A0A087XHV8_POEFO Loading...

Chromosome 15 open reading frame 48

AlphaFold DB , UniProt , Accession A0A087XHV8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 85 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M53.3Low87.3Confident182 Ų182103.1 Ų103.190%0.89752%0.515SS*.  0121.80-139.6175.1-152.400107.3G3M1-G3 PolarHBondContact O-N 3.43Å
2S75.3Confident87.9Confident68 Ų68105.2 Ų105.248%0.47652%0.518SS..  trans-36.4125.2-1731610000113.9F4 I5 Q6S2-F4 PolarHBondContact O-N 3.33Å; S2-I5 PolarHBondContact O-N 3.19Å; S2-Q6 PolarHBondContact O-N 2.88Å; S2-Q6 VanDerWaalsContact O-N 3.14Å
3G88.6Confident88.4Confident54 Ų54107.1 Ų107.156%0.55753%0.525SS*.Hα-helixtrans-59.1-29.1-17700000113.7M1 Q6 L7M1-G3 PolarHBondContact O-N 3.43Å; G3-Q6 PolarHBondContact O-N 3.22Å; G3-L7 PolarHBondContact O-N 2.9Å
4F89.4Confident88.8Confident113 Ų113103.2 Ų103.250%0.49651%0.508SS..Hα-helixtrans-67.8-41.7174.6-175.6-106.4000112.4S2 Q6 L7 L8 V18S2-F4 PolarHBondContact O-N 3.33Å; F4-Q6 VanDerWaalsContact C-N 3.29Å; F4-Q6 PolarHBondContact O-N 3.31Å; F4-L7 WeakPolarHBondContact O-CB 3.42Å; F4-L7 PolarHBondContact O-N 3.05Å; F4-L8 HydrophobicContact CD1-CD1 4.03Å; F4-L8 HydrophobicContact CE1-CD1 3.55Å; F4-L8 HydrophobicContact CE1-CG 4.28Å; F4-L8 HydrophobicContact CZ-CD1 3.99Å; F4-L8 HydrophobicContact CZ-CG 4.38Å; F4-L8 PolarHBondContact O-N 2.98Å; F4-V18 HydrophobicContact CZ-CG1 4.03Å; F4-V18 HydrophobicContact CZ-CG2 4.4Å
5I90.6Very high89.2Confident83 Ų83101.4 Ų101.443%0.42650%0.5SS..Hα-helixtrans-66.5-36.6176.1-60179000110.2S2 K9S2-I5 PolarHBondContact O-N 3.19Å; I5-K9 HydrophobicContact CG2-CD 4.46Å; I5-K9 WeakPolarHBondContact O-CB 3.41Å; I5-K9 WeakPolarHBondContact O-CG 3.37Å; I5-K9 PolarHBondContact O-N 3.28Å
6Q93.1Very high89.7Confident96 Ų9699.6 Ų99.645%0.44950%0.498SS..Hα-helixtrans-65-39.9173.4-72-174.8-7.900112.3S2 G3 F4 K9 K10S2-Q6 PolarHBondContact O-N 2.88Å; S2-Q6 VanDerWaalsContact O-N 3.14Å; G3-Q6 PolarHBondContact O-N 3.22Å; F4-Q6 VanDerWaalsContact C-N 3.29Å; F4-Q6 PolarHBondContact O-N 3.31Å; Q6-K9 PolarHBondContact O-N 3.42Å; Q6-K10 WeakPolarHBondContact O-CG 3.36Å; Q6-K10 PolarHBondContact O-N 3.22Å
7L94Very high90.1Very high87 Ų87100.4 Ų100.446%0.45550%0.503SS..Hα-helixtrans-58.8-50.5175.1-18069.6000111.3G3 F4 K9 K10 R11 L14G3-L7 PolarHBondContact O-N 2.9Å; F4-L7 WeakPolarHBondContact O-CB 3.42Å; F4-L7 PolarHBondContact O-N 3.05Å; L7-K9 VanDerWaalsContact C-N 3.28Å; L7-K9 PolarHBondContact O-N 3.35Å; L7-K10 PolarHBondContact O-N 3.11Å; L7-K10 VanDerWaalsContact O-N 3.11Å; L7-R11 PolarHBondContact O-N 2.94Å; L7-L14 HydrophobicContact CG-CD1 4.48Å
8L93.3Very high90.4Very high32 Ų3296.9 Ų96.917%0.16849%0.488CS..Hα-helixtrans-63.8-31.9177.6-66.8177.9000112.9F4 R11 L14 I15 V18F4-L8 HydrophobicContact CD1-CD1 4.03Å; F4-L8 HydrophobicContact CE1-CD1 3.55Å; F4-L8 HydrophobicContact CE1-CG 4.28Å; F4-L8 HydrophobicContact CZ-CD1 3.99Å; F4-L8 HydrophobicContact CZ-CG 4.38Å; F4-L8 PolarHBondContact O-N 2.98Å; L8-R11 CarbonylContact O-C 3.55Å; L8-L14 HydrophobicContact CD2-CB 3.97Å; L8-I15 HydrophobicContact CB-CG1 4.27Å; L8-I15 HydrophobicContact CD2-CG1 4.37Å; L8-V18 HydrophobicContact CD2-CG2 4.12Å
9K92.4Very high90.7Very high117 Ų11793.8 Ų93.851%0.50948%0.484SS..Hα-helixtrans-69.3-36.3173.2-77.5-179.2179.6-174.40112.4I5 Q6 L7 K12I5-K9 HydrophobicContact CG2-CD 4.46Å; I5-K9 WeakPolarHBondContact O-CB 3.41Å; I5-K9 WeakPolarHBondContact O-CG 3.37Å; I5-K9 PolarHBondContact O-N 3.28Å; Q6-K9 PolarHBondContact O-N 3.42Å; L7-K9 VanDerWaalsContact C-N 3.28Å; L7-K9 PolarHBondContact O-N 3.35Å; K9-K12 VanDerWaalsContact O-CE 3.24Å; K9-K12 WeakPolarHBondContact O-CE 3.46Å
10K95.8Very high91.1Very high163 Ų16397 Ų9771%0.70949%0.494SS*.Hα-helixtrans-80.6-26.4179.4-73.2-175.9177.9-176.20113.6Q6 L7Q6-K10 WeakPolarHBondContact O-CG 3.36Å; Q6-K10 PolarHBondContact O-N 3.22Å; L7-K10 PolarHBondContact O-N 3.11Å; L7-K10 VanDerWaalsContact O-N 3.11Å
11R94.5Very high91.4Very high139 Ų13998.3 Ų98.353%0.52550%0.499SS..  trans-128.187.5-178.2-64.4-73.3-171.5-111.72.1109.4L7 L8 E13 L14L7-R11 PolarHBondContact O-N 2.94Å; L8-R11 CarbonylContact O-C 3.55Å; R11-E13 VanDerWaalsContact C-N 3.28Å; R11-E13 WeakPolarHBondContact CD-OE1 3.24Å; R11-E13 PolarHBondContact O-N 3.43Å; R11-L14 HydrophobicContact CB-CD1 3.74Å; R11-L14 HydrophobicContact CB-CG 3.98Å; R11-L14 HydrophobicContact CG-CD1 4.38Å; R11-L14 PolarHBondContact O-N 2.84Å
12K93.9Very high93.5Very high128 Ų12891.8 Ų91.856%0.55748%0.475SS*.THydrogen-bonded Turntrans-70.8-25.6-172.7-64.1-66.1-171.9172.30112.5K9 L14 I15K9-K12 VanDerWaalsContact O-CE 3.24Å; K9-K12 WeakPolarHBondContact O-CE 3.46Å; K12-L14 PolarHBondContact O-N 2.9Å; K12-I15 HydrophobicContact CB-CD1 4.5Å; K12-I15 HydrophobicContact CD-CD1 3.61Å; K12-I15 WeakPolarHBondContact O-CB 3.44Å; K12-I15 PolarHBondContact O-N 3.48Å
13E94.3Very high94.6Very high130 Ų13096.4 Ų96.461%0.60749%0.487SS*.THydrogen-bonded Turntrans-62.2-23.2175.766.3-88-172.200113.4R11 P16R11-E13 VanDerWaalsContact C-N 3.28Å; R11-E13 WeakPolarHBondContact CD-OE1 3.24Å; R11-E13 PolarHBondContact O-N 3.43Å; E13-P16 WeakPolarHBondContact O-CD 3.35Å; E13-P16 WeakPolarHBondContact O-CG 3.13Å
14L95.1Very high95.1Very high53 Ų5396.7 Ų96.728%0.27748%0.483SS..Hα-helixtrans-78.6-19179.5-61.7-179.4000113.3L7 L8 R11 K12 L17 V18L7-L14 HydrophobicContact CG-CD1 4.48Å; L8-L14 HydrophobicContact CD2-CB 3.97Å; R11-L14 HydrophobicContact CB-CD1 3.74Å; R11-L14 HydrophobicContact CB-CG 3.98Å; R11-L14 HydrophobicContact CG-CD1 4.38Å; R11-L14 PolarHBondContact O-N 2.84Å; K12-L14 PolarHBondContact O-N 2.9Å; L14-L17 HydrophobicContact CD2-CD2 4.25Å; L14-L17 PolarHBondContact O-N 3.03Å; L14-V18 WeakPolarHBondContact O-CB 3.43Å; L14-V18 WeakPolarHBondContact O-CG2 3.4Å; L14-V18 PolarHBondContact O-N 3.37Å
15I94.5Very high95.5Very high76 Ų7693.9 Ų93.939%0.3948%0.481SS..Hα-helixtrans-59.3-53.9-178.1-63.5173.2000111.7L8 K12 L17 V18 G19L8-I15 HydrophobicContact CB-CG1 4.27Å; L8-I15 HydrophobicContact CD2-CG1 4.37Å; K12-I15 HydrophobicContact CB-CD1 4.5Å; K12-I15 HydrophobicContact CD-CD1 3.61Å; K12-I15 WeakPolarHBondContact O-CB 3.44Å; K12-I15 PolarHBondContact O-N 3.48Å; I15-L17 VanDerWaalsContact C-N 3.31Å; I15-L17 PolarHBondContact O-N 2.89Å; I15-V18 PolarHBondContact O-N 3.39Å; I15-G19 PolarHBondContact O-N 3.47Å
16P96.6Very high95.9Very high73 Ų7394.5 Ų94.547%0.47449%0.489SS..Hα-helixtrans-63.1-38.3177.823.4-33.8000112.1E13 G19 F20E13-P16 WeakPolarHBondContact O-CD 3.35Å; E13-P16 WeakPolarHBondContact O-CG 3.13Å; P16-G19 PolarHBondContact O-N 2.94Å; P16-F20 HydrophobicContact CB-CE2 4.5Å; P16-F20 WeakPolarHBondContact O-CD2 3.39Å; P16-F20 PolarHBondContact O-N 3.21Å
17L96.6Very high96.1Very high112 Ų11291.8 Ų91.859%0.58649%0.486SS*.Hα-helixtrans-60.7-50.6178.7-178.765.3000111.8L14 I15 G19 F20 M21L14-L17 HydrophobicContact CD2-CD2 4.25Å; L14-L17 PolarHBondContact O-N 3.03Å; I15-L17 VanDerWaalsContact C-N 3.31Å; I15-L17 PolarHBondContact O-N 2.89Å; L17-G19 VanDerWaalsContact C-N 3.28Å; L17-G19 PolarHBondContact O-N 3.44Å; L17-F20 PolarHBondContact O-N 2.9Å; L17-M21 WeakPolarHBondContact O-CB 3.36Å; L17-M21 PolarHBondContact O-N 3.45Å
18V96Very high96.2Very high38 Ų3890.4 Ų90.423%0.2349%0.487CS..Hα-helixtrans-64-36.7176171.30000110.8F4 L8 L14 I15 M21 A22F4-V18 HydrophobicContact CZ-CG1 4.03Å; F4-V18 HydrophobicContact CZ-CG2 4.4Å; L8-V18 HydrophobicContact CD2-CG2 4.12Å; L14-V18 WeakPolarHBondContact O-CB 3.43Å; L14-V18 WeakPolarHBondContact O-CG2 3.4Å; L14-V18 PolarHBondContact O-N 3.37Å; I15-V18 PolarHBondContact O-N 3.39Å; V18-M21 PolarHBondContact O-N 3.38Å; V18-A22 WeakPolarHBondContact O-CB 3.19Å; V18-A22 PolarHBondContact O-N 3.2Å
19G96.4Very high96.5Very high39 Ų3992.8 Ų92.840%0.40250%0.504SS..Hα-helixtrans-58.7-52.9176.100000112.8I15 P16 L17 A22 F23I15-G19 PolarHBondContact O-N 3.47Å; P16-G19 PolarHBondContact O-N 2.94Å; L17-G19 VanDerWaalsContact C-N 3.28Å; L17-G19 PolarHBondContact O-N 3.44Å; G19-A22 PolarHBondContact O-N 3.39Å; G19-F23 WeakPolarHBondContact O-CB 3.34Å; G19-F23 PolarHBondContact O-N 3.29Å
20F98.1Very high96.7Very high157 Ų15790.8 Ų90.869%0.68950%0.504SS*.Hα-helixtrans-64.7-41.7178-73.8-63.9000112.4P16 L17 F23 A24P16-F20 HydrophobicContact CB-CE2 4.5Å; P16-F20 WeakPolarHBondContact O-CD2 3.39Å; P16-F20 PolarHBondContact O-N 3.21Å; L17-F20 PolarHBondContact O-N 2.9Å; F20-F23 PolarHBondContact O-N 3.47Å; F20-A24 WeakPolarHBondContact O-CB 3.33Å; F20-A24 PolarHBondContact O-N 3.01Å
21M97.8Very high96.7Very high124 Ų12484.8 Ų84.861%0.61149%0.485SS*.Hα-helixtrans-61.8-46.4177.1-178.3-17966.900111.5L17 V18 A24 A25L17-M21 WeakPolarHBondContact O-CB 3.36Å; L17-M21 PolarHBondContact O-N 3.45Å; V18-M21 PolarHBondContact O-N 3.38Å; M21-A24 PolarHBondContact O-N 3.14Å; M21-A25 WeakPolarHBondContact O-CB 3.35Å; M21-A25 PolarHBondContact O-N 3.05Å
22A97.6Very high96.7Very high46 Ų4681.9 Ų81.938%0.3849%0.486SS..Hα-helixtrans-63-45.7177.500000110.9V18 G19 A24 A25 T26V18-A22 WeakPolarHBondContact O-CB 3.19Å; V18-A22 PolarHBondContact O-N 3.2Å; G19-A22 PolarHBondContact O-N 3.39Å; A22-A24 VanDerWaalsContact C-N 3.33Å; A22-A24 PolarHBondContact O-N 2.87Å; A22-A25 PolarHBondContact O-N 3.02Å; A22-T26 WeakPolarHBondContact O-CB 3.49Å; A22-T26 PolarHBondContact O-N 2.86Å; A22-T26 PolarHBondContact O-OG1 3.33Å
23F98.2Very high96.8Very high165 Ų16579.9 Ų79.972%0.72448%0.481SS*.Hα-helixtrans-57.9-45.7176.5-177.3-100.5000111.9G19 F20 G27G19-F23 WeakPolarHBondContact O-CB 3.34Å; G19-F23 PolarHBondContact O-N 3.29Å; F20-F23 PolarHBondContact O-N 3.47Å; F23-G27 PolarHBondContact O-N 3.41Å
24A98.3Very high96.9Very high59 Ų5977.1 Ų77.149%0.48847%0.465SS..Hα-helixtrans-63.7-46.5177.200000112F20 M21 A22 G27 A28F20-A24 WeakPolarHBondContact O-CB 3.33Å; F20-A24 PolarHBondContact O-N 3.01Å; M21-A24 PolarHBondContact O-N 3.14Å; A22-A24 VanDerWaalsContact C-N 3.33Å; A22-A24 PolarHBondContact O-N 2.87Å; A24-G27 PolarHBondContact O-N 2.91Å; A24-A28 WeakPolarHBondContact O-CB 3.38Å; A24-A28 PolarHBondContact O-N 2.87Å
25A98.3Very high96.8Very high54 Ų5479.3 Ų79.345%0.44647%0.473SS..Hα-helixtrans-63-44.7179.400000111.9M21 A22 T29M21-A25 WeakPolarHBondContact O-CB 3.35Å; M21-A25 PolarHBondContact O-N 3.05Å; A22-A25 PolarHBondContact O-N 3.02Å; A25-T29 WeakPolarHBondContact O-CB 3.37Å; A25-T29 PolarHBondContact O-N 2.86Å; A25-T29 PolarHBondContact O-OG1 2.74Å
26T98.3Very high96.7Very high97 Ų9778.7 Ų78.760%0.59547%0.47SS*.Hα-helixtrans-63.6-44.7175.3-59.10000111.2A22 T29 S30A22-T26 WeakPolarHBondContact O-CB 3.49Å; A22-T26 PolarHBondContact O-N 2.86Å; A22-T26 PolarHBondContact O-OG1 3.33Å; T26-T29 PolarHBondContact O-N 2.99Å; T26-S30 VanDerWaalsContact O-CB 3.26Å; T26-S30 WeakPolarHBondContact O-CB 3.35Å; T26-S30 PolarHBondContact O-N 2.89Å
27G97.4Very high96.5Very high38 Ų3882.9 Ų82.939%0.39248%0.481SS..Hα-helixtrans-60.6-46.8177.100000112.7F23 A24 T29 S30 A31F23-G27 PolarHBondContact O-N 3.41Å; A24-G27 PolarHBondContact O-N 2.91Å; G27-T29 PolarHBondContact O-N 3.39Å; G27-S30 PolarHBondContact O-N 3.49Å; G27-A31 WeakPolarHBondContact O-CB 3.26Å; G27-A31 PolarHBondContact O-N 3Å
28A97.8Very high96.2Very high58 Ų5881.1 Ų81.148%0.47948%0.475SS..Hα-helixtrans-63.5-42.5178.200000112.1A24 S32A24-A28 WeakPolarHBondContact O-CB 3.38Å; A24-A28 PolarHBondContact O-N 2.87Å; A28-S32 WeakPolarHBondContact O-CB 3.37Å; A28-S32 PolarHBondContact O-N 3.49Å; A28-S32 PolarHBondContact O-OG 2.69Å
29T98.1Very high95.9Very high83 Ų8380.8 Ų80.851%0.50947%0.471SS..Hα-helixtrans-65.2-45.5177.7-54.20000110.8A25 T26 G27 S32 L33A25-T29 WeakPolarHBondContact O-CB 3.37Å; A25-T29 PolarHBondContact O-N 2.86Å; A25-T29 PolarHBondContact O-OG1 2.74Å; T26-T29 PolarHBondContact O-N 2.99Å; G27-T29 PolarHBondContact O-N 3.39Å; T29-S32 PolarHBondContact O-N 3.28Å; T29-L33 HydrophobicContact CG2-CD1 4.15Å; T29-L33 WeakPolarHBondContact O-CG 3.29Å; T29-L33 PolarHBondContact O-N 3.39Å
30S97.1Very high95.6Very high74 Ų7480.3 Ų80.352%0.51746%0.461SS..Hα-helixtrans-62.3-45.5178179.90000112T26 G27 S32 L33 Y34T26-S30 VanDerWaalsContact O-CB 3.26Å; T26-S30 WeakPolarHBondContact O-CB 3.35Å; T26-S30 PolarHBondContact O-N 2.89Å; G27-S30 PolarHBondContact O-N 3.49Å; S30-S32 PolarHBondContact O-N 2.75Å; S30-L33 PolarHBondContact O-N 2.98Å; S30-Y34 WeakPolarHBondContact O-CB 3.4Å; S30-Y34 PolarHBondContact O-N 3.36Å
31A95.1Very high95.1Very high38 Ų3877.4 Ų77.431%0.31445%0.453SS..Hα-helixtrans-62.9-41.3177.100000112.1G27 Y34 F35G27-A31 WeakPolarHBondContact O-CB 3.26Å; G27-A31 PolarHBondContact O-N 3Å; A31-Y34 PolarHBondContact O-N 3.37Å; A31-F35 HydrophobicContact CB-CE2 4.39Å; A31-F35 VanDerWaalsContact O-CD2 3.29Å; A31-F35 WeakPolarHBondContact O-CD2 3.31Å; A31-F35 VanDerWaalsContact O-CG 3.28Å; A31-F35 WeakPolarHBondContact O-CG 3.39Å; A31-F35 PolarHBondContact O-N 3.41Å
32S95.9Very high94.7Very high77 Ų7774.5 Ų74.554%0.53844%0.442SS..Hα-helixtrans-62.1-45.7177.1-58.30000111.7A28 T29 S30 F35 L36A28-S32 WeakPolarHBondContact O-CB 3.37Å; A28-S32 PolarHBondContact O-N 3.49Å; A28-S32 PolarHBondContact O-OG 2.69Å; T29-S32 PolarHBondContact O-N 3.28Å; S30-S32 PolarHBondContact O-N 2.75Å; S32-F35 PolarHBondContact O-N 2.62Å; S32-L36 VanDerWaalsContact O-CB 3.32Å; S32-L36 WeakPolarHBondContact O-CB 3.39Å; S32-L36 PolarHBondContact O-N 3.33Å
33L96.4Very high94.4Very high86 Ų8674.1 Ų74.145%0.4543%0.433SS..Hα-helixtrans-63.7-44.4175.4-69168000111.3T29 S30 F35 L36 F37T29-L33 HydrophobicContact CG2-CD1 4.15Å; T29-L33 WeakPolarHBondContact O-CG 3.29Å; T29-L33 PolarHBondContact O-N 3.39Å; S30-L33 PolarHBondContact O-N 2.98Å; L33-F35 VanDerWaalsContact C-N 3.35Å; L33-F35 PolarHBondContact O-N 2.94Å; L33-L36 PolarHBondContact O-N 2.87Å; L33-F37 HydrophobicContact CB-CD2 4.4Å; L33-F37 HydrophobicContact CB-CE2 4.34Å; L33-F37 HydrophobicContact CD2-CE2 3.89Å; L33-F37 WeakPolarHBondContact O-CD2 3.35Å; L33-F37 PolarHBondContact O-N 3.2Å
34Y94.4Very high94Very high72 Ų7273.3 Ų73.328%0.28244%0.436SS..Hα-helixtrans-57-47.9176169.9-99.9000111.3S30 A31 F37 T38 K39 L64S30-Y34 WeakPolarHBondContact O-CB 3.4Å; S30-Y34 PolarHBondContact O-N 3.36Å; A31-Y34 PolarHBondContact O-N 3.37Å; Y34-F37 PolarHBondContact O-N 3.3Å; Y34-T38 HydrophobicContact CD2-CG2 3.81Å; Y34-T38 HydrophobicContact CE2-CG2 3.78Å; Y34-T38 WeakPolarHBondContact CE2-OG1 3.28Å; Y34-T38 VanDerWaalsContact O-CB 3.31Å; Y34-T38 WeakPolarHBondContact O-CB 3.48Å; Y34-T38 WeakPolarHBondContact O-CG2 3.4Å; Y34-T38 PolarHBondContact O-N 2.88Å; Y34-T38 PolarHBondContact O-OG1 3.43Å; Y34-K39 PolarHBondContact OH-NZ 3.48Å; Y34-L64 HydrophobicContact CE1-CD1 4.18Å; Y34-L64 HydrophobicContact CE2-CD1 4.43Å
35F93.4Very high93.6Very high100 Ų10076.1 Ų76.144%0.43944%0.443SS..Hα-helixtrans-65.6-42.7179.1-64.4-32.9000112.3A31 S32 L33 F37 K39 V42A31-F35 HydrophobicContact CB-CE2 4.39Å; A31-F35 VanDerWaalsContact O-CD2 3.29Å; A31-F35 WeakPolarHBondContact O-CD2 3.31Å; A31-F35 VanDerWaalsContact O-CG 3.28Å; A31-F35 WeakPolarHBondContact O-CG 3.39Å; A31-F35 PolarHBondContact O-N 3.41Å; S32-F35 PolarHBondContact O-N 2.62Å; L33-F35 VanDerWaalsContact C-N 3.35Å; L33-F35 PolarHBondContact O-N 2.94Å; F35-F37 VanDerWaalsContact C-N 3.27Å; F35-F37 PolarHBondContact O-N 3.43Å; F35-K39 HydrophobicContact CB-CG 4.31Å; F35-K39 HydrophobicContact CD1-CG 3.79Å; F35-K39 HydrophobicContact CG-CG 4.46Å; F35-K39 WeakPolarHBondContact O-CB 2.93Å; F35-K39 PolarHBondContact O-N 3.37Å; F35-V42 HydrophobicContact CB-CG2 4.07Å
36L93.8Very high93.1Very high63 Ų6381.3 Ų81.333%0.3346%0.455SS..Hα-helixtrans-59.2-38.1178.8-177.260.9000112.8S32 L33 V42 L44S32-L36 VanDerWaalsContact O-CB 3.32Å; S32-L36 WeakPolarHBondContact O-CB 3.39Å; S32-L36 PolarHBondContact O-N 3.33Å; L33-L36 PolarHBondContact O-N 2.87Å; L36-V42 HydrophobicContact CD1-CG1 3.75Å; L36-L44 HydrophobicContact CD1-CD1 3.96Å; L36-L44 HydrophobicContact CD1-CD2 3.8Å; L36-L44 HydrophobicContact CD1-CG 3.83Å
37F91.9Very high92.6Very high161 Ų16180.3 Ų80.371%0.70645%0.452SS*.Hα-helixtrans-94.9-20-176-65.5-57.5000114.8L33 Y34 F35L33-F37 HydrophobicContact CB-CD2 4.4Å; L33-F37 HydrophobicContact CB-CE2 4.34Å; L33-F37 HydrophobicContact CD2-CE2 3.89Å; L33-F37 WeakPolarHBondContact O-CD2 3.35Å; L33-F37 PolarHBondContact O-N 3.2Å; Y34-F37 PolarHBondContact O-N 3.3Å; F35-F37 VanDerWaalsContact C-N 3.27Å; F35-F37 PolarHBondContact O-N 3.43Å
38T89.7Confident91.9Very high74 Ų7487.3 Ų87.345%0.45448%0.475SS..Hα-helixtrans-117.7-17.8-171.869.90000115Y34Y34-T38 HydrophobicContact CD2-CG2 3.81Å; Y34-T38 HydrophobicContact CE2-CG2 3.78Å; Y34-T38 WeakPolarHBondContact CE2-OG1 3.28Å; Y34-T38 VanDerWaalsContact O-CB 3.31Å; Y34-T38 WeakPolarHBondContact O-CB 3.48Å; Y34-T38 WeakPolarHBondContact O-CG2 3.4Å; Y34-T38 PolarHBondContact O-N 2.88Å; Y34-T38 PolarHBondContact O-OG1 3.43Å
39K90.5Very high91.2Very high31 Ų3190.9 Ų90.914%0.13549%0.486CS..  trans-103.2127.4-177.4-58-62.4166.2-162.10110.6Y34 F35 D41 V42 Q62Y34-K39 PolarHBondContact OH-NZ 3.48Å; F35-K39 HydrophobicContact CB-CG 4.31Å; F35-K39 HydrophobicContact CD1-CG 3.79Å; F35-K39 HydrophobicContact CG-CG 4.46Å; F35-K39 WeakPolarHBondContact O-CB 2.93Å; F35-K39 PolarHBondContact O-N 3.37Å; K39-D41 PolarHBondContact O-N 3.28Å; K39-V42 HydrophobicContact CB-CG2 4.32Å; K39-V42 PolarHBondContact O-N 3.46Å; K39-Q62 WeakPolarHBondContact CE-O 3.37Å; K39-Q62 PolarHBondContact NZ-O 2.92Å
40S88.9Confident90.5Very high30 Ų3088.2 Ų88.221%0.2147%0.469CS..THydrogen-bonded Turntrans-65.6-23.4176.652.20000112.9V42 I43 P52 L56S40-V42 VanDerWaalsContact C-N 3.29Å; S40-V42 PolarHBondContact O-N 3.32Å; S40-I43 WeakPolarHBondContact O-CG1 3.37Å; S40-P52 WeakPolarHBondContact O-CB 3.19Å; S40-P52 PolarHBondContact OG-O 3.22Å; S40-L56 WeakPolarHBondContact OG-CD2 3.47Å
41D87.8Confident90.2Very high95 Ų9588.3 Ų88.351%0.50846%0.462SS..THydrogen-bonded Turntrans-72.3-20.9179.9-55.7-37.5000113.2K39 I43K39-D41 PolarHBondContact O-N 3.28Å; D41-I43 PolarHBondContact O-N 3.31Å
42V90.9Very high89.8Confident63 Ų6387.5 Ų87.538%0.38245%0.453SS..  trans-89.494.5177.6-174.90000109.2F35 L36 K39 S40F35-V42 HydrophobicContact CB-CG2 4.07Å; L36-V42 HydrophobicContact CD1-CG1 3.75Å; K39-V42 HydrophobicContact CB-CG2 4.32Å; K39-V42 PolarHBondContact O-N 3.46Å; S40-V42 VanDerWaalsContact C-N 3.29Å; S40-V42 PolarHBondContact O-N 3.32Å
43I89.8Confident89.4Confident38 Ų3891.6 Ų91.620%0.19546%0.457CS..  trans-108.5118.9-177.5-63.2178.7000110S40 D41 N45 K46 P50 P52S40-I43 WeakPolarHBondContact O-CG1 3.37Å; D41-I43 PolarHBondContact O-N 3.31Å; I43-N45 VanDerWaalsContact CG2-C 3.43Å; I43-N45 WeakPolarHBondContact CG2-O 3.38Å; I43-K46 HydrophobicContact CG2-CG 4.12Å; I43-P50 HydrophobicContact CD1-CB 3.98Å; I43-P50 HydrophobicContact CD1-CG 3.66Å; I43-P50 HydrophobicContact CG2-CG 4.15Å; I43-P52 HydrophobicContact CD1-CB 3.71Å; I43-P52 HydrophobicContact CD1-CG 3.79Å; I43-P52 HydrophobicContact CG1-CB 4.5Å
44L90.5Very high88.9Confident149 Ų14990 Ų9078%0.7845%0.447SS*.SBendtrans-80-37.2172.7-62.5-176.9000112.4L36L36-L44 HydrophobicContact CD1-CD1 3.96Å; L36-L44 HydrophobicContact CD1-CD2 3.8Å; L36-L44 HydrophobicContact CD1-CG 3.83Å
45N89.3Confident88.4Confident118 Ų11894.4 Ų94.463%0.63146%0.463SS*.  trans-110.4109.4179.3-1761.6000110.8I43 S47I43-N45 VanDerWaalsContact CG2-C 3.43Å; I43-N45 WeakPolarHBondContact CG2-O 3.38Å; N45-S47 VanDerWaalsContact C-N 3.35Å; N45-S47 WeakPolarHBondContact OD1-CB 3.32Å; N45-S47 PolarHBondContact OD1-N 3.32Å
46K87.6Confident88.2Confident162 Ų16292.6 Ų92.670%0.70446%0.458SS*.  trans-92.412.9178.8-64.9-173.1179.5-176.60114I43 E48 N49 P50I43-K46 HydrophobicContact CG2-CG 4.12Å; K46-E48 PolarHBondContact O-N 2.94Å; K46-N49 PolarHBondContact O-N 3.04Å; K46-P50 WeakPolarHBondContact O-CD 2.93Å
47S87.4Confident87.8Confident77 Ų7792.3 Ų92.354%0.53846%0.457SS..THydrogen-bonded Turntrans-53.3139.6173.5-169.10000110.2N45 N49N45-S47 VanDerWaalsContact C-N 3.35Å; N45-S47 WeakPolarHBondContact OD1-CB 3.32Å; N45-S47 PolarHBondContact OD1-N 3.32Å; S47-N49 VanDerWaalsContact C-N 3.3Å; S47-N49 PolarHBondContact O-N 3.45Å
48E84.1Confident87.5Confident185 Ų18586.1 Ų86.186%0.86443%0.433SS*.THydrogen-bonded Turntrans67.318179.4-50.8-177.5168.500116.2K46K46-E48 PolarHBondContact O-N 2.94Å
49N82.1Confident87.2Confident133 Ų13386.7 Ų86.771%0.71144%0.44SS*.  trans50.861.9175.9-170.152.5000113K46 S47K46-N49 PolarHBondContact O-N 3.04Å; S47-N49 VanDerWaalsContact C-N 3.3Å; S47-N49 PolarHBondContact O-N 3.45Å
50P84.9Confident87Confident26 Ų2691.3 Ų91.317%0.16946%0.46CS..  trans-62.6144.9-176.927.2-34.6000110.9I43 K46 P52I43-P50 HydrophobicContact CD1-CB 3.98Å; I43-P50 HydrophobicContact CD1-CG 3.66Å; I43-P50 HydrophobicContact CG2-CG 4.15Å; K46-P50 WeakPolarHBondContact O-CD 2.93Å; P50-P52 VanDerWaalsContact C-CD 3.44Å; P50-P52 WeakPolarHBondContact O-CD 3.07Å
51E89.4Confident86.9Confident77 Ų7793.8 Ų93.836%0.3648%0.475SS..  trans-99.186.1172.7-63.5-173.4-172.100110.3W53 E54E51-W53 HydrophobicContact CB-CD2 4.49Å; E51-W53 HydrophobicContact CB-CZ2 3.89Å; E51-W53 HydrophobicContact CG-CZ2 3.82Å; E51-W53 PolarHBondContact O-N 3.31Å; E51-W53 VanDerWaalsContact O-N 3.17Å; E51-E54 HydrophobicContact CB-CB 4.33Å; E51-E54 HydrophobicContact CB-CG 3.76Å; E51-E54 WeakPolarHBondContact O-CB 3.35Å; E51-E54 PolarHBondContact O-N 2.9Å; E51-E54 VanDerWaalsContact OE2-CG 3.31Å; E51-E54 WeakPolarHBondContact OE2-CG 3.45Å
52P88Confident86.8Confident20 Ų2092.5 Ų92.513%0.1347%0.466CS..G310 helixtrans-56.6-33.4-173.19.4-23.1000114.7S40 I43 P50 E54 R55S40-P52 WeakPolarHBondContact O-CB 3.19Å; S40-P52 PolarHBondContact OG-O 3.22Å; I43-P52 HydrophobicContact CD1-CB 3.71Å; I43-P52 HydrophobicContact CD1-CG 3.79Å; I43-P52 HydrophobicContact CG1-CB 4.5Å; P50-P52 VanDerWaalsContact C-CD 3.44Å; P50-P52 WeakPolarHBondContact O-CD 3.07Å; P52-E54 VanDerWaalsContact C-N 3.25Å; P52-E54 PolarHBondContact O-N 3.48Å; P52-R55 PolarHBondContact O-N 3.04Å
53W85.8Confident86.6Confident164 Ų16497 Ų9762%0.62148%0.48SS*.G310 helixtrans-66.3-26.2179.252.180.5000112.7E51 R55 L56E51-W53 HydrophobicContact CB-CD2 4.49Å; E51-W53 HydrophobicContact CB-CZ2 3.89Å; E51-W53 HydrophobicContact CG-CZ2 3.82Å; E51-W53 PolarHBondContact O-N 3.31Å; E51-W53 VanDerWaalsContact O-N 3.17Å; W53-R55 PolarHBondContact O-N 3.36Å; W53-L56 HydrophobicContact CB-CD1 4.28Å; W53-L56 WeakPolarHBondContact O-CB 3.44Å; W53-L56 PolarHBondContact O-N 3.38Å
54E86.1Confident86.5Confident51 Ų51101.7 Ų101.724%0.23851%0.506CS..G310 helixtrans-73.5-16.6177.9-68.2-166.4114.400113.7E51 P52 K81 K85E51-E54 HydrophobicContact CB-CB 4.33Å; E51-E54 HydrophobicContact CB-CG 3.76Å; E51-E54 WeakPolarHBondContact O-CB 3.35Å; E51-E54 PolarHBondContact O-N 2.9Å; E51-E54 VanDerWaalsContact OE2-CG 3.31Å; E51-E54 WeakPolarHBondContact OE2-CG 3.45Å; P52-E54 VanDerWaalsContact C-N 3.25Å; P52-E54 PolarHBondContact O-N 3.48Å; E54-K81 PolarHBondContact O-NZ 3.22Å; E54-K85 VanDerWaalsContact CD-NZ 3.34Å; E54-K85 WeakPolarHBondContact OE1-CE 3.31Å; E54-K85 IonicContact OE1-NZ 3.31Å; E54-K85 PolarHBondContact OE1-NZ 3.29Å; E54-K85 IonicContact OE2-NZ 2.55Å; E54-K85 PolarHBondContact OE2-NZ 2.89Å
55R85.6Confident86.4Confident165 Ų165101 Ų10162%0.62350%0.501SS*.G310 helixtrans-91.8-3.1179.2-59.4178.8-177.5165.5-0.1112.4P52 W53P52-R55 PolarHBondContact O-N 3.04Å; W53-R55 PolarHBondContact O-N 3.36Å
56L87.3Confident86.5Confident63 Ų6397.8 Ų97.833%0.3349%0.486SS..  trans-70.1129.6177.7-68.8169.8000110.1S40 W53 P58S40-L56 WeakPolarHBondContact OG-CD2 3.47Å; W53-L56 HydrophobicContact CB-CD1 4.28Å; W53-L56 WeakPolarHBondContact O-CB 3.44Å; W53-L56 PolarHBondContact O-N 3.38Å; L56-P58 WeakPolarHBondContact O-CD 3.3Å
57D86.4Confident86.6Confident57 Ų5796.7 Ų96.731%0.30549%0.486SS..  trans-87.8110.9171.1-177.7-9.4000109.2S59 K60 Q62D57-S59 PolarHBondContact O-N 3.36Å; D57-S59 VanDerWaalsContact OD1-CB 3.22Å; D57-S59 WeakPolarHBondContact OD1-CB 3.16Å; D57-S59 PolarHBondContact OD1-N 3.23Å; D57-S59 PolarHBondContact OD1-OG 3.17Å; D57-K60 HydrophobicContact CB-CB 4.36Å; D57-K60 HydrophobicContact CB-CD 4.23Å; D57-K60 HydrophobicContact CB-CG 4.38Å; D57-K60 PolarHBondContact O-N 3.29Å; D57-K60 VanDerWaalsContact OD2-CD 3.23Å; D57-K60 WeakPolarHBondContact OD2-CD 3.31Å; D57-K60 WeakPolarHBondContact OD2-CE 3.47Å; D57-K60 WeakPolarHBondContact OD2-CG 3.19Å; D57-K60 IonicContact OD2-NZ 3.64Å; D57-Q62 PolarHBondContact O-NE2 3.17Å
58P84.6Confident86.6Confident30 Ų3099.7 Ų99.720%0.19550%0.496CS..THydrogen-bonded Turntrans-66.6-20.5-179.228-34.4000112.6L56 K60 W71 P73L56-P58 WeakPolarHBondContact O-CD 3.3Å; P58-K60 VanDerWaalsContact C-N 3.28Å; P58-K60 PolarHBondContact O-N 3.05Å; P58-W71 HydrophobicContact CB-CE3 3.7Å; P58-W71 HydrophobicContact CB-CZ3 4.13Å; P58-P73 HydrophobicContact CG-CB 3.98Å
59S84.1Confident86.6Confident87 Ų8793.9 Ų93.961%0.60847%0.469SS*.THydrogen-bonded Turntrans-79.1-13.4-178.7-48.30000112.8D57D57-S59 PolarHBondContact O-N 3.36Å; D57-S59 VanDerWaalsContact OD1-CB 3.22Å; D57-S59 WeakPolarHBondContact OD1-CB 3.16Å; D57-S59 PolarHBondContact OD1-N 3.23Å; D57-S59 PolarHBondContact OD1-OG 3.17Å
60K86.1Confident86.6Confident127 Ų12794.6 Ų94.655%0.55247%0.468SS*.SBendtrans-105.6147.4-177-72.4179.1-177.4166.50112.5D57 P58 Q62 Q69D57-K60 HydrophobicContact CB-CB 4.36Å; D57-K60 HydrophobicContact CB-CD 4.23Å; D57-K60 HydrophobicContact CB-CG 4.38Å; D57-K60 PolarHBondContact O-N 3.29Å; D57-K60 VanDerWaalsContact OD2-CD 3.23Å; D57-K60 WeakPolarHBondContact OD2-CD 3.31Å; D57-K60 WeakPolarHBondContact OD2-CE 3.47Å; D57-K60 WeakPolarHBondContact OD2-CG 3.19Å; D57-K60 IonicContact OD2-NZ 3.64Å; P58-K60 VanDerWaalsContact C-N 3.28Å; P58-K60 PolarHBondContact O-N 3.05Å; K60-Q62 PolarHBondContact O-N 3.38Å; K60-Q62 PolarHBondContact O-NE2 3.29Å; K60-Q69 VanDerWaalsContact C-NE2 3.33Å; K60-Q69 PolarHBondContact O-NE2 3.17Å
61P87.6Confident86.4Confident82 Ų82102.1 Ų102.153%0.53249%0.493SS..  trans-60122.4170.9-25.935.9000113.8Q69P61-Q69 VanDerWaalsContact CA-OE1 3.24Å
62Q84.5Confident86.1Confident69 Ų69105.5 Ų105.532%0.32251%0.507SS..  trans-92-16.3-179.2-63.1-56.2-26.800113.4K39 D57 K60K39-Q62 WeakPolarHBondContact CE-O 3.37Å; K39-Q62 PolarHBondContact NZ-O 2.92Å; D57-Q62 PolarHBondContact O-NE2 3.17Å; K60-Q62 PolarHBondContact O-N 3.38Å; K60-Q62 PolarHBondContact O-NE2 3.29Å
63K87.8Confident85.9Confident156 Ų156107.4 Ų107.468%0.67852%0.519SS*.SBendtrans-99.8157.4176.6-62.5-178-177.8179.60110.7I65 T66K63-I65 WeakPolarHBondContact CB-O 3.22Å; K63-I65 PolarHBondContact O-N 3.29Å; K63-T66 PolarHBondContact O-OG1 2.98Å
64L86.6Confident86.1Confident138 Ų138102.8 Ų102.872%0.72351%0.509SS*.SBendtrans-56.4-37.8175.2-175.268000111.6Y34Y34-L64 HydrophobicContact CE1-CD1 4.18Å; Y34-L64 HydrophobicContact CE2-CD1 4.43Å
65I89.9Confident86.3Confident133 Ų133108.3 Ų108.368%0.68254%0.535SS*.SBendtrans-129.8128.7173.3-57.2175.4000107K63K63-I65 WeakPolarHBondContact CB-O 3.22Å; K63-I65 PolarHBondContact O-N 3.29Å
66T90.3Very high86.5Confident52 Ų52105 Ų10532%0.31953%0.533SS..  trans-130.5134.3176-41.60000110K63 Q69K63-T66 PolarHBondContact O-OG1 2.98Å; T66-Q69 HydrophobicContact CG2-CB 3.74Å; T66-Q69 HydrophobicContact CG2-CG 4.4Å
67I89.9Confident86.6Confident139 Ų139107.7 Ų107.771%0.71355%0.547SS*.SBendtrans-119.8127.5177.9-57.2173.5000106.6Q69I67-Q69 PolarHBondContact O-N 3.42Å
68N87.6Confident86.6Confident140 Ų140110.2 Ų110.275%0.74956%0.557SS**SBendtrans52.249.4177.4-58.4-31.5000113.6Q70N68-Q70 PolarHBondContact O-N 3.09Å
69Q83.6Confident87Confident63 Ų63114.4 Ų114.429%0.29458%0.576SS.*  trans-60.2123.3176.2-178.6159-52.200110.8K60 P61 T66 I67 W71K60-Q69 VanDerWaalsContact C-NE2 3.33Å; K60-Q69 PolarHBondContact O-NE2 3.17Å; P61-Q69 VanDerWaalsContact CA-OE1 3.24Å; T66-Q69 HydrophobicContact CG2-CB 3.74Å; T66-Q69 HydrophobicContact CG2-CG 4.4Å; I67-Q69 PolarHBondContact O-N 3.42Å; Q69-W71 HydrophobicContact CG-CB 4.06Å
70Q82.9Confident87.3Confident147 Ų147114.4 Ų114.469%0.68757%0.572SS**  trans-109.47.2177.6-62.7-61.9-28.700113.1N68 K72N68-Q70 PolarHBondContact O-N 3.09Å; Q70-K72 PolarHBondContact O-N 3.47Å
71W80.3Confident87.3Confident185 Ų185112.5 Ų112.570%0.70156%0.564SS**  trans-64.9125.8179.3-109.985.5000110.1P58 Q69P58-W71 HydrophobicContact CB-CE3 3.7Å; P58-W71 HydrophobicContact CB-CZ3 4.13Å; Q69-W71 HydrophobicContact CG-CB 4.06Å
72K82.7Confident87.4Confident147 Ų147112.6 Ų112.664%0.63957%0.566SS**  trans-131149.2178.9-66.7-176.3-176.3-178.40109Q70Q70-K72 PolarHBondContact O-N 3.47Å
73P85.3Confident87.8Confident60 Ų60115.4 Ų115.439%0.3958%0.58SS.*  trans-58.2140.8171.624-32000110.1P58 E78P58-P73 HydrophobicContact CG-CB 3.98Å; P73-E78 WeakPolarHBondContact CB-OE1 3.33Å
74V89.4Confident87.7Confident68 Ų68113.3 Ų113.341%0.41258%0.581SS.*  trans-98.8110.7176.7-176.20000107.1T76 L77 E78V74-T76 VanDerWaalsContact CG1-OG1 3.31Å; V74-T76 WeakPolarHBondContact CG1-OG1 3.21Å; V74-T76 PolarHBondContact O-N 3.28Å; V74-L77 HydrophobicContact CB-CB 4.23Å; V74-L77 HydrophobicContact CB-CD1 3.92Å; V74-L77 HydrophobicContact CB-CG 4.01Å; V74-L77 HydrophobicContact CG1-CD1 4.38Å; V74-L77 HydrophobicContact CG1-CG 4.11Å; V74-L77 HydrophobicContact CG2-CD1 4.2Å; V74-L77 WeakPolarHBondContact O-CB 3.38Å; V74-L77 PolarHBondContact O-N 3.26Å; V74-E78 PolarHBondContact O-N 3.13Å; V74-E78 VanDerWaalsContact O-N 3.17Å
75E89.8Confident86.9Confident166 Ų166115.4 Ų115.478%0.77658%0.584SS**Hα-helixtrans-54.8-38.4-174.8-65178.6-179.600112.7L77 E78 M79E75-L77 VanDerWaalsContact C-N 3.33Å; E75-L77 PolarHBondContact O-N 3.16Å; E75-E78 PolarHBondContact O-N 2.81Å; E75-M79 WeakPolarHBondContact O-CB 3.49Å; E75-M79 PolarHBondContact O-N 3.4Å
76T90.6Very high86.8Confident97 Ų97114.6 Ų114.660%0.59558%0.579SS**Hα-helixtrans-63.8-37.2178.1560000112.6V74 V80V74-T76 VanDerWaalsContact CG1-OG1 3.31Å; V74-T76 WeakPolarHBondContact CG1-OG1 3.21Å; V74-T76 PolarHBondContact O-N 3.28Å; T76-V80 VanDerWaalsContact O-CG2 3.3Å; T76-V80 WeakPolarHBondContact O-CG2 3.23Å; T76-V80 PolarHBondContact O-N 2.9Å; T76-V80 VanDerWaalsContact O-N 3.09Å
77L87.9Confident86.6Confident118 Ų118117.8 Ų117.862%0.61859%0.593SS**Hα-helixtrans-69.5-40.7176.6-68.2179.7000111.1V74 E75 V80 K81V74-L77 HydrophobicContact CB-CB 4.23Å; V74-L77 HydrophobicContact CB-CD1 3.92Å; V74-L77 HydrophobicContact CB-CG 4.01Å; V74-L77 HydrophobicContact CG1-CD1 4.38Å; V74-L77 HydrophobicContact CG1-CG 4.11Å; V74-L77 HydrophobicContact CG2-CD1 4.2Å; V74-L77 WeakPolarHBondContact O-CB 3.38Å; V74-L77 PolarHBondContact O-N 3.26Å; E75-L77 VanDerWaalsContact C-N 3.33Å; E75-L77 PolarHBondContact O-N 3.16Å; L77-V80 PolarHBondContact O-N 3.42Å; L77-K81 WeakPolarHBondContact O-CB 3.4Å; L77-K81 PolarHBondContact O-N 3.35Å
78E87.5Confident86.4Confident111 Ų111116.7 Ų116.752%0.51959%0.587SS.*Hα-helixtrans-64.9-41.4176.5-66-171.6167.800111.7P73 V74 E75 K81 S82P73-E78 WeakPolarHBondContact CB-OE1 3.33Å; V74-E78 PolarHBondContact O-N 3.13Å; V74-E78 VanDerWaalsContact O-N 3.17Å; E75-E78 PolarHBondContact O-N 2.81Å; E78-K81 PolarHBondContact O-N 3.29Å; E78-S82 PolarHBondContact O-N 2.99Å
79M92.4Very high86.3Confident118 Ų118115.3 Ų115.358%0.58158%0.577SS**Hα-helixtrans-60.3-50.2176.9-159.6-161.1-170.500111.1E75 K81 S82 M83E75-M79 WeakPolarHBondContact O-CB 3.49Å; E75-M79 PolarHBondContact O-N 3.4Å; M79-K81 VanDerWaalsContact C-N 3.32Å; M79-K81 PolarHBondContact O-N 2.68Å; M79-S82 PolarHBondContact O-N 3.5Å; M79-S82 PolarHBondContact O-OG 2.98Å; M79-M83 HydrophobicContact CE-CE 3.59Å; M79-M83 HydrophobicContact CG-CE 3.52Å; M79-M83 WeakPolarHBondContact O-CG 3.48Å; M79-M83 PolarHBondContact O-N 3.32Å; M79-M83 HydrophobicContact SD-CE 3.64Å
80V90.9Very high86.5Confident86 Ų86118.6 Ų118.652%0.52160%0.595SS.*Hα-helixtrans-61.7-41177.9172.30000111.4T76 L77 S82 M83 T84T76-V80 VanDerWaalsContact O-CG2 3.3Å; T76-V80 WeakPolarHBondContact O-CG2 3.23Å; T76-V80 PolarHBondContact O-N 2.9Å; T76-V80 VanDerWaalsContact O-N 3.09Å; L77-V80 PolarHBondContact O-N 3.42Å; V80-S82 VanDerWaalsContact C-N 3.3Å; V80-S82 PolarHBondContact O-N 3.31Å; V80-M83 PolarHBondContact O-N 2.98Å; V80-M83 VanDerWaalsContact O-N 3.13Å; V80-T84 PolarHBondContact O-N 2.55Å; V80-T84 VanDerWaalsContact O-N 3.16Å; V80-T84 PolarHBondContact O-OG1 2.9Å
81K86.3Confident86.8Confident88 Ų88116.7 Ų116.738%0.38359%0.589SS.*Hα-helixtrans-59.9-41.4177.2-169176.2-173.5179.30111.8E54 L77 E78 M79 M83 T84 K85E54-K81 PolarHBondContact O-NZ 3.22Å; L77-K81 WeakPolarHBondContact O-CB 3.4Å; L77-K81 PolarHBondContact O-N 3.35Å; E78-K81 PolarHBondContact O-N 3.29Å; M79-K81 VanDerWaalsContact C-N 3.32Å; M79-K81 PolarHBondContact O-N 2.68Å; K81-M83 VanDerWaalsContact C-N 3.26Å; K81-M83 PolarHBondContact O-N 3.31Å; K81-T84 PolarHBondContact O-N 3.32Å; K81-K85 PolarHBondContact O-N 3.36Å
82S88.6Confident87.2Confident83 Ų83111.8 Ų111.858%0.5858%0.58SS**Hα-helixtrans-67.6-21.9177.775.50000114.4E78 M79 V80E78-S82 PolarHBondContact O-N 2.99Å; M79-S82 PolarHBondContact O-N 3.5Å; M79-S82 PolarHBondContact O-OG 2.98Å; V80-S82 VanDerWaalsContact C-N 3.3Å; V80-S82 PolarHBondContact O-N 3.31Å
83M92.6Very high87.6Confident128 Ų128109.1 Ų109.163%0.63158%0.576SS**Hα-helixtrans-88.7-21.9176.4-62.7-174.5-147.300113.5M79 V80 K81M79-M83 HydrophobicContact CE-CE 3.59Å; M79-M83 HydrophobicContact CG-CE 3.52Å; M79-M83 WeakPolarHBondContact O-CG 3.48Å; M79-M83 PolarHBondContact O-N 3.32Å; M79-M83 HydrophobicContact SD-CE 3.64Å; V80-M83 PolarHBondContact O-N 2.98Å; V80-M83 VanDerWaalsContact O-N 3.13Å; K81-M83 VanDerWaalsContact C-N 3.26Å; K81-M83 PolarHBondContact O-N 3.31Å
84T87.4Confident87.8Confident112 Ų112113.2 Ų113.269%0.68759%0.592SS**Hα-helixtrans-97.4-23.9-170.4-49.10000112.8V80 K81V80-T84 PolarHBondContact O-N 2.55Å; V80-T84 VanDerWaalsContact O-N 3.16Å; V80-T84 PolarHBondContact O-OG1 2.9Å; K81-T84 PolarHBondContact O-N 3.32Å
85K69.8Low87.6Confident183 Ų183117.3 Ų117.380%0.79661%0.608SS**  trans-113.20179.2-73.9-169.6172.2-170.60111.4E54 K81E54-K85 VanDerWaalsContact CD-NZ 3.34Å; E54-K85 WeakPolarHBondContact OE1-CE 3.31Å; E54-K85 IonicContact OE1-NZ 3.31Å; E54-K85 PolarHBondContact OE1-NZ 3.29Å; E54-K85 IonicContact OE2-NZ 2.55Å; E54-K85 PolarHBondContact OE2-NZ 2.89Å; K81-K85 PolarHBondContact O-N 3.36Å

Retrieved 85 of 85 residues in 380.5 ms (Link to these results)