContact O-N 3.14Å; R104-R107 PolarHBondContact O-N 3.43Å; R104-H108 PolarHBondContact O-CE1 2.98Å; R104-H108 PolarHBondContact O-N 3.35Å; R104-H108 PolarHBondContact O-ND1 2.89Å
105M64.8Low65.8Low97 Ų9790.8 Ų90.848%0.47846%0.458SS..Hα-helixtrans-58-44.3178.1-171.3171.171.200111.7H102 R107 H108 I109H102-M105 WeakPolarHBondContact O-CB 3.43Å; H102-M105 PolarHBondContact O-N 2.81Å; H102-M105 VanDerWaalsContact O-N 3.14Å; M105-R107 PolarHBondContact O-N 2.88Å; M105-H108 WeakPolarHBondContact O-CB 3.36Å; M105-H108 PolarHBondContact O-N 3.39Å; M105-H108 VanDerWaalsContact O-N 3.16Å; M105-I109 HydrophobicContact CG-CD1 4.27Å; M105-I109 WeakPolarHBondContact O-CG1 3.49Å; M105-I109 PolarHBondContact O-N 3.02Å
106H71.3Confident67.9Low39 Ų3984.3 Ų84.318%0.18142%0.424CS..Hα-helixtrans-62-39.6179.4-161.377.9000113.1H102 E103 R104 H108 I109 E110H102-H106 PolarHBondContact O-N 3.44Å; E103-H106 PolarHBondContact O-N 3.19Å; R104-H106 VanDerWaalsContact C-N 3.32Å; R104-H106 PolarHBondContact O-N 3.14Å; H106-H108 VanDerWaalsContact C-N 3.27Å; H106-H108 PolarHBondContact O-N 2.85Å; H106-I109 PolarHBondContact O-N 3.49Å; H106-I109 VanDerWaalsContact O-N 3.12Å; H106-E110 PolarHBondContact O-N 3.48Å
107R72.4Confident70Confident179 Ų17980.8 Ų80.868%0.67540%0.398SS*.Hα-helixtrans-61.5-34.1176.6-165.7174-173.8156.5-1.2112.7E103 R104 M105 L111E103-R107 PolarHBondContact O-N 3.34Å; E103-R107 VanDerWaalsContact O-N 3.15Å; R104-R107 PolarHBondContact O-N 3.43Å; M105-R107 PolarHBondContact O-N 2.88Å; R107-L111 VanDerWaalsContact O-CB 3.29Å; R107-L111 WeakPolarHBondContact O-CB 3.37Å; R107-L111 PolarHBondContact O-N 3.14Å
108H75Confident72Confident48 Ų4877.5 Ų77.522%0.22238%0.378CS..Hα-helixtrans-69.8-40174.8-63.379.6000111.4R104 M105 H106 L111 A112 H184R104-H108 PolarHBondContact O-CE1 2.98Å; R104-H108 PolarHBondContact O-N 3.35Å; R104-H108 PolarHBondContact O-ND1 2.89Å; M105-H108 WeakPolarHBondContact O-CB 3.36Å; M105-H108 PolarHBondContact O-N 3.39Å; M105-H108 VanDerWaalsContact O-N 3.16Å; H106-H108 VanDerWaalsContact C-N 3.27Å; H106-H108 PolarHBondContact O-N 2.85Å; H108-L111 PolarHBondContact O-N 3.2Å; H108-A112 VanDerWaalsContact O-CB 3.27Å; H108-A112 WeakPolarHBondContact O-CB 3.42Å; H108-A112 PolarHBondContact O-N 3.32Å; H108-H184 AromaticContact CD2-ND1 3.81Å; H108-H184 AromaticContact CE1-CE1 3.32Å; H108-H184 PolarHBondContact CE1-CE1 3.33Å; H108-H184 AromaticContact CE1-ND1 3.36Å; H108-H184 PolarHBondContact CE1-ND1 3.46Å; H108-H184 AromaticContact NE2-CE1 3.36Å; H108-H184 PolarHBondContact NE2-CE1 3.22Å; H108-H184 AromaticContact NE2-ND1 2.87Å; H108-H184 PolarHBondContact NE2-ND1 3.41Å
109I79.4Confident74.2Confident52 Ų5270.5 Ų70.527%0.26735%0.349SS..Hα-helixtrans-66.4-42.4178.5-57.2171.1000109.6V77 I81 M105 H106 L111 A112 W113V77-I109 HydrophobicContact CG1-CG2 3.49Å; V77-I109 VanDerWaalsContact CG1-CG2 3.49Å; I81-I109 HydrophobicContact CD1-CG2 3.7Å; I81-I109 HydrophobicContact CG1-CB 4.44Å; I81-I109 HydrophobicContact CG1-CG2 3.46Å; I81-I109 VanDerWaalsContact CG1-CG2 3.46Å; M105-I109 HydrophobicContact CG-CD1 4.27Å; M105-I109 WeakPolarHBondContact O-CG1 3.49Å; M105-I109 PolarHBondContact O-N 3.02Å; H106-I109 PolarHBondContact O-N 3.49Å; H106-I109 VanDerWaalsContact O-N 3.12Å; I109-L111 VanDerWaalsContact C-N 3.34Å; I109-L111 PolarHBondContact O-N 2.86Å; I109-A112 PolarHBondContact O-N 3.3Å; I109-W113 WeakPolarHBondContact O-CB 3.47Å; I109-W113 PolarHBondContact O-N 3.49Å
110E81.7Confident76.4Confident61 Ų6161.3 Ų61.329%0.28531%0.306SS..Hα-helixtrans-62.8-40.3173.4-170.9-179.7-178.200111.6K22 H106 W113 A114K22-E110 IonicContact NZ-OE1 3.74Å; K22-E110 PolarHBondContact NZ-OE1 3Å; K22-E110 VanDerWaalsContact NZ-OE1 3.08Å; H106-E110 PolarHBondContact O-N 3.48Å; E110-W113 HydrophobicContact CG-CE3 4.13Å; E110-W113 WeakPolarHBondContact O-CB 3.28Å; E110-W113 PolarHBondContact O-N 3.32Å; E110-A114 WeakPolarHBondContact O-CB 3.42Å; E110-A114 PolarHBondContact O-N 2.95Å
111L82.1Confident78.7Confident42 Ų4260 Ų6022%0.2230%0.295CS..Hα-helixtrans-72.1-36.8-179.8-153.2143.2000112.1R107 H108 I109 A114 F115 L181R107-L111 VanDerWaalsContact O-CB 3.29Å; R107-L111 WeakPolarHBondContact O-CB 3.37Å; R107-L111 PolarHBondContact O-N 3.14Å; H108-L111 PolarHBondContact O-N 3.2Å; I109-L111 VanDerWaalsContact C-N 3.34Å; I109-L111 PolarHBondContact O-N 2.86Å; L111-A114 PolarHBondContact O-N 3.46Å; L111-F115 VanDerWaalsContact O-CB 3.26Å; L111-F115 WeakPolarHBondContact O-CB 3.45Å; L111-F115 PolarHBondContact O-N 3.02Å; L111-L181 HydrophobicContact CB-CD2 4.32Å; L111-L181 HydrophobicContact CD2-CB 4.22Å; L111-L181 HydrophobicContact CD2-CD1 4.2Å; L111-L181 HydrophobicContact CD2-CD2 3.19Å; L111-L181 HydrophobicContact CD2-CG 3.21Å; L111-L181 HydrophobicContact CG-CD2 4.34Å
112A84.3Confident80.8Confident26 Ų2656.4 Ų56.422%0.21527%0.269CS..Hα-helixtrans-65-40.2171.500000112H108 I109 S116H108-A112 VanDerWaalsContact O-CB 3.27Å; H108-A112 WeakPolarHBondContact O-CB 3.42Å; H108-A112 PolarHBondContact O-N 3.32Å; I109-A112 PolarHBondContact O-N 3.3Å; A112-S116 WeakPolarHBondContact O-CB 3.46Å; A112-S116 PolarHBondContact O-N 3.35Å; A112-S116 PolarHBondContact O-OG 3.35Å
113W88.4Confident82.7Confident24 Ų2454.6 Ų54.69%0.09126%0.261CS..Hα-helixtrans-58-55.1171.5164.775000111K22 S26 V77 I81 I109 E110 F115 S116 T117K22-W113 HydrophobicContact CB-CH2 4.01Å; K22-W113 HydrophobicContact CB-CZ2 4.37Å; K22-W113 HydrophobicContact CD-CH2 4.48Å; K22-W113 VanDerWaalsContact CE-CH2 3.42Å; K22-W113 VanDerWaalsContact CE-CZ3 3.44Å; K22-W113 HydrophobicContact CG-CH2 4.48Å; S26-W113 VanDerWaalsContact CB-NE1 3.34Å; S26-W113 PolarHBondContact OG-NE1 3.33Å; V77-W113 HydrophobicContact CB-CB 4.4Å; V77-W113 HydrophobicContact CG1-CB 3.67Å; I81-W113 HydrophobicContact CD1-CB 4.35Å; I109-W113 WeakPolarHBondContact O-CB 3.47Å; I109-W113 PolarHBondContact O-N 3.49Å; E110-W113 HydrophobicContact CG-CE3 4.13Å; E110-W113 WeakPolarHBondContact O-CB 3.28Å; E110-W113 PolarHBondContact O-N 3.32Å; W113-F115 VanDerWaalsContact C-N 3.31Å; W113-F115 PolarHBondContact O-N 2.97Å; W113-S116 PolarHBondContact O-N 3.09Å; W113-S116 VanDerWaalsContact O-N 3.12Å; W113-T117 PolarHBondContact O-N 3.43Å; W113-T117 PolarHBondContact O-OG1 2.95Å
114A87.1Confident84.3Confident20 Ų2050 Ų5017%0.16524%0.239CC..Hα-helixtrans-59.3-42.9-178.600000111.9E110 L111 S116 T117 V118E110-A114 WeakPolarHBondContact O-CB 3.42Å; E110-A114 PolarHBondContact O-N 2.95Å; L111-A114 PolarHBondContact O-N 3.46Å; A114-S116 VanDerWaalsContact C-N 3.34Å; A114-S116 PolarHBondContact O-N 2.88Å; A114-T117 PolarHBondContact O-N 3.49Å; A114-V118 WeakPolarHBondContact O-CG2 3.16Å; A114-V118 PolarHBondContact O-N 2.83Å
115F88.3Confident85.9Confident44 Ų4444.8 Ų44.819%0.19322%0.222CC..Hα-helixtrans-59.5-43.9176177.3-109000112.4L111 W113 T117 V118 I119 F177 Y178 L181L111-F115 VanDerWaalsContact O-CB 3.26Å; L111-F115 WeakPolarHBondContact O-CB 3.45Å; L111-F115 PolarHBondContact O-N 3.02Å; W113-F115 VanDerWaalsContact C-N 3.31Å; W113-F115 PolarHBondContact O-N 2.97Å; F115-T117 VanDerWaalsContact C-N 3.35Å; F115-T117 PolarHBondContact O-N 3.34Å; F115-V118 PolarHBondContact O-N 3.41Å; F115-I119 HydrophobicContact CD1-CD1 3.98Å; F115-I119 HydrophobicContact CD2-CD1 4.2Å; F115-I119 HydrophobicContact CD2-CG1 4.43Å; F115-I119 HydrophobicContact CE1-CD1 3.32Å; F115-I119 HydrophobicContact CE1-CG1 4.37Å; F115-I119 HydrophobicContact CE2-CD1 3.56Å; F115-I119 HydrophobicContact CE2-CG1 4.13Å; F115-I119 HydrophobicContact CG-CD1 4.4Å; F115-I119 HydrophobicContact CZ-CD1 3.11Å; F115-I119 HydrophobicContact CZ-CG1 4.14Å; F115-I119 PolarHBondContact O-N 3.11Å; F115-F177 HydrophobicContact CD2-CB 4.07Å; F115-Y178 HydrophobicContact CE2-CD2 4.43Å; F115-Y178 HydrophobicContact CZ-CD2 4.28Å; F115-L181 HydrophobicContact CB-CD1 4.04Å; F115-L181 HydrophobicContact CD1-CD1 3.9Å; F115-L181 HydrophobicContact CD2-CD1 4.02Å; F115-L181 HydrophobicContact CE1-CD1 4.25Å; F115-L181 HydrophobicContact CE2-CD1 4.38Å; F115-L181 HydrophobicContact CG-CD1 3.73Å; F115-L181 HydrophobicContact CZ-CD1 4.44Å
116S90.6Very high87.3Confident7 Ų741.9 Ų41.95%0.04921%0.213CC..Hα-helixtrans-67.7-36.5179.9-53.20000111.7V70 F73 A112 W113 A114 G120V70-S116 WeakPolarHBondContact CG1-O 3.1Å; F73-S116 WeakPolarHBondContact CD1-OG 3.5Å; F73-S116 WeakPolarHBondContact CE1-OG 3.43Å; A112-S116 WeakPolarHBondContact O-CB 3.46Å; A112-S116 PolarHBondContact O-N 3.35Å; A112-S116 PolarHBondContact O-OG 3.35Å; W113-S116 PolarHBondContact O-N 3.09Å; W113-S116 VanDerWaalsContact O-N 3.12Å; A114-S116 VanDerWaalsContact C-N 3.34Å; A114-S116 PolarHBondContact O-N 2.88Å; S116-G120 PolarHBondContact O-N 3.15Å
117T90.9Very high88.4Confident31 Ų3140.1 Ų40.119%0.1921%0.205CC..Hα-helixtrans-64.1-41.7172.3-51.30000111.7W113 A114 F115 T121W113-T117 PolarHBondContact O-N 3.43Å; W113-T117 PolarHBondContact O-OG1 2.95Å; A114-T117 PolarHBondContact O-N 3.49Å; F115-T117 VanDerWaalsContact C-N 3.35Å; F115-T117 PolarHBondContact O-N 3.34Å; T117-T121 WeakPolarHBondContact O-CB 3.45Å; T117-T121 PolarHBondContact O-N 2.83Å; T117-T121 PolarHBondContact O-OG1 2.96Å
118V91.2Very high89.4Confident24 Ų2433.9 Ų33.915%0.14519%0.186CC..Hα-helixtrans-66.8-47.1178.9172.60000111.2A114 F115 T121 L122 F173 A174 F177A114-V118 WeakPolarHBondContact O-CG2 3.16Å; A114-V118 PolarHBondContact O-N 2.83Å; F115-V118 PolarHBondContact O-N 3.41Å; V118-T121 PolarHBondContact O-N 3.31Å; V118-L122 PolarHBondContact O-N 2.87Å; V118-F173 HydrophobicContact CG1-CB 4.41Å; V118-A174 HydrophobicContact CG1-CB 4.09Å; V118-F177 HydrophobicContact CG2-CD2 4.04Å; V118-F177 HydrophobicContact CG2-CE2 3.97Å
119I92.2Very high90.4Very high44 Ų4432.6 Ų32.623%0.22618%0.182CC..Hα-helixtrans-63-44.9176.6-70.9-172.2000111.1V70 F115 T121 L122 L123V70-I119 HydrophobicContact CG1-CB 4.17Å; V70-I119 HydrophobicContact CG1-CG2 4Å; V70-I119 HydrophobicContact CG2-CG2 4.06Å; F115-I119 HydrophobicContact CD1-CD1 3.98Å; F115-I119 HydrophobicContact CD2-CD1 4.2Å; F115-I119 HydrophobicContact CD2-CG1 4.43Å; F115-I119 HydrophobicContact CE1-CD1 3.32Å; F115-I119 HydrophobicContact CE1-CG1 4.37Å; F115-I119 HydrophobicContact CE2-CD1 3.56Å; F115-I119 HydrophobicContact CE2-CG1 4.13Å; F115-I119 HydrophobicContact CG-CD1 4.4Å; F115-I119 HydrophobicContact CZ-CD1 3.11Å; F115-I119 HydrophobicContact CZ-CG1 4.14Å; F115-I119 PolarHBondContact O-N 3.11Å; I119-T121 VanDerWaalsContact C-N 3.29Å; I119-T121 PolarHBondContact O-N 3.31Å; I119-L122 PolarHBondContact O-N 2.95Å; I119-L122 VanDerWaalsContact O-N 3.14Å; I119-L123 HydrophobicContact CG2-CD1 3.72Å; I119-L123 HydrophobicContact CG2-CG 4.18Å; I119-L123 WeakPolarHBondContact O-CB 3.19Å; I119-L123 WeakPolarHBondContact O-CG 3.1Å; I119-L123 PolarHBondContact O-N 3.32Å
120G93.7Very high91.1Very high0 Ų031.5 Ų31.50%018%0.176CC..Hα-helixtrans-58.6-42.917700000111.7L67 S116 L122 L123 F124L67-G120 WeakPolarHBondContact CD1-O 3.37Å; S116-G120 PolarHBondContact O-N 3.15Å; G120-L122 PolarHBondContact O-N 3.42Å; G120-L123 PolarHBondContact O-N 3.3Å; G120-F124 WeakPolarHBondContact O-CB 3.32Å; G120-F124 PolarHBondContact O-N 3.47Å
121T92.6Very high91.6Very high42 Ų4230.3 Ų30.326%0.25817%0.172SC..Hα-helixtrans-62.5-41.1175.1-50.20000112.3T117 V118 I119 F124 L125 F170T117-T121 WeakPolarHBondContact O-CB 3.45Å; T117-T121 PolarHBondContact O-N 2.83Å; T117-T121 PolarHBondContact O-OG1 2.96Å; V118-T121 PolarHBondContact O-N 3.31Å; I119-T121 VanDerWaalsContact C-N 3.29Å; I119-T121 PolarHBondContact O-N 3.31Å; T121-F124 PolarHBondContact O-N 3.38Å; T121-L125 PolarHBondContact O-N 3.45Å; T121-L125 VanDerWaalsContact O-N 3.09Å; T121-F170 HydrophobicContact CG2-CD1 4.44Å; T121-F170 HydrophobicContact CG2-CE1 3.69Å; T121-F170 HydrophobicContact CG2-CE2 4.37Å; T121-F170 HydrophobicContact CG2-CZ 3.66Å
122L93.7Very high92.2Very high46 Ų4629.4 Ų29.424%0.24117%0.169CC..Hα-helixtrans-65.5-43176.9-177.5154.2000111.7V118 I119 G120 F124 L125 A126 F170 I171V118-L122 PolarHBondContact O-N 2.87Å; I119-L122 PolarHBondContact O-N 2.95Å; I119-L122 VanDerWaalsContact O-N 3.14Å; G120-L122 PolarHBondContact O-N 3.42Å; L122-F124 VanDerWaalsContact C-N 3.31Å; L122-F124 PolarHBondContact O-N 2.9Å; L122-L125 VanDerWaalsContact O-CB 3.3Å; L122-L125 WeakPolarHBondContact O-CB 3.5Å; L122-L125 PolarHBondContact O-N 2.99Å; L122-A126 PolarHBondContact O-N 3.39Å; L122-F170 HydrophobicContact CB-CB 4.38Å; L122-F170 HydrophobicContact CD1-CB 4.11Å; L122-I171 HydrophobicContact CD1-CG1 3.68Å
123L94.8Very high92.5Very high27 Ų2731.5 Ų31.514%0.14117%0.171CC..Hα-helixtrans-65.9-34.9176.3-71.9171.2000111.6V66 L67 V70 I119 G120 L125 A126 E127V66-L123 HydrophobicContact CB-CD1 4.22Å; V66-L123 HydrophobicContact CG1-CD1 3.58Å; L67-L123 HydrophobicContact CB-CB 4Å; L67-L123 HydrophobicContact CD1-CB 3.64Å; L67-L123 HydrophobicContact CG-CB 4.41Å; V70-L123 HydrophobicContact CG2-CD1 4.15Å; I119-L123 HydrophobicContact CG2-CD1 3.72Å; I119-L123 HydrophobicContact CG2-CG 4.18Å; I119-L123 WeakPolarHBondContact O-CB 3.19Å; I119-L123 WeakPolarHBondContact O-CG 3.1Å; I119-L123 PolarHBondContact O-N 3.32Å; G120-L123 PolarHBondContact O-N 3.3Å; L123-L125 VanDerWaalsContact C-N 3.29Å; L123-L125 PolarHBondContact O-N 2.77Å; L123-A126 PolarHBondContact O-N 2.91Å; L123-E127 WeakPolarHBondContact O-CB 3.43Å; L123-E127 PolarHBondContact O-N 2.98Å
124F94.8Very high92.7Very high56 Ų5630.4 Ų30.425%0.24617%0.167CC..Hα-helixtrans-64.9-38.6175-176-96.9000110.8L33 L67 G120 T121 L122 E127 V128L33-F124 HydrophobicContact CB-CD2 4.17Å; L33-F124 HydrophobicContact CB-CE2 4.38Å; L33-F124 HydrophobicContact CD2-CD1 4.04Å; L33-F124 HydrophobicContact CD2-CD2 3.97Å; L33-F124 HydrophobicContact CD2-CE1 3.86Å; L33-F124 HydrophobicContact CD2-CE2 3.79Å; L33-F124 HydrophobicContact CD2-CG 4.1Å; L33-F124 HydrophobicContact CD2-CZ 3.73Å; L67-F124 HydrophobicContact CD1-CB 3.92Å; L67-F124 HydrophobicContact CD2-CB 4.46Å; L67-F124 HydrophobicContact CD2-CD2 4.25Å; G120-F124 WeakPolarHBondContact O-CB 3.32Å; G120-F124 PolarHBondContact O-N 3.47Å; T121-F124 PolarHBondContact O-N 3.38Å; L122-F124 VanDerWaalsContact C-N 3.31Å; L122-F124 PolarHBondContact O-N 2.9Å; F124-E127 WeakPolarHBondContact O-CB 3.32Å; F124-E127 PolarHBondContact O-N 3.27Å; F124-V128 HydrophobicContact CE1-CG2 4.17Å; F124-V128 HydrophobicContact CZ-CG2 4.45Å; F124-V128 WeakPolarHBondContact O-CG2 3.45Å; F124-V128 PolarHBondContact O-N 3.45Å; F124-V128 VanDerWaalsContact O-N 3.09Å
125L94.2Very high92.9Very high32 Ų3236.3 Ų36.317%0.16819%0.189CC..Hα-helixtrans-62.9-45.3173.9-160.873.7000111.8T121 L122 L123 E127 V128 V129 M163 F166 F170T121-L125 PolarHBondContact O-N 3.45Å; T121-L125 VanDerWaalsContact O-N 3.09Å; L122-L125 VanDerWaalsContact O-CB 3.3Å; L122-L125 WeakPolarHBondContact O-CB 3.5Å; L122-L125 PolarHBondContact O-N 2.99Å; L123-L125 VanDerWaalsContact C-N 3.29Å; L123-L125 PolarHBondContact O-N 2.77Å; L125-E127 VanDerWaalsContact C-N 3.34Å; L125-V128 PolarHBondContact O-N 2.92Å; L125-V129 PolarHBondContact O-N 2.79Å; L125-M163 HydrophobicContact CD1-CE 4.22Å; L125-M163 HydrophobicContact CD1-CG 3.56Å; L125-M163 HydrophobicContact CD1-SD 3.25Å; L125-M163 WeakPolarHBondContact CD1-SD 3.35Å; L125-M163 HydrophobicContact CD2-CG 3.87Å; L125-M163 HydrophobicContact CG-CG 3.43Å; L125-M163 VanDerWaalsContact CG-CG 3.43Å; L125-M163 HydrophobicContact CG-SD 3.89Å; L125-F166 HydrophobicContact CD2-CB 4.04Å; L125-F170 HydrophobicContact CD2-CD2 4.39Å
126A94.6Very high92.9Very high35 Ų3537.6 Ų37.629%0.28920%0.195SC..Hα-helixtrans-63.4-39.7176.100000111.8L122 L123 V128 V129 L130L122-A126 PolarHBondContact O-N 3.39Å; L123-A126 PolarHBondContact O-N 2.91Å; A126-V128 PolarHBondContact O-N 2.89Å; A126-V129 WeakPolarHBondContact O-CB 3.46Å; A126-V129 PolarHBondContact O-N 3.09Å; A126-L130 WeakPolarHBondContact O-CG 3.25Å; A126-L130 PolarHBondContact O-N 2.91Å
127E94.8Very high92.7Very high2 Ų238.2 Ų38.21%0.00920%0.197CC..Hα-helixtrans-58.7-46.6176.4-172.870.3179.900111.5A37 F60 C63 T64 L67 L123 F124 L125 V129 L130 L131A37-E127 HydrophobicContact CB-CG 4.44Å; F60-E127 WeakPolarHBondContact CE2-OE1 3.32Å; C63-E127 PolarHBondContact SG-OE2 3.42Å; T64-E127 WeakPolarHBondContact CB-OE1 3.04Å; T64-E127 WeakPolarHBondContact CG2-OE1 3.18Å; T64-E127 PolarHBondContact N-OE2 2.96Å; T64-E127 PolarHBondContact OG1-OE1 3.39Å; T64-E127 PolarHBondContact OG1-OE2 3.2Å; L67-E127 HydrophobicContact CD2-CB 4.05Å; L67-E127 HydrophobicContact CD2-CG 4.11Å; L123-E127 WeakPolarHBondContact O-CB 3.43Å; L123-E127 PolarHBondContact O-N 2.98Å; F124-E127 WeakPolarHBondContact O-CB 3.32Å; F124-E127 PolarHBondContact O-N 3.27Å; L125-E127 VanDerWaalsContact C-N 3.34Å; E127-V129 VanDerWaalsContact C-N 3.29Å; E127-V129 PolarHBondContact O-N 3.01Å; E127-L130 PolarHBondContact O-N 3.4Å; E127-L131 HydrophobicContact CG-CD1 4.29Å; E127-L131 WeakPolarHBondContact O-CB 3.07Å; E127-L131 VanDerWaalsContact O-CG 3.31Å; E127-L131 WeakPolarHBondContact O-CG 3.37Å; E127-L131 PolarHBondContact O-N 3.13Å
128V93.9Very high92.3Very high48 Ų4838.2 Ų38.229%0.29120%0.198SC..Hα-helixtrans-60.2-40.8176.8172.40000111.3F124 L125 A126 L131 C132 M163F124-V128 HydrophobicContact CE1-CG2 4.17Å; F124-V128 HydrophobicContact CZ-CG2 4.45Å; F124-V128 WeakPolarHBondContact O-CG2 3.45Å; F124-V128 PolarHBondContact O-N 3.45Å; F124-V128 VanDerWaalsContact O-N 3.09Å; L125-V128 PolarHBondContact O-N 2.92Å; A126-V128 PolarHBondContact O-N 2.89Å; V128-L131 PolarHBondContact O-N 2.99Å; V128-C132 PolarHBondContact O-N 3.09Å; V128-C132 PolarHBondContact O-SG 3.24Å; V128-C132 VanDerWaalsContact O-SG 3.35Å; V128-M163 HydrophobicContact CB-CE 4.37Å; V128-M163 HydrophobicContact CG1-CE 3.77Å
129V94.5Very high91.8Very high22 Ų2240.9 Ų40.913%0.13321%0.211CC..Hα-helixtrans-64.1-49.2175.8172.30000110.6L125 A126 E127 L131 C132 W133 T160 M163L125-V129 PolarHBondContact O-N 2.79Å; A126-V129 WeakPolarHBondContact O-CB 3.46Å; A126-V129 PolarHBondContact O-N 3.09Å; E127-V129 VanDerWaalsContact C-N 3.29Å; E127-V129 PolarHBondContact O-N 3.01Å; V129-L131 VanDerWaalsContact C-N 3.3Å; V129-L131 PolarHBondContact O-N 3.36Å; V129-C132 WeakPolarHBondContact O-CB 3.46Å; V129-C132 PolarHBondContact O-N 3.12Å; V129-C132 VanDerWaalsContact O-N 3.09Å; V129-W133 PolarHBondContact O-N 2.73Å; V129-T160 HydrophobicContact CG1-CG2 4.22Å; V129-T160 WeakPolarHBondContact CG1-OG1 3.3Å; V129-M163 HydrophobicContact CG2-CB 3.72Å; V129-M163 HydrophobicContact CG2-CE 4.49Å; V129-M163 HydrophobicContact CG2-CG 3.75Å
130L94.4Very high90.5Very high28 Ų2847.4 Ų47.415%0.14724%0.237CC..Hα-helixtrans-60.6-39178.8-70.3167.6000111.8L56 A59 F60 C63 A126 E127 C132 W133 V134L56-L130 HydrophobicContact CD1-CD2 3.94Å; A59-L130 HydrophobicContact CB-CD2 4.22Å; F60-L130 HydrophobicContact CB-CB 4.49Å; F60-L130 HydrophobicContact CD2-CB 3.94Å; C63-L130 HydrophobicContact CB-CD1 3.51Å; A126-L130 WeakPolarHBondContact O-CG 3.25Å; A126-L130 PolarHBondContact O-N 2.91Å; E127-L130 PolarHBondContact O-N 3.4Å; L130-C132 PolarHBondContact O-N 3.42Å; L130-W133 WeakPolarHBondContact O-CB 3.34Å; L130-W133 PolarHBondContact O-N 3.22Å; L130-V134 WeakPolarHBondContact O-CG2 3.23Å; L130-V134 PolarHBondContact O-N 3.44Å
131L93.4Very high89Confident36 Ų3651.1 Ų51.119%0.18826%0.262CS..Hα-helixtrans-60.7-42.7173-76.7171.7000112.1A40 V44 F60 E127 V128 V129 W133 V134 K135A40-L131 HydrophobicContact CB-CD1 3.76Å; A40-L131 HydrophobicContact CB-CD2 4.46Å; V44-L131 HydrophobicContact CG2-CD2 4.39Å; F60-L131 HydrophobicContact CD2-CD2 4.47Å; F60-L131 HydrophobicContact CE2-CD2 3.36Å; F60-L131 HydrophobicContact CE2-CG 3.73Å; F60-L131 HydrophobicContact CZ-CD2 3.48Å; F60-L131 VanDerWaalsContact CZ-CD2 3.48Å; F60-L131 HydrophobicContact CZ-CG 4.35Å; E127-L131 HydrophobicContact CG-CD1 4.29Å; E127-L131 WeakPolarHBondContact O-CB 3.07Å; E127-L131 VanDerWaalsContact O-CG 3.31Å; E127-L131 WeakPolarHBondContact O-CG 3.37Å; E127-L131 PolarHBondContact O-N 3.13Å; V128-L131 PolarHBondContact O-N 2.99Å; V129-L131 VanDerWaalsContact C-N 3.3Å; V129-L131 PolarHBondContact O-N 3.36Å; L131-W133 VanDerWaalsContact C-N 3.32Å; L131-W133 PolarHBondContact O-N 3.32Å; L131-V134 PolarHBondContact O-N 2.91Å; L131-K135 WeakPolarHBondContact O-CB 3.3Å; L131-K135 PolarHBondContact O-N 3.2Å
132C92.9Very high87.4Confident23 Ų2354.8 Ų54.816%0.15528%0.279CS..Hα-helixtrans-60.5-43.5174-69.20000111.3V128 V129 L130 F136 S159V128-C132 PolarHBondContact O-N 3.09Å; V128-C132 PolarHBondContact O-SG 3.24Å; V128-C132 VanDerWaalsContact O-SG 3.35Å; V129-C132 WeakPolarHBondContact O-CB 3.46Å; V129-C132 PolarHBondContact O-N 3.12Å; V129-C132 VanDerWaalsContact O-N 3.09Å; L130-C132 PolarHBondContact O-N 3.42Å; C132-F136 HydrophobicContact CB-CD2 3.94Å; C132-F136 HydrophobicContact CB-CE2 4.12Å; C132-F136 WeakPolarHBondContact O-CB 3.4Å; C132-F136 WeakPolarHBondContact O-CD2 3.47Å; C132-F136 PolarHBondContact O-N 3.25Å; C132-S159 PolarHBondContact SG-OG 3.34Å; C132-S159 VanDerWaalsContact SG-OG 3.34Å
133W92.4Very high85.5Confident70 Ų7062.1 Ų62.127%0.26531%0.313SS..Hα-helixtrans-61.7-51.6175.7-7997.2000111.5L56 V129 L130 L131 K135 L137 A156 I157 T160L56-W133 HydrophobicContact CD1-CB 3.76Å; L56-W133 HydrophobicContact CD1-CG 4.47Å; L56-W133 HydrophobicContact CD2-CB 4.19Å; V129-W133 PolarHBondContact O-N 2.73Å; L130-W133 WeakPolarHBondContact O-CB 3.34Å; L130-W133 PolarHBondContact O-N 3.22Å; L131-W133 VanDerWaalsContact C-N 3.32Å; L131-W133 PolarHBondContact O-N 3.32Å; W133-K135 VanDerWaalsContact C-N 3.31Å; W133-K135 PolarHBondContact O-N 2.99Å; W133-L137 HydrophobicContact CE3-CD1 4.35Å; W133-L137 HydrophobicContact CZ3-CD1 4.46Å; W133-L137 WeakPolarHBondContact O-CB 3.33Å; W133-L137 PolarHBondContact O-N 3.28Å; W133-L137 VanDerWaalsContact O-N 3.15Å; W133-A156 HydrophobicContact CD2-CB 3.74Å; W133-A156 HydrophobicContact CE3-CB 3.97Å; W133-A156 HydrophobicContact CG-CB 4.12Å; W133-A156 HydrophobicContact CZ2-CB 4.3Å; W133-A156 HydrophobicContact CZ3-CB 4.34Å; W133-I157 HydrophobicContact CH2-CG1 3.91Å; W133-I157 HydrophobicContact CZ2-CG1 4.13Å; W133-T160 PolarHBondContact NE1-OG1 2.93Å
134V92.4Very high83.7Confident1 Ų164.5 Ų64.51%0.00633%0.331CS..Hα-helixtrans-60.3-41-179.8171.60000111.8V44 L46 Y52 L56 F60 L130 L131V44-V134 HydrophobicContact CG2-CG1 3.71Å; L46-V134 HydrophobicContact CD2-CG1 3.3Å; Y52-V134 WeakPolarHBondContact CE1-O 2.94Å; L56-V134 HydrophobicContact CD1-CG2 4.44Å; L56-V134 HydrophobicContact CD2-CG2 4.13Å; L56-V134 HydrophobicContact CG-CG2 4.06Å; F60-V134 HydrophobicContact CB-CG2 4.32Å; F60-V134 HydrophobicContact CD1-CG2 4.46Å; F60-V134 HydrophobicContact CG-CG2 4.2Å; L130-V134 WeakPolarHBondContact O-CG2 3.23Å; L130-V134 PolarHBondContact O-N 3.44Å; L131-V134 PolarHBondContact O-N 2.91Å
135K90.6Very high81.6Confident144 Ų14467.4 Ų67.463%0.62635%0.35SS*.Hα-helixtrans-79.5-38-174.8-172.2154-176.1150.30114.3L131 W133L131-K135 WeakPolarHBondContact O-CB 3.3Å; L131-K135 PolarHBondContact O-N 3.2Å; W133-K135 VanDerWaalsContact C-N 3.31Å; W133-K135 PolarHBondContact O-N 2.99Å
136F88.1Confident79.7Confident72 Ų7274.6 Ų74.632%0.31639%0.388SS..Hα-helixtrans-94.4-18.7-173.4-62.7-59.2000113.7C132 P138 I139 G152 A155C132-F136 HydrophobicContact CB-CD2 3.94Å; C132-F136 HydrophobicContact CB-CE2 4.12Å; C132-F136 WeakPolarHBondContact O-CB 3.4Å; C132-F136 WeakPolarHBondContact O-CD2 3.47Å; C132-F136 PolarHBondContact O-N 3.25Å; F136-P138 VanDerWaalsContact C-CD 3.46Å; F136-I139 HydrophobicContact CB-CD1 4.41Å; F136-I139 HydrophobicContact CD1-CD1 3.64Å; F136-I139 HydrophobicContact CE1-CD1 4.47Å; F136-I139 WeakPolarHBondContact O-CB 3.33Å; F136-I139 WeakPolarHBondContact O-CG1 3.42Å; F136-I139 PolarHBondContact O-N 3.36Å; F136-I139 VanDerWaalsContact O-N 3.14Å; F136-G152 WeakPolarHBondContact CB-O 3.3Å; F136-G152 WeakPolarHBondContact O-CA 3.44Å; F136-A155 HydrophobicContact CD2-CB 4.49Å; F136-A155 HydrophobicContact CG-CB 4.4Å
137L85.9Confident77.9Confident19 Ų1976.5 Ų76.510%0.09940%0.399CS..THydrogen-bonded Turntrans-57.9-36.5-178.4-165.270.6000115.2Y50 Y52 P53 L56 W133 I139 V153Y50-L137 HydrophobicContact CE1-CB 4.45Å; Y50-L137 HydrophobicContact CE1-CD2 3.75Å; Y50-L137 HydrophobicContact CE1-CG 3.84Å; Y50-L137 WeakPolarHBondContact OH-CG 3.39Å; Y50-L137 PolarHBondContact OH-O 3.27Å; Y52-L137 HydrophobicContact CD1-CD2 4.3Å; P53-L137 HydrophobicContact CG-CD2 4.26Å; L56-L137 HydrophobicContact CD2-CD2 3.94Å; W133-L137 HydrophobicContact CE3-CD1 4.35Å; W133-L137 HydrophobicContact CZ3-CD1 4.46Å; W133-L137 WeakPolarHBondContact O-CB 3.33Å; W133-L137 PolarHBondContact O-N 3.28Å; W133-L137 VanDerWaalsContact O-N 3.15Å; L137-I139 VanDerWaalsContact C-N 3.27Å; L137-I139 PolarHBondContact O-N 2.99Å; L137-V153 HydrophobicContact CD1-CG2 3.93Å
138P83.9Confident76.1Confident32 Ų3283 Ų8321%0.20844%0.439CS..THydrogen-bonded Turntrans-74.6-10.2178.1-17.532.5000115Y50 Y52 F136 K140Y50-P138 HydrophobicContact CD1-CG 4.21Å; Y50-P138 HydrophobicContact CD2-CB 4.01Å; Y50-P138 HydrophobicContact CE2-CB 4.48Å; Y50-P138 HydrophobicContact CG-CB 4.03Å; Y50-P138 HydrophobicContact CG-CG 4.18Å; Y52-P138 HydrophobicContact CE1-CG 3.72Å; Y52-P138 WeakPolarHBondContact OH-CG 3.33Å; F136-P138 VanDerWaalsContact C-CD 3.46Å; P138-K140 PolarHBondContact O-N 3.49Å
139I80.8Confident74.6Confident80 Ų8087.3 Ų87.341%0.4145%0.454SS..PPolyproline II helixtrans-66.5122.3-177.9-61-177.8000108.5F136 L137 S150F136-I139 HydrophobicContact CB-CD1 4.41Å; F136-I139 HydrophobicContact CD1-CD1 3.64Å; F136-I139 HydrophobicContact CE1-CD1 4.47Å; F136-I139 WeakPolarHBondContact O-CB 3.33Å; F136-I139 WeakPolarHBondContact O-CG1 3.42Å; F136-I139 PolarHBondContact O-N 3.36Å; F136-I139 VanDerWaalsContact O-N 3.14Å; L137-I139 VanDerWaalsContact C-N 3.27Å; L137-I139 PolarHBondContact O-N 2.99Å; I139-S150 PolarHBondContact O-OG 3.28Å
140K64.7Low73.8Confident180 Ų18087.4 Ų87.478%0.78346%0.456SS*.PPolyproline II helixtrans-68.3147.6-177.7-73.3178.4178.7171.20111.2P138 D142P138-K140 PolarHBondContact O-N 3.49Å; K140-D142 PolarHBondContact O-N 2.81Å
141P62.4Low73.2Confident79 Ų7989.7 Ų89.751%0.51347%0.474SS..PPolyproline II helixtrans-60.7133.7167.425-30.7000109.4Q143P141-Q143 PolarHBondContact O-N 2.88Å
142D57.7Low72.8Confident118 Ų11888 Ų8863%0.63147%0.466SS*.PPolyproline II helixtrans-68128.9172.6-163.5-3.4000108.6K140 S144K140-D142 PolarHBondContact O-N 2.81Å; D142-S144 PolarHBondContact O-N 3.46Å; D142-S144 PolarHBondContact OD2-OG 3.33Å
143Q55.1Low72.4Confident201 Ų20188.6 Ų88.694%0.93947%0.468SS*.THydrogen-bonded Turntrans-70.31.1-173.4-80.3-165.5-3.500113.7P141P141-Q143 PolarHBondContact O-N 2.88Å
144S55.4Low72.2Confident77 Ų7787.2 Ų87.254%0.53847%0.472SS..THydrogen-bonded Turntrans-95.6-12.5-167.461.90000115.4D142D142-S144 PolarHBondContact O-N 3.46Å; D142-S144 PolarHBondContact OD2-OG 3.33Å
145N50.8Low72.1Confident117 Ų11789 Ų8963%0.62649%0.487SS*.SBendtrans-133.4136.5-176.2-70-46.9000112.1S147N145-S147 PolarHBondContact O-N 3.24Å
146N55.3Low72.1Confident183 Ų18382.2 Ų82.298%0.97946%0.458SS*.  trans-65.837.8176.4-71.7-26.5000113.8
147S55.7Low72.3Confident75 Ų7582.6 Ų82.652%0.52446%0.462SS..  trans-94.3122174.953.90000110.2N145 F149N145-S147 PolarHBondContact O-N 3.24Å; S147-F149 PolarHBondContact O-N 3.45Å
148T58.3Low72.6Confident137 Ų13785.5 Ų85.584%0.8448%0.481SS*.SBendtrans-65.1-4.1-178.5-230000114.5
149F62.5Low73Confident139 Ų13985.3 Ų85.361%0.6148%0.48SS*.SBendtrans-118.3133-172.8-65.9-79.4000111.4S147 S151S147-F149 PolarHBondContact O-N 3.45Å; F149-S151 PolarHBondContact O-N 3.09Å
150S76.8Confident73.6Confident24 Ų2483.3 Ų83.317%0.16847%0.472CS..  trans-58.8135.8169.3164.70000110.1I139 G152 V153 A154I139-S150 PolarHBondContact O-OG 3.28Å; S150-G152 PolarHBondContact O-N 2.97Å; S150-G152 VanDerWaalsContact O-N 3.17Å; S150-G152 PolarHBondContact OG-N 2.86Å; S150-V153 PolarHBondContact O-N 2.71Å; S150-A154 PolarHBondContact O-N 3.43Å
151S82.2Confident75Confident76 Ų7678.8 Ų78.853%0.53146%0.463SS..Hα-helixtrans-51.8-36.7174.4-177.80000111.9F149 A154 A155F149-S151 PolarHBondContact O-N 3.09Å; S151-A154 PolarHBondContact O-N 2.94Å; S151-A155 WeakPolarHBondContact O-CB 3.32Å; S151-A155 PolarHBondContact O-N 3.49Å
152G84Confident76.5Confident1 Ų180 Ų801%0.0146%0.464CS..Hα-helixtrans-65.9-41.6176.200000114.1F136 S150 A155 A156F136-G152 WeakPolarHBondContact CB-O 3.3Å; F136-G152 WeakPolarHBondContact O-CA 3.44Å; S150-G152 PolarHBondContact O-N 2.97Å; S150-G152 VanDerWaalsContact O-N 3.17Å; S150-G152 PolarHBondContact OG-N 2.86Å; G152-A155 PolarHBondContact O-N 2.89Å; G152-A156 PolarHBondContact O-N 2.86Å
153V86.1Confident78.2Confident35 Ų3576.2 Ų76.221%0.21244%0.443CS..Hα-helixtrans-66.8-42.7175.3175.70000110.2L137 S150 A155 A156 I157L137-V153 HydrophobicContact CD1-CG2 3.93Å; S150-V153 PolarHBondContact O-N 2.71Å; V153-A155 VanDerWaalsContact C-N 3.33Å; V153-A155 PolarHBondContact O-N 3.42Å; V153-A156 PolarHBondContact O-N 2.99Å; V153-I157 HydrophobicContact CG1-CD1 3.66Å; V153-I157 HydrophobicContact CG1-CG1 4.28Å; V153-I157 WeakPolarHBondContact O-CB 3.33Å; V153-I157 VanDerWaalsContact O-CG1 3.24Å; V153-I157 WeakPolarHBondContact O-CG1 3.28Å; V153-I157 PolarHBondContact O-N 3.3Å
154A88.3Confident80Confident41 Ų4170.3 Ų70.334%0.33942%0.421SS..Hα-helixtrans-60.9-41.1176.200000112S150 S151 I157 T158S150-A154 PolarHBondContact O-N 3.43Å; S151-A154 PolarHBondContact O-N 2.94Å; A154-I157 PolarHBondContact O-N 3.39Å; A154-T158 WeakPolarHBondContact O-CB 3.44Å; A154-T158 PolarHBondContact O-N 2.92Å; A154-T158 PolarHBondContact O-OG1 3.01Å
155A90Very high81.8Confident40 Ų4069.7 Ų69.733%0.33142%0.415SS..Hα-helixtrans-62.8-45.4175.500000112.2F136 S151 G152 V153 T158 S159F136-A155 HydrophobicContact CD2-CB 4.49Å; F136-A155 HydrophobicContact CG-CB 4.4Å; S151-A155 WeakPolarHBondContact O-CB 3.32Å; S151-A155 PolarHBondContact O-N 3.49Å; G152-A155 PolarHBondContact O-N 2.89Å; V153-A155 VanDerWaalsContact C-N 3.33Å; V153-A155 PolarHBondContact O-N 3.42Å; A155-T158 PolarHBondContact O-N 2.57Å; A155-S159 WeakPolarHBondContact O-CB 3.48Å; A155-S159 PolarHBondContact O-N 3.23Å
156A91.3Very high83.8Confident0 Ų069.5 Ų69.50%041%0.409CS..Hα-helixtrans-65.2-40.7177.800000112.5W133 G152 V153 S159 T160W133-A156 HydrophobicContact CD2-CB 3.74Å; W133-A156 HydrophobicContact CE3-CB 3.97Å; W133-A156 HydrophobicContact CG-CB 4.12Å; W133-A156 HydrophobicContact CZ2-CB 4.3Å; W133-A156 HydrophobicContact CZ3-CB 4.34Å; G152-A156 PolarHBondContact O-N 2.86Å; V153-A156 PolarHBondContact O-N 2.99Å; A156-S159 PolarHBondContact O-N 3.34Å; A156-T160 WeakPolarHBondContact O-CB 3.25Å; A156-T160 PolarHBondContact O-N 3.39Å; A156-T160 PolarHBondContact O-OG1 3.05Å
157I90.9Very high85.5Confident80 Ų8061.4 Ų61.441%0.4137%0.368SS..Hα-helixtrans-63.2-44.1174.5-68.7169000110.5W133 V153 A154 T160 S161W133-I157 HydrophobicContact CH2-CG1 3.91Å; W133-I157 HydrophobicContact CZ2-CG1 4.13Å; V153-I157 HydrophobicContact CG1-CD1 3.66Å; V153-I157 HydrophobicContact CG1-CG1 4.28Å; V153-I157 WeakPolarHBondContact O-CB 3.33Å; V153-I157 VanDerWaalsContact O-CG1 3.24Å; V153-I157 WeakPolarHBondContact O-CG1 3.28Å; V153-I157 PolarHBondContact O-N 3.3Å; A154-I157 PolarHBondContact O-N 3.39Å; I157-T160 PolarHBondContact O-N 3.19Å; I157-S161 WeakPolarHBondContact O-CB 3.42Å; I157-S161 PolarHBondContact O-N 3.25Å
158T92.7Very high87.2Confident80 Ų8062.8 Ų62.849%0.49137%0.369SS..Hα-helixtrans-62.3-46.7178.9-57.30000111A154 A155 T160 S161 I162A154-T158 WeakPolarHBondContact O-CB 3.44Å; A154-T158 PolarHBondContact O-N 2.92Å; A154-T158 PolarHBondContact O-OG1 3.01Å; A155-T158 PolarHBondContact O-N 2.57Å; T158-T160 VanDerWaalsContact C-N 3.33Å; T158-T160 PolarHBondContact O-N 3.42Å; T158-S161 PolarHBondContact O-N 3.35Å; T158-I162 HydrophobicContact CG2-CD1 4.18Å; T158-I162 WeakPolarHBondContact O-CG1 3.35Å; T158-I162 PolarHBondContact O-N 3.39Å; T158-I162 VanDerWaalsContact O-N 3.08Å
159S91.8Very high88.9Confident28 Ų2861 Ų6120%0.19635%0.353CS..Hα-helixtrans-57.3-46.7174.8-178.50000111.3C132 A155 A156 S161 I162 M163C132-S159 PolarHBondContact SG-OG 3.34Å; C132-S159 VanDerWaalsContact SG-OG 3.34Å; A155-S159 WeakPolarHBondContact O-CB 3.48Å; A155-S159 PolarHBondContact O-N 3.23Å; A156-S159 PolarHBondContact O-N 3.34Å; S159-S161 PolarHBondContact O-N 2.8Å; S159-I162 PolarHBondContact O-N 2.99Å; S159-M163 WeakPolarHBondContact O-CB 3.48Å; S159-M163 PolarHBondContact O-N 3.5Å; S159-M163 VanDerWaalsContact O-N 3.07Å
160T93.1Very high90.1Very high39 Ų3957.3 Ų57.324%0.23934%0.337CS..Hα-helixtrans-60.5-45.8177.5-54.10000111.2V129 W133 A156 I157 T158 I162 M163 V164V129-T160 HydrophobicContact CG1-CG2 4.22Å; V129-T160 WeakPolarHBondContact CG1-OG1 3.3Å; W133-T160 PolarHBondContact NE1-OG1 2.93Å; A156-T160 WeakPolarHBondContact O-CB 3.25Å; A156-T160 PolarHBondContact O-N 3.39Å; A156-T160 PolarHBondContact O-OG1 3.05Å; I157-T160 PolarHBondContact O-N 3.19Å; T158-T160 VanDerWaalsContact C-N 3.33Å; T158-T160 PolarHBondContact O-N 3.42Å; T160-I162 VanDerWaalsContact C-N 3.29Å; T160-I162 PolarHBondContact O-N 3.31Å; T160-M163 PolarHBondContact O-N 2.81Å; T160-V164 HydrophobicContact CG2-CG2 4.32Å; T160-V164 VanDerWaalsContact O-CG2 3.28Å; T160-V164 WeakPolarHBondContact O-CG2 3.37Å; T160-V164 PolarHBondContact O-N 3.47Å
161S94.3Very high90.8Very high85 Ų8560 Ų6059%0.59435%0.349SS*.Hα-helixtrans-60.5-37.7-179.6-171.80000112.6I157 T158 S159 M163 P165I157-S161 WeakPolarHBondContact O-CB 3.42Å; I157-S161 PolarHBondContact O-N 3.25Å; T158-S161 PolarHBondContact O-N 3.35Å; S159-S161 PolarHBondContact O-N 2.8Å; S161-M163 VanDerWaalsContact C-N 3.34Å; S161-P165 WeakPolarHBondContact O-CD 3.48Å
162I94.5Very high91.2Very high105 Ų10561.3 Ų61.354%0.53835%0.353SS..Hα-helixtrans-70.8-34.1176.3-65.8167.5000110.7T158 S159 T160 P165 F166T158-I162 HydrophobicContact CG2-CD1 4.18Å; T158-I162 WeakPolarHBondContact O-CG1 3.35Å; T158-I162 PolarHBondContact O-N 3.39Å; T158-I162 VanDerWaalsContact O-N 3.08Å; S159-I162 PolarHBondContact O-N 2.99Å; T160-I162 VanDerWaalsContact C-N 3.29Å; T160-I162 PolarHBondContact O-N 3.31Å; I162-P165 VanDerWaalsContact O-CD 3.3Å; I162-P165 WeakPolarHBondContact O-CD 3.41Å; I162-P165 WeakPolarHBondContact O-CG 3.31Å; I162-F166 WeakPolarHBondContact O-CD2 3.42Å
163M93Very high91.3Very high37 Ų3766.2 Ų66.218%0.18238%0.375CS..Hα-helixtrans-81-28.7-174.9-146.868.987.500114.3L125 V128 V129 S159 T160 S161 F166 G167L125-M163 HydrophobicContact CD1-CE 4.22Å; L125-M163 HydrophobicContact CD1-CG 3.56Å; L125-M163 HydrophobicContact CD1-SD 3.25Å; L125-M163 WeakPolarHBondContact CD1-SD 3.35Å; L125-M163 HydrophobicContact CD2-CG 3.87Å; L125-M163 HydrophobicContact CG-CG 3.43Å; L125-M163 VanDerWaalsContact CG-CG 3.43Å; L125-M163 HydrophobicContact CG-SD 3.89Å; V128-M163 HydrophobicContact CB-CE 4.37Å; V128-M163 HydrophobicContact CG1-CE 3.77Å; V129-M163 HydrophobicContact CG2-CB 3.72Å; V129-M163 HydrophobicContact CG2-CE 4.49Å; V129-M163 HydrophobicContact CG2-CG 3.75Å; S159-M163 WeakPolarHBondContact O-CB 3.48Å; S159-M163 PolarHBondContact O-N 3.5Å; S159-M163 VanDerWaalsContact O-N 3.07Å; T160-M163 PolarHBondContact O-N 2.81Å; S161-M163 VanDerWaalsContact C-N 3.34Å; M163-F166 PolarHBondContact O-N 3.45Å; M163-G167 PolarHBondContact O-N 2.98Å
164V93.1Very high91.2Very high78 Ų7865.3 Ų65.347%0.47337%0.371SS..Hα-helixtrans-49.6-50.4179.2164.70000114.4T160 F166 G167 L168T160-V164 HydrophobicContact CG2-CG2 4.32Å; T160-V164 VanDerWaalsContact O-CG2 3.28Å; T160-V164 WeakPolarHBondContact O-CG2 3.37Å; T160-V164 PolarHBondContact O-N 3.47Å; V164-F166 VanDerWaalsContact C-N 3.31Å; V164-F166 PolarHBondContact O-N 3.37Å; V164-G167 PolarHBondContact O-N 3.24Å; V164-G167 VanDerWaalsContact O-N 3.13Å; V164-L168 HydrophobicContact CG1-CD1 4.24Å; V164-L168 HydrophobicContact CG1-CG 4.43Å; V164-L168 WeakPolarHBondContact O-CG 3.17Å; V164-L168 PolarHBondContact O-N 2.74Å
165P93.1Very high91.1Very high64 Ų6466.7 Ų66.742%0.41638%0.375SS..Hα-helixtrans-61.7-38.4-178.722.6-34.6000112.7S161 I162 L168 I169S161-P165 WeakPolarHBondContact O-CD 3.48Å; I162-P165 VanDerWaalsContact O-CD 3.3Å; I162-P165 WeakPolarHBondContact O-CD 3.41Å; I162-P165 WeakPolarHBondContact O-CG 3.31Å; P165-L168 PolarHBondContact O-N 3.1Å; P165-I169 WeakPolarHBondContact O-CG1 3.39Å; P165-I169 PolarHBondContact O-N 2.85Å
166F92.6Very high90.9Very high113 Ų11370.3 Ų70.350%0.49638%0.384SS..Hα-helixtrans-64.5-44.7174.4-63.4-81.6000110.8L125 I162 M163 V164 L168 I169 F170L125-F166 HydrophobicContact CD2-CB 4.04Å; I162-F166 WeakPolarHBondContact O-CD2 3.42Å; M163-F166 PolarHBondContact O-N 3.45Å; V164-F166 VanDerWaalsContact C-N 3.31Å; V164-F166 PolarHBondContact O-N 3.37Å; F166-L168 VanDerWaalsContact C-N 3.34Å; F166-L168 PolarHBondContact O-N 3.06Å; F166-I169 PolarHBondContact O-N 2.7Å; F166-F170 WeakPolarHBondContact O-CD2 3.41Å; F166-F170 PolarHBondContact O-N 2.97Å; F166-F170 VanDerWaalsContact O-N 3.09Å
167G90.3Very high90.4Very high13 Ų1373 Ų7313%0.13440%0.396CS..Hα-helixtrans-56.4-45.1175.800000112.6M163 V164 I169 F170 I171M163-G167 PolarHBondContact O-N 2.98Å; V164-G167 PolarHBondContact O-N 3.24Å; V164-G167 VanDerWaalsContact O-N 3.13Å; G167-I169 PolarHBondContact O-N 3.13Å; G167-F170 PolarHBondContact O-N 3Å; G167-I171 VanDerWaalsContact O-CG1 3.24Å; G167-I171 WeakPolarHBondContact O-CG1 3.43Å; G167-I171 PolarHBondContact O-N 3.04Å
168L92.5Very high89.9Confident104 Ų10475.5 Ų75.555%0.54540%0.401SS..Hα-helixtrans-59.7-45.5177.9-72.6176.5000112.3V164 P165 F166 F170 I171 V172V164-L168 HydrophobicContact CG1-CD1 4.24Å; V164-L168 HydrophobicContact CG1-CG 4.43Å; V164-L168 WeakPolarHBondContact O-CG 3.17Å; V164-L168 PolarHBondContact O-N 2.74Å; P165-L168 PolarHBondContact O-N 3.1Å; F166-L168 VanDerWaalsContact C-N 3.34Å; F166-L168 PolarHBondContact O-N 3.06Å; L168-F170 VanDerWaalsContact C-N 3.33Å; L168-F170 PolarHBondContact O-N 3.48Å; L168-I171 PolarHBondContact O-N 3.21Å; L168-V172 WeakPolarHBondContact O-CG2 3.44Å; L168-V172 PolarHBondContact O-N 2.83Å
169I92.9Very high89.4Confident98 Ų9880.2 Ų80.250%0.50341%0.41SS..Hα-helixtrans-59-46.7177.1-66.1168000110.2P165 F166 G167 I171 V172 F173P165-I169 WeakPolarHBondContact O-CG1 3.39Å; P165-I169 PolarHBondContact O-N 2.85Å; F166-I169 PolarHBondContact O-N 2.7Å; G167-I169 PolarHBondContact O-N 3.13Å; I169-I171 VanDerWaalsContact C-N 3.34Å; I169-I171 PolarHBondContact O-N 3.07Å; I169-V172 PolarHBondContact O-N 3.19Å; I169-F173 HydrophobicContact CG2-CD2 3.86Å; I169-F173 HydrophobicContact CG2-CE2 3.59Å; I169-F173 WeakPolarHBondContact O-CD2 3.43Å; I169-F173 PolarHBondContact O-N 3.33Å; I169-F173 VanDerWaalsContact O-N 3.14Å
170F89.4Confident88.5Confident62 Ų6280.9 Ų80.927%0.27242%0.415SS..Hα-helixtrans-63.5-36.7177-78.7-69.6000113T121 L122 L125 F166 G167 L168 F173 A174T121-F170 HydrophobicContact CG2-CD1 4.44Å; T121-F170 HydrophobicContact CG2-CE1 3.69Å; T121-F170 HydrophobicContact CG2-CE2 4.37Å; T121-F170 HydrophobicContact CG2-CZ 3.66Å; L122-F170 HydrophobicContact CB-CB 4.38Å; L122-F170 HydrophobicContact CD1-CB 4.11Å; L125-F170 HydrophobicContact CD2-CD2 4.39Å; F166-F170 WeakPolarHBondContact O-CD2 3.41Å; F166-F170 PolarHBondContact O-N 2.97Å; F166-F170 VanDerWaalsContact O-N 3.09Å; G167-F170 PolarHBondContact O-N 3Å; L168-F170 VanDerWaalsContact C-N 3.33Å; L168-F170 PolarHBondContact O-N 3.48Å; F170-F173 PolarHBondContact O-N 3.49Å; F170-A174 WeakPolarHBondContact O-CB 3.3Å; F170-A174 PolarHBondContact O-N 3.37Å
171I90.4Very high87.5Confident82 Ų8281.2 Ų81.242%0.42142%0.415SS..Hα-helixtrans-63.5-43.6175.5-69.4164.3000110.6L122 G167 L168 I169 F173 A174 V175L122-I171 HydrophobicContact CD1-CG1 3.68Å; G167-I171 VanDerWaalsContact O-CG1 3.24Å; G167-I171 WeakPolarHBondContact O-CG1 3.43Å; G167-I171 PolarHBondContact O-N 3.04Å; L168-I171 PolarHBondContact O-N 3.21Å; I169-I171 VanDerWaalsContact C-N 3.34Å; I169-I171 PolarHBondContact O-N 3.07Å; I171-F173 VanDerWaalsContact C-N 3.32Å; I171-F173 PolarHBondContact O-N 3Å; I171-A174 PolarHBondContact O-N 2.77Å; I171-V175 HydrophobicContact CG2-CG2 4.26Å; I171-V175 WeakPolarHBondContact O-CB 3.31Å; I171-V175 WeakPolarHBondContact O-CG2 3.44Å; I171-V175 PolarHBondContact O-N 3.24Å
172V91.3Very high86.3Confident102 Ų10280 Ų8062%0.61840%0.404SS*.Hα-helixtrans-58.6-46.5176.2175.80000110.7L168 I169 V175 H176L168-V172 WeakPolarHBondContact O-CG2 3.44Å; L168-V172 PolarHBondContact O-N 2.83Å; I169-V172 PolarHBondContact O-N 3.19Å; V172-V175 PolarHBondContact O-N 2.88Å; V172-H176 WeakPolarHBondContact O-CB 3.31Å; V172-H176 PolarHBondContact O-N 3.18Å
173F85.9Confident85Confident105 Ų10578.4 Ų78.446%0.46140%0.402SS..Hα-helixtrans-61.8-46.7175.3-76.8-64.9000111.8V118 I169 F170 I171 V175 H176 F177V118-F173 HydrophobicContact CG1-CB 4.41Å; I169-F173 HydrophobicContact CG2-CD2 3.86Å; I169-F173 HydrophobicContact CG2-CE2 3.59Å; I169-F173 WeakPolarHBondContact O-CD2 3.43Å; I169-F173 PolarHBondContact O-N 3.33Å; I169-F173 VanDerWaalsContact O-N 3.14Å; F170-F173 PolarHBondContact O-N 3.49Å; I171-F173 VanDerWaalsContact C-N 3.32Å; I171-F173 PolarHBondContact O-N 3Å; F173-V175 VanDerWaalsContact C-N 3.32Å; F173-V175 PolarHBondContact O-N 3.09Å; F173-H176 WeakPolarHBondContact O-CB 3.48Å; F173-H176 PolarHBondContact O-N 3.26Å; F173-H176 VanDerWaalsContact O-N 3.16Å; F173-F177 HydrophobicContact CB-CD2 4.3Å; F173-F177 HydrophobicContact CB-CE2 4.16Å; F173-F177 HydrophobicContact CD1-CE2 4.25Å; F173-F177 WeakPolarHBondContact O-CD2 3.44Å; F173-F177 PolarHBondContact O-N 3.09Å
174A84.4Confident83.6Confident15 Ų1579.4 Ų79.412%0.12441%0.406CS..Hα-helixtrans-58.2-43.7178.800000111.8V118 F170 I171 F177 Y178V118-A174 HydrophobicContact CG1-CB 4.09Å; F170-A174 WeakPolarHBondContact O-CB 3.3Å; F170-A174 PolarHBondContact O-N 3.37Å; I171-A174 PolarHBondContact O-N 2.77Å; A174-F177 PolarHBondContact O-N 2.82Å; A174-Y178 WeakPolarHBondContact O-CB 3.24Å; A174-Y178 PolarHBondContact O-N 3.48Å
175V86.3Confident82.1Confident70 Ų7083.1 Ų83.142%0.42442%0.416SS..Hα-helixtrans-65.3-42.3175.9171.90000111.3I171 V172 F173 Y178 R179I171-V175 HydrophobicContact CG2-CG2 4.26Å; I171-V175 WeakPolarHBondContact O-CB 3.31Å; I171-V175 WeakPolarHBondContact O-CG2 3.44Å; I171-V175 PolarHBondContact O-N 3.24Å; V172-V175 PolarHBondContact O-N 2.88Å; F173-V175 VanDerWaalsContact C-N 3.32Å; F173-V175 PolarHBondContact O-N 3.09Å; V175-Y178 PolarHBondContact O-N 3.02Å; V175-R179 WeakPolarHBondContact O-CB 3.47Å; V175-R179 WeakPolarHBondContact O-CG 3.41Å; V175-R179 PolarHBondContact O-N 3.37Å
176H85.1Confident80.5Confident116 Ų11683.9 Ų83.954%0.53742%0.42SS..Hα-helixtrans-60.1-46.2175.8-179.9-83.7000111.8V172 F173 S180V172-H176 WeakPolarHBondContact O-CB 3.31Å; V172-H176 PolarHBondContact O-N 3.18Å; F173-H176 WeakPolarHBondContact O-CB 3.48Å; F173-H176 PolarHBondContact O-N 3.26Å; F173-H176 VanDerWaalsContact O-N 3.16Å; H176-S180 WeakPolarHBondContact O-CB 3.49Å; H176-S180 PolarHBondContact O-N 3.48Å; H176-S180 PolarHBondContact O-OG 3.42Å
177F80.7Confident79.1Confident56 Ų5682.9 Ų82.925%0.24642%0.419CS..Hα-helixtrans-68.3-39.5176.4-73.1-65.8000112.3F115 V118 F173 A174 S180 L181F115-F177 HydrophobicContact CD2-CB 4.07Å; V118-F177 HydrophobicContact CG2-CD2 4.04Å; V118-F177 HydrophobicContact CG2-CE2 3.97Å; F173-F177 HydrophobicContact CB-CD2 4.3Å; F173-F177 HydrophobicContact CB-CE2 4.16Å; F173-F177 HydrophobicContact CD1-CE2 4.25Å; F173-F177 WeakPolarHBondContact O-CD2 3.44Å; F173-F177 PolarHBondContact O-N 3.09Å; A174-F177 PolarHBondContact O-N 2.82Å; F177-S180 WeakPolarHBondContact O-CB 3.29Å; F177-S180 PolarHBondContact O-N 3.38Å; F177-L181 PolarHBondContact O-N 3.46Å
178Y81.5Confident77.8Confident133 Ų13387.6 Ų87.652%0.52243%0.433SS..Hα-helixtrans-60.7-46.8175.5177.6-99.3000111.5F115 A174 V175 S180 L181 V182F115-Y178 HydrophobicContact CE2-CD2 4.43Å; F115-Y178 HydrophobicContact CZ-CD2 4.28Å; A174-Y178 WeakPolarHBondContact O-CB 3.24Å; A174-Y178 PolarHBondContact O-N 3.48Å; V175-Y178 PolarHBondContact O-N 3.02Å; Y178-S180 VanDerWaalsContact C-N 3.28Å; Y178-S180 PolarHBondContact O-N 2.91Å; Y178-L181 WeakPolarHBondContact O-CB 3.47Å; Y178-L181 PolarHBondContact O-N 2.99Å; Y178-L181 VanDerWaalsContact O-N 3.15Å; Y178-V182 HydrophobicContact CD1-CG2 4.27Å; Y178-V182 HydrophobicContact CD2-CG2 4.42Å; Y178-V182 HydrophobicContact CE1-CG2 3.79Å; Y178-V182 HydrophobicContact CE2-CG2 3.98Å; Y178-V182 WeakPolarHBondContact O-CG2 3.5Å; Y178-V182 PolarHBondContact O-N 3.29Å
179R80.3Confident76.2Confident179 Ų17988.1 Ų88.168%0.67543%0.433SS*.Hα-helixtrans-61.9-38.1174.2-76.7-174.1169-179-2.3112V175 L181 V182 S183V175-R179 WeakPolarHBondContact O-CB 3.47Å; V175-R179 WeakPolarHBondContact O-CG 3.41Å; V175-R179 PolarHBondContact O-N 3.37Å; R179-L181 VanDerWaalsContact C-N 3.31Å; R179-L181 PolarHBondContact O-N 2.9Å; R179-V182 PolarHBondContact O-N 3.44Å; R179-S183 VanDerWaalsContact O-CB 3.24Å; R179-S183 WeakPolarHBondContact O-CB 3.41Å; R179-S183 PolarHBondContact O-N 2.94Å
180S74.7Confident75Confident43 Ų4390.3 Ų90.330%0.30144%0.439SS..Hα-helixtrans-63.8-35.8175.3-58.50000112.2H176 F177 Y178H176-S180 WeakPolarHBondContact O-CB 3.49Å; H176-S180 PolarHBondContact O-N 3.48Å; H176-S180 PolarHBondContact O-OG 3.42Å; F177-S180 WeakPolarHBondContact O-CB 3.29Å; F177-S180 PolarHBondContact O-N 3.38Å; Y178-S180 VanDerWaalsContact C-N 3.28Å; Y178-S180 PolarHBondContact O-N 2.91Å
181L70.2Confident74.2Confident45 Ų4591.2 Ų91.224%0.23644%0.444CS..Hα-helixtrans-67.7-47.6172.2-74.9169.2000112L111 F115 F177 Y178 R179 K185L111-L181 HydrophobicContact CB-CD2 4.32Å; L111-L181 HydrophobicContact CD2-CB 4.22Å; L111-L181 HydrophobicContact CD2-CD1 4.2Å; L111-L181 HydrophobicContact CD2-CD2 3.19Å; L111-L181 HydrophobicContact CD2-CG 3.21Å; L111-L181 HydrophobicContact CG-CD2 4.34Å; F115-L181 HydrophobicContact CB-CD1 4.04Å; F115-L181 HydrophobicContact CD1-CD1 3.9Å; F115-L181 HydrophobicContact CD2-CD1 4.02Å; F115-L181 HydrophobicContact CE1-CD1 4.25Å; F115-L181 HydrophobicContact CE2-CD1 4.38Å; F115-L181 HydrophobicContact CG-CD1 3.73Å; F115-L181 HydrophobicContact CZ-CD1 4.44Å; F177-L181 PolarHBondContact O-N 3.46Å; Y178-L181 WeakPolarHBondContact O-CB 3.47Å; Y178-L181 PolarHBondContact O-N 2.99Å; Y178-L181 VanDerWaalsContact O-N 3.15Å; R179-L181 VanDerWaalsContact C-N 3.31Å; R179-L181 PolarHBondContact O-N 2.9Å; L181-K185 PolarHBondContact O-N 3.43Å; L181-K185 VanDerWaalsContact O-N 3.15Å
182V70.4Confident73.4Confident60 Ų6091 Ų9136%0.36444%0.441SS..Hα-helixtrans-73.7-43.8-172.2169.50000112.5Y178 R179 H184 K185 T186Y178-V182 HydrophobicContact CD1-CG2 4.27Å; Y178-V182 HydrophobicContact CD2-CG2 4.42Å; Y178-V182 HydrophobicContact CE1-CG2 3.79Å; Y178-V182 HydrophobicContact CE2-CG2 3.98Å; Y178-V182 WeakPolarHBondContact O-CG2 3.5Å; Y178-V182 PolarHBondContact O-N 3.29Å; R179-V182 PolarHBondContact O-N 3.44Å; V182-H184 PolarHBondContact O-N 2.79Å; V182-K185 PolarHBondContact O-N 3.15Å; V182-T186 PolarHBondContact O-N 3.36Å; V182-T186 PolarHBondContact O-OG1 2.95Å
183S67.3Low72.6Confident71 Ų7191.6 Ų91.650%0.49744%0.44SS..Hα-helixtrans-56.2-44177.4-170.20000110.4R179 T186 D187R179-S183 VanDerWaalsContact O-CB 3.24Å; R179-S183 WeakPolarHBondContact O-CB 3.41Å; R179-S183 PolarHBondContact O-N 2.94Å; S183-T186 PolarHBondContact O-N 3.34Å; S183-D187 VanDerWaalsContact O-CG 3.32Å; S183-D187 PolarHBondContact O-N 3.47Å
184H62.8Low72.5Confident59 Ų5991.6 Ų91.627%0.27344%0.442SS..Hα-helixtrans-74.7-29.5-177.7-158.6-92.2000113.3H108 V182 R188H108-H184 AromaticContact CD2-ND1 3.81Å; H108-H184 AromaticContact CE1-CE1 3.32Å; H108-H184 PolarHBondContact CE1-CE1 3.33Å; H108-H184 AromaticContact CE1-ND1 3.36Å; H108-H184 PolarHBondContact CE1-ND1 3.46Å; H108-H184 AromaticContact NE2-CE1 3.36Å; H108-H184 PolarHBondContact NE2-CE1 3.22Å; H108-H184 AromaticContact NE2-ND1 2.87Å; H108-H184 PolarHBondContact NE2-ND1 3.41Å; V182-H184 PolarHBondContact O-N 2.79Å; H184-R188 WeakPolarHBondContact O-CB 3.08Å; H184-R188 PolarHBondContact O-N 3.27Å
185K61.6Low72.6Confident155 Ų15596.9 Ų96.967%0.67446%0.464SS*.Hα-helixtrans-69.7-35.9172.3-163.1175.1-173.4172.40111.5L181 V182 Q189L181-K185 PolarHBondContact O-N 3.43Å; L181-K185 VanDerWaalsContact O-N 3.15Å; V182-K185 PolarHBondContact O-N 3.15Å; K185-Q189 VanDerWaalsContact O-CG 3.3Å; K185-Q189 WeakPolarHBondContact O-CG 3.14Å; K185-Q189 PolarHBondContact O-N 2.98Å
186T60.8Low72.4Confident80 Ų8098.7 Ų98.749%0.49147%0.471SS..Hα-helixtrans-69.4-47.3177.7-53.30000110.9V182 S183 R188 Q189 F190V182-T186 PolarHBondContact O-N 3.36Å; V182-T186 PolarHBondContact O-OG1 2.95Å; S183-T186 PolarHBondContact O-N 3.34Å; T186-R188 VanDerWaalsContact C-N 3.26Å; T186-R188 PolarHBondContact O-N 2.95Å; T186-Q189 PolarHBondContact O-N 3.32Å; T186-F190 PolarHBondContact O-N 2.88Å
187D61.9Low72.3Confident92 Ų9296.2 Ų96.249%0.49247%0.466SS..Hα-helixtrans-59.1-38.9177.3-70.6-24.5000112S183 F190 Q191S183-D187 VanDerWaalsContact O-CG 3.32Å; S183-D187 PolarHBondContact O-N 3.47Å; D187-F190 PolarHBondContact O-N 3.05Å; D187-Q191 PolarHBondContact O-N 3.43Å
188R63.9Low72.6Confident113 Ų11397.7 Ų97.743%0.42648%0.477SS..Hα-helixtrans-71.6-39.7-178.8-157.1169.791.9-179.510.9113.2H184 T186 F190 Q191 E192H184-R188 WeakPolarHBondContact O-CB 3.08Å; H184-R188 PolarHBondContact O-N 3.27Å; T186-R188 VanDerWaalsContact C-N 3.26Å; T186-R188 PolarHBondContact O-N 2.95Å; R188-F190 VanDerWaalsContact C-N 3.28Å; R188-F190 PolarHBondContact O-N 3.5Å; R188-Q191 PolarHBondContact O-N 3.29Å; R188-E192 IonicContact NE-OE1 3.83Å; R188-E192 WeakPolarHBondContact O-CG 3.5Å; R188-E192 PolarHBondContact O-N 2.9Å
189Q57.3Low72.9Confident114 Ų11496.6 Ų96.653%0.53348%0.48SS..Hα-helixtrans-66.3-34.3175-72.4-88.7-85.600111.5K185 T186 E192 L193K185-Q189 VanDerWaalsContact O-CG 3.3Å; K185-Q189 WeakPolarHBondContact O-CG 3.14Å; K185-Q189 PolarHBondContact O-N 2.98Å; T186-Q189 PolarHBondContact O-N 3.32Å; Q189-E192 PolarHBondContact NE2-OE2 3.48Å; Q189-L193 WeakPolarHBondContact O-CB 3Å; Q189-L193 WeakPolarHBondContact O-CG 3.34Å; Q189-L193 PolarHBondContact O-N 3.33Å
190F69.1Low73.1Confident145 Ų14592 Ų9264%0.63647%0.471SS*.Hα-helixtrans-68.8-41.8174.8-147.4-90000111.7T186 D187 R188 L193 E194T186-F190 PolarHBondContact O-N 2.88Å; D187-F190 PolarHBondContact O-N 3.05Å; R188-F190 VanDerWaalsContact C-N 3.28Å; R188-F190 PolarHBondContact O-N 3.5Å; F190-L193 PolarHBondContact O-N 3.15Å; F190-E194 WeakPolarHBondContact O-CB 3.33Å; F190-E194 PolarHBondContact O-N 3.26Å
191Q71.8Confident73.6Confident80 Ų8099 Ų9937%0.37449%0.491SS..Hα-helixtrans-62.2-43.4173.7-108.8-179.6-38.500112.6D187 R188 L193 E194 E195D187-Q191 PolarHBondContact O-N 3.43Å; R188-Q191 PolarHBondContact O-N 3.29Å; Q191-L193 VanDerWaalsContact C-N 3.34Å; Q191-L193 PolarHBondContact O-N 2.83Å; Q191-E194 PolarHBondContact O-N 3.47Å; Q191-E195 WeakPolarHBondContact O-CG 3.32Å; Q191-E195 PolarHBondContact O-N 2.91Å
192E74.3Confident74.5Confident78 Ų78101.9 Ų101.936%0.36451%0.506SS..Hα-helixtrans-62.4-39.9176-75.5168.3-176.300111.6R188 Q189 L196R188-E192 IonicContact NE-OE1 3.83Å; R188-E192 WeakPolarHBondContact O-CG 3.5Å; R188-E192 PolarHBondContact O-N 2.9Å; Q189-E192 PolarHBondContact NE2-OE2 3.48Å; E192-L196 WeakPolarHBondContact O-CB 3.26Å; E192-L196 WeakPolarHBondContact O-CD1 3.21Å; E192-L196 WeakPolarHBondContact O-CG 3.17Å; E192-L196 PolarHBondContact O-N 3.44Å; E192-L196 VanDerWaalsContact O-N 3.07Å
193L75Confident75.2Confident115 Ų115105.6 Ų105.660%0.60252%0.519SS*.Hα-helixtrans-66-39.8174.3-83.7165000112.5Q189 F190 Q191 S197Q189-L193 WeakPolarHBondContact O-CB 3Å; Q189-L193 WeakPolarHBondContact O-CG 3.34Å; Q189-L193 PolarHBondContact O-N 3.33Å; F190-L193 PolarHBondContact O-N 3.15Å; Q191-L193 VanDerWaalsContact C-N 3.34Å; Q191-L193 PolarHBondContact O-N 2.83Å; L193-S197 VanDerWaalsContact O-CB 3.29Å; L193-S197 WeakPolarHBondContact O-CB 3.26Å; L193-S197 PolarHBondContact O-N 3.43Å
194E83.3Confident76Confident105 Ų105107 Ų10749%0.49152%0.522SS..Hα-helixtrans-68.8-41.5179.5-169.3166.4-168.800111.6F190 Q191 S197 N198F190-E194 WeakPolarHBondContact O-CB 3.33Å; F190-E194 PolarHBondContact O-N 3.26Å; Q191-E194 PolarHBondContact O-N 3.47Å; E194-S197 PolarHBondContact O-N 3.3Å; E194-S197 PolarHBondContact O-OG 2.93Å; E194-N198 PolarHBondContact O-N 3.08Å
195E86.4Confident77Confident125 Ų125111.1 Ų111.158%0.58454%0.541SS*.Hα-helixtrans-62.3-45.4173.9-74.3-179.8-175.900111.9Q191 S197 N198 L199Q191-E195 WeakPolarHBondContact O-CG 3.32Å; Q191-E195 PolarHBondContact O-N 2.91Å; E195-S197 VanDerWaalsContact C-N 3.32Å; E195-S197 PolarHBondContact O-N 2.95Å; E195-N198 PolarHBondContact O-N 3.47Å; E195-L199 WeakPolarHBondContact O-CG 3.11Å; E195-L199 PolarHBondContact O-N 3.06Å
196L82Confident77.8Confident109 Ų109109.6 Ų109.657%0.57154%0.539SS*.Hα-helixtrans-62.9-38.8174.6-76.5166.3000112.1E192 N198 L199 T200E192-L196 WeakPolarHBondContact O-CB 3.26Å; E192-L196 WeakPolarHBondContact O-CD1 3.21Å; E192-L196 WeakPolarHBondContact O-CG 3.17Å; E192-L196 PolarHBondContact O-N 3.44Å; E192-L196 VanDerWaalsContact O-N 3.07Å; L196-N198 VanDerWaalsContact C-N 3.35Å; L196-L199 PolarHBondContact O-N 3.23Å; L196-T200 WeakPolarHBondContact O-CB 3.3Å; L196-T200 PolarHBondContact O-N 3.34Å; L196-T200 PolarHBondContact O-OG1 3.15Å
197S82.4Confident78.5Confident63 Ų63111.1 Ų111.144%0.44155%0.545SS..Hα-helixtrans-65.4-39177.481.60000111.9L193 E194 E195 T200 R201L193-S197 VanDerWaalsContact O-CB 3.29Å; L193-S197 WeakPolarHBondContact O-CB 3.26Å; L193-S197 PolarHBondContact O-N 3.43Å; E194-S197 PolarHBondContact O-N 3.3Å; E194-S197 PolarHBondContact O-OG 2.93Å; E195-S197 VanDerWaalsContact C-N 3.32Å; E195-S197 PolarHBondContact O-N 2.95Å; S197-T200 PolarHBondContact O-N 3.41Å; S197-R201 WeakPolarHBondContact O-CB 3.34Å; S197-R201 PolarHBondContact O-N 3.35Å
198N87.3Confident79.1Confident87 Ų87112.1 Ų112.147%0.46555%0.55SS.*Hα-helixtrans-70-41.4177.6-94.5-32.8000112.1E194 E195 L196 T200 R201 L202E194-N198 PolarHBondContact O-N 3.08Å; E195-N198 PolarHBondContact O-N 3.47Å; L196-N198 VanDerWaalsContact C-N 3.35Å; N198-T200 VanDerWaalsContact C-N 3.35Å; N198-R201 WeakPolarHBondContact O-CB 3.44Å; N198-R201 PolarHBondContact O-N 2.88Å; N198-L202 WeakPolarHBondContact O-CG 3.32Å; N198-L202 PolarHBondContact O-N 3.48Å
199L87.5Confident79.2Confident111 Ų111115.8 Ų115.858%0.58156%0.564SS**Hα-helixtrans-61.9-43.5173.6-74176.6000111.7E195 L196 R201 L202 Q203E195-L199 WeakPolarHBondContact O-CG 3.11Å; E195-L199 PolarHBondContact O-N 3.06Å; L196-L199 PolarHBondContact O-N 3.23Å; L199-R201 VanDerWaalsContact C-N 3.31Å; L199-R201 PolarHBondContact O-N 3.41Å; L199-L202 PolarHBondContact O-N 2.95Å; L199-Q203 WeakPolarHBondContact O-CB 3.22Å; L199-Q203 PolarHBondContact O-N 3.35Å
200T84.4Confident79.4Confident82 Ų82111.8 Ų111.850%0.50355%0.553SS.*Hα-helixtrans-62.4-39.4176.4-53.70000111.3L196 S197 N198 Q203 N204L196-T200 WeakPolarHBondContact O-CB 3.3Å; L196-T200 PolarHBondContact O-N 3.34Å; L196-T200 PolarHBondContact O-OG1 3.15Å; S197-T200 PolarHBondContact O-N 3.41Å; N198-T200 VanDerWaalsContact C-N 3.35Å; T200-Q203 PolarHBondContact O-N 3.36Å; T200-N204 PolarHBondContact O-N 3.07Å
201R86.9Confident79Confident190 Ų190110.9 Ų110.972%0.71755%0.551SS**Hα-helixtrans-62.7-46.3174.3-107.5-174.3144.3113.9-0.1112.9S197 N198 L199 Q203 N204 E205S197-R201 WeakPolarHBondContact O-CB 3.34Å; S197-R201 PolarHBondContact O-N 3.35Å; N198-R201 WeakPolarHBondContact O-CB 3.44Å; N198-R201 PolarHBondContact O-N 2.88Å; L199-R201 VanDerWaalsContact C-N 3.31Å; L199-R201 PolarHBondContact O-N 3.41Å; R201-Q203 VanDerWaalsContact C-N 3.34Å; R201-N204 PolarHBondContact O-N 3.03Å; R201-E205 PolarHBondContact O-N 3.11Å
202L88.8Confident78.3Confident105 Ų105110.1 Ų110.155%0.5556%0.555SS.*Hα-helixtrans-64.5-39.8178-74.1169.1000111.8N198 L199 E205 L206N198-L202 WeakPolarHBondContact O-CG 3.32Å; N198-L202 PolarHBondContact O-N 3.48Å; L199-L202 PolarHBondContact O-N 2.95Å; L202-E205 PolarHBondContact O-N 3.08Å; L202-L206 PolarHBondContact O-N 3.28Å
203Q83.6Confident77.5Confident138 Ų138110.1 Ų110.165%0.64556%0.563SS**Hα-helixtrans-60.6-47.1174.3-165104.6-3.100111L199 T200 R201 E205 L206 D207L199-Q203 WeakPolarHBondContact O-CB 3.22Å; L199-Q203 PolarHBondContact O-N 3.35Å; T200-Q203 PolarHBondContact O-N 3.36Å; R201-Q203 VanDerWaalsContact C-N 3.34Å; Q203-E205 VanDerWaalsContact C-N 3.34Å; Q203-E205 PolarHBondContact O-N 2.88Å; Q203-L206 PolarHBondContact O-N 3.2Å; Q203-D207 PolarHBondContact O-N 2.94Å
204N84.4Confident76.5Confident101 Ų101111.2 Ų111.254%0.5457%0.568SS.*Hα-helixtrans-62.4-37.2177.2-82.6-7.8000112.9T200 R201 N208T200-N204 PolarHBondContact O-N 3.07Å; R201-N204 PolarHBondContact O-N 3.03Å; N204-N208 WeakPolarHBondContact O-CB 3.45Å; N204-N208 PolarHBondContact O-N 3.33Å; N204-N208 VanDerWaalsContact O-N 3.07Å
205E83.4Confident75.2Confident146 Ų146113.5 Ų113.568%0.68258%0.583SS**Hα-helixtrans-66.1-41.3173.2-88.4-133.5150.200112.4R201 L202 Q203 N208 R209R201-E205 PolarHBondContact O-N 3.11Å; L202-E205 PolarHBondContact O-N 3.08Å; Q203-E205 VanDerWaalsContact C-N 3.34Å; Q203-E205 PolarHBondContact O-N 2.88Å; E205-N208 PolarHBondContact O-N 2.87Å; E205-R209 WeakPolarHBondContact O-CB 3.17Å; E205-R209 PolarHBondContact O-N 2.9Å
206L79.6Confident73.4Confident122 Ų122115.4 Ų115.464%0.63959%0.592SS**Hα-helixtrans-64.4-40.4177.2-80.9161.2000112.1L202 Q203 R209 G210L202-L206 PolarHBondContact O-N 3.28Å; Q203-L206 PolarHBondContact O-N 3.2Å; L206-R209 PolarHBondContact O-N 3.46Å; L206-G210 PolarHBondContact O-N 3.09Å
207D76.1Confident71.5Confident113 Ų113114.9 Ų114.960%0.60460%0.597SS**Hα-helixtrans-64.2-46.6175.8-120.83.4000111.3Q203 R209 G210 E211Q203-D207 PolarHBondContact O-N 2.94Å; D207-R209 VanDerWaalsContact C-N 3.26Å; D207-R209 PolarHBondContact O-N 3.03Å; D207-G210 PolarHBondContact O-N 3.19Å; D207-G210 VanDerWaalsContact O-N 3.11Å; D207-E211 PolarHBondContact O-N 3.4Å
208N74.2Confident69.8Low113 Ų113116.9 Ų116.960%0.60461%0.609SS**Hα-helixtrans-61.4-34.5175.6-115-17.5000112.4N204 E205 S212N204-N208 WeakPolarHBondContact O-CB 3.45Å; N204-N208 PolarHBondContact O-N 3.33Å; N204-N208 VanDerWaalsContact O-N 3.07Å; E205-N208 PolarHBondContact O-N 2.87Å; N208-S212 PolarHBondContact O-N 3.17Å; N208-S212 VanDerWaalsContact O-N 3.15Å; N208-S212 PolarHBondContact O-OG 3.43Å
209R66.3Low68Low190 Ų190118.1 Ų118.172%0.71762%0.624SS**Hα-helixtrans-74.1-30.5176.7-135.3171.391.5168.76.9112.6E205 L206 D207 S212 S213E205-R209 WeakPolarHBondContact O-CB 3.17Å; E205-R209 PolarHBondContact O-N 2.9Å; L206-R209 PolarHBondContact O-N 3.46Å; D207-R209 VanDerWaalsContact C-N 3.26Å; D207-R209 PolarHBondContact O-N 3.03Å; R209-S212 WeakPolarHBondContact CA-OG 3.4Å; R209-S212 PolarHBondContact O-OG 2.72Å; R209-S213 PolarHBondContact O-N 3.4Å; R209-S213 PolarHBondContact O-OG 2.95Å
210G61.6Low66.1Low30 Ų30118.5 Ų118.531%0.30964%0.636SS.*Hα-helixtrans-67.2-45.7171.700000112.2L206 D207 S213 I214L206-G210 PolarHBondContact O-N 3.09Å; D207-G210 PolarHBondContact O-N 3.19Å; D207-G210 VanDerWaalsContact O-N 3.11Å; G210-S213 PolarHBondContact O-N 2.93Å; G210-S213 PolarHBondContact O-OG 3.19Å; G210-S213 VanDerWaalsContact O-OG 3.11Å; G210-I214 WeakPolarHBondContact O-CD1 3.47Å; G210-I214 VanDerWaalsContact O-CG1 3.28Å; G210-I214 WeakPolarHBondContact O-CG1 3.44Å; G210-I214 PolarHBondContact O-N 3.22Å
211E58.9Low64.4Low126 Ų126122.6 Ų122.659%0.58965%0.65SS**Hα-helixtrans-66.1-41177.7-79.5-166.6101.300113.2D207 S213 I214 L215D207-E211 PolarHBondContact O-N 3.4Å; E211-S213 VanDerWaalsContact C-N 3.32Å; E211-S213 PolarHBondContact O-N 2.69Å; E211-I214 PolarHBondContact O-N 3Å; E211-L215 PolarHBondContact O-N 3.14Å; E211-L215 VanDerWaalsContact O-N 3.15Å
212S58.8Low62Low64 Ų64123.4 Ų123.445%0.44866%0.659SS.*Hα-helixtrans-68.3-27.9179.243.40000113.6N208 R209N208-S212 PolarHBondContact O-N 3.17Å; N208-S212 VanDerWaalsContact O-N 3.15Å; N208-S212 PolarHBondContact O-OG 3.43Å; R209-S212 WeakPolarHBondContact CA-OG 3.4Å; R209-S212 PolarHBondContact O-OG 2.72Å
213S55.9Low60.6Low77 Ų77127.6 Ų127.654%0.53869%0.692SS.*Hα-helixtrans-80.8-26.3174.942.40000113.4R209 G210 E211 Q216R209-S213 PolarHBondContact O-N 3.4Å; R209-S213 PolarHBondContact O-OG 2.95Å; G210-S213 PolarHBondContact O-N 2.93Å; G210-S213 PolarHBondContact O-OG 3.19Å; G210-S213 VanDerWaalsContact O-OG 3.11Å; E211-S213 VanDerWaalsContact C-N 3.32Å; E211-S213 PolarHBondContact O-N 2.69Å; S213-Q216 PolarHBondContact O-N 2.75Å
214I55.6Low59.5Low138 Ų138127.1 Ų127.171%0.70870%0.695SS**Hα-helixtrans-71.7-34.8171.6-64.7164.8000111.1G210 E211 Q216G210-I214 WeakPolarHBondContact O-CD1 3.47Å; G210-I214 VanDerWaalsContact O-CG1 3.28Å; G210-I214 WeakPolarHBondContact O-CG1 3.44Å; G210-I214 PolarHBondContact O-N 3.22Å; E211-I214 PolarHBondContact O-N 3Å; I214-Q216 PolarHBondContact O-N 3.04Å
215L55Low58.2Low154 Ų154128.5 Ų128.581%0.80670%0.703SS**THydrogen-bonded Turntrans-72.5-10.2175.5-100.7138.8000114.3E211E211-L215 PolarHBondContact O-N 3.14Å; E211-L215 VanDerWaalsContact O-N 3.15Å
216Q48.6Very low56.8Low165 Ų165127.5 Ų127.577%0.77170%0.704SS**THydrogen-bonded Turntrans-113.822.1-177.8-149.5171.912.300113.6S213 I214S213-Q216 PolarHBondContact O-N 2.75Å; I214-Q216 PolarHBondContact O-N 3.04Å
217S41.7Very low55.4Low98 Ų98127.8 Ų127.869%0.68571%0.708SS**  trans-70.4120.5167.6-172.60000109.6S219S217-S219 PolarHBondContact O-N 3.45Å
218P46.4Very low54.1Low105 Ų105128.8 Ų128.868%0.68271%0.714SS**  trans-72.3126.9-16928-31.5000110.2S220P218-S220 PolarHBondContact O-N 3.49Å
219S50.2Low52.8Low113 Ų113129.8 Ų129.879%0.7972%0.721SS**  trans-57.588.6160.448.30000109.2S217 Q221S217-S219 PolarHBondContact O-N 3.45Å; S219-Q221 PolarHBondContact O-N 3.37Å
220S48.3Very low51.8Low119 Ų119125.5 Ų125.583%0.83272%0.722SS**  trans-70.693.8168.657.30000108.2P218P218-S220 PolarHBondContact O-N 3.49Å
221Q48.6Very low51.1Low168 Ų168132.8 Ų132.879%0.78575%0.754SS**  trans-101.5100.6175.9-168.3170.29.300108.2S219S219-Q221 PolarHBondContact O-N 3.37Å
222F36.7Very low50.4Low207 Ų207133.4 Ų133.491%0.90877%0.767SS**  trans-167.4155.2157.5-90.8-70000109.7
223P59.4Low49.7Very low193 Ų193139.7 Ų139.7100%1.25380%0.796SS**  cis-107.20-16.238-25.3000113.5

Retrieved 223 of 223 residues in 177.5 ms (Link to these results)