A0A087XDJ2_POEFO Loading...

ER lipid raft associated 2

AlphaFold DB , UniProt , Accession A0A087XDJ2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 332 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
1M57.5Low77Confident212 Ų212116 Ų116100%1.04463%0.628SS**  0-73.50-66.5-77.1-102.800111.3Q3 W4 G5M1-Q3 VanDerWaalsContact C-N 3.34Å; M1-Q3 PolarHBondContact O-N 3.2Å; M1-Q3 VanDerWaalsContact O-N 3.15Å; M1-W4 PolarHBondContact O-N 3.17Å; M1-W4 VanDerWaalsContact O-N 3.13Å; M1-G5 PolarHBondContact O-N 3.34Å
2A61.7Low77.8Confident89 Ų89111.2 Ų111.274%0.73662%0.616SS**Hα-helixtrans-50.7-42.9-172.900000115.8W4 G5 A6A2-W4 PolarHBondContact O-N 3.08Å; A2-G5 PolarHBondContact O-N 2.83Å; A2-A6 PolarHBondContact O-N 3.38Å
3Q66.4Low78.4Confident156 Ų156107.6 Ų107.673%0.72961%0.61SS**Hα-helixtrans-62.2-37.5-178.1-134.2171.7-7.900113.5M1 I7M1-Q3 VanDerWaalsContact C-N 3.34Å; M1-Q3 PolarHBondContact O-N 3.2Å; M1-Q3 VanDerWaalsContact O-N 3.15Å; Q3-I7 WeakPolarHBondContact O-CD1 3.32Å; Q3-I7 WeakPolarHBondContact O-CG1 3.43Å; Q3-I7 PolarHBondContact O-N 3.35Å; Q3-I7 VanDerWaalsContact O-N 3.16Å
4W75.9Confident78.9Confident209 Ų209108.3 Ų108.379%0.79261%0.61SS**Hα-helixtrans-73-35.2177-75.680.1000111.9M1 A2 I7 F8M1-W4 PolarHBondContact O-N 3.17Å; M1-W4 VanDerWaalsContact O-N 3.13Å; A2-W4 PolarHBondContact O-N 3.08Å; W4-I7 PolarHBondContact O-N 3.43Å; W4-F8 WeakPolarHBondContact O-CB 3.45Å; W4-F8 PolarHBondContact O-N 3.06Å
5G79.8Confident79.2Confident46 Ų46103.3 Ų103.347%0.47459%0.593SS.*Hα-helixtrans-61.8-43.4172.600000112.4M1 A2 F8 S9M1-G5 PolarHBondContact O-N 3.34Å; A2-G5 PolarHBondContact O-N 2.83Å; G5-F8 PolarHBondContact O-N 2.91Å; G5-S9 PolarHBondContact O-N 2.81Å; G5-S9 PolarHBondContact O-OG 3.39Å
6A79.6Confident79.5Confident47 Ų4798.8 Ų98.839%0.38858%0.576SS.*Hα-helixtrans-61.6-48.6175.700000111.9A2 F8 S9 I10A2-A6 PolarHBondContact O-N 3.38Å; A6-F8 VanDerWaalsContact C-N 3.34Å; A6-F8 PolarHBondContact O-N 3.42Å; A6-S9 PolarHBondContact O-N 2.81Å; A6-S9 PolarHBondContact O-OG 2.81Å; A6-I10 WeakPolarHBondContact O-CG1 3.46Å; A6-I10 PolarHBondContact O-N 2.88Å
7I83.1Confident79.8Confident94 Ų9496.3 Ų96.348%0.48257%0.569SS.*Hα-helixtrans-59-45.3177-66.2163.5000110.8Q3 W4 S9 I10 V11Q3-I7 WeakPolarHBondContact O-CD1 3.32Å; Q3-I7 WeakPolarHBondContact O-CG1 3.43Å; Q3-I7 PolarHBondContact O-N 3.35Å; Q3-I7 VanDerWaalsContact O-N 3.16Å; W4-I7 PolarHBondContact O-N 3.43Å; I7-S9 PolarHBondContact O-N 2.88Å; I7-I10 PolarHBondContact O-N 3.19Å; I7-V11 HydrophobicContact CG2-CG2 4.47Å; I7-V11 WeakPolarHBondContact O-CG2 3.48Å; I7-V11 PolarHBondContact O-N 3.31Å
8F84.9Confident80Confident163 Ų16392.8 Ų92.872%0.71555%0.553SS**Hα-helixtrans-63.7-39.9179-156.8-89.2000112.1W4 G5 A6 I10 V11 A12W4-F8 WeakPolarHBondContact O-CB 3.45Å; W4-F8 PolarHBondContact O-N 3.06Å; G5-F8 PolarHBondContact O-N 2.91Å; A6-F8 VanDerWaalsContact C-N 3.34Å; A6-F8 PolarHBondContact O-N 3.42Å; F8-I10 PolarHBondContact O-N 2.82Å; F8-V11 PolarHBondContact O-N 3.3Å; F8-A12 VanDerWaalsContact O-CB 3.26Å; F8-A12 WeakPolarHBondContact O-CB 3.35Å; F8-A12 PolarHBondContact O-N 2.87Å
9S84.3Confident80.1Confident70 Ų7094.3 Ų94.349%0.4956%0.557SS.*Hα-helixtrans-64.4-36.4174.266.90000113.3G5 A6 I7 A13G5-S9 PolarHBondContact O-N 2.81Å; G5-S9 PolarHBondContact O-OG 3.39Å; A6-S9 PolarHBondContact O-N 2.81Å; A6-S9 PolarHBondContact O-OG 2.81Å; I7-S9 PolarHBondContact O-N 2.88Å; S9-A13 WeakPolarHBondContact O-CB 3.43Å; S9-A13 PolarHBondContact O-N 3.4Å
10I86.6Confident80.2Confident97 Ų9796.8 Ų96.850%0.49757%0.567SS.*Hα-helixtrans-69.6-44177.8-69.7164000110.4A6 I7 F8 A13 L14A6-I10 WeakPolarHBondContact O-CG1 3.46Å; A6-I10 PolarHBondContact O-N 2.88Å; I7-I10 PolarHBondContact O-N 3.19Å; F8-I10 PolarHBondContact O-N 2.82Å; I10-A13 PolarHBondContact O-N 3.42Å; I10-L14 HydrophobicContact CG2-CD1 3.88Å; I10-L14 WeakPolarHBondContact O-CB 3.22Å; I10-L14 WeakPolarHBondContact O-CG 3.25Å; I10-L14 PolarHBondContact O-N 3.04Å
11V86.9Confident80.2Confident93 Ų9394.6 Ų94.656%0.56456%0.56SS**Hα-helixtrans-65.7-41.4176.7174.30000111.2I7 F8 L14 G15I7-V11 HydrophobicContact CG2-CG2 4.47Å; I7-V11 WeakPolarHBondContact O-CG2 3.48Å; I7-V11 PolarHBondContact O-N 3.31Å; F8-V11 PolarHBondContact O-N 3.3Å; V11-L14 PolarHBondContact O-N 3.44Å; V11-G15 PolarHBondContact O-N 2.98Å
12A86.9Confident81.6Confident58 Ų5885.2 Ų85.248%0.47952%0.515SS..Hα-helixtrans-65-40.8175.200000112.3F8 G16F8-A12 VanDerWaalsContact O-CB 3.26Å; F8-A12 WeakPolarHBondContact O-CB 3.35Å; F8-A12 PolarHBondContact O-N 2.87Å; A12-G16 PolarHBondContact O-N 3.19Å
13A86.1Confident82.9Confident65 Ų6584.2 Ų84.254%0.53750%0.5SS..Hα-helixtrans-66.3-43.4175.800000112.2S9 I10 G16 A17S9-A13 WeakPolarHBondContact O-CB 3.43Å; S9-A13 PolarHBondContact O-N 3.4Å; I10-A13 PolarHBondContact O-N 3.42Å; A13-G16 PolarHBondContact O-N 2.86Å; A13-A17 VanDerWaalsContact O-CB 3.27Å; A13-A17 WeakPolarHBondContact O-CB 3.05Å; A13-A17 PolarHBondContact O-N 3.29Å
14L84.9Confident84.1Confident117 Ų11777.3 Ų77.361%0.61347%0.468SS*.Hα-helixtrans-64.5-42.5175-79.1166.5000112I10 V11 A17 A18I10-L14 HydrophobicContact CG2-CD1 3.88Å; I10-L14 WeakPolarHBondContact O-CB 3.22Å; I10-L14 WeakPolarHBondContact O-CG 3.25Å; I10-L14 PolarHBondContact O-N 3.04Å; V11-L14 PolarHBondContact O-N 3.44Å; L14-A17 PolarHBondContact O-N 3.42Å; L14-A18 VanDerWaalsContact O-CB 3.31Å; L14-A18 WeakPolarHBondContact O-CB 3.28Å; L14-A18 PolarHBondContact O-N 2.87Å
15G83.6Confident84.9Confident34 Ų3472.6 Ų72.635%0.35145%0.453SS..Hα-helixtrans-63.9-44.6175.300000112.4V11 A18 L19V11-G15 PolarHBondContact O-N 2.98Å; G15-A18 PolarHBondContact O-N 3.03Å; G15-L19 WeakPolarHBondContact O-CG 3.47Å; G15-L19 PolarHBondContact O-N 3.42Å
16G84.7Confident85.6Confident31 Ų3170.5 Ų70.532%0.3243%0.431SS..Hα-helixtrans-62.4-43.7174.700000112.7A12 A13 L19 L20A12-G16 PolarHBondContact O-N 3.19Å; A13-G16 PolarHBondContact O-N 2.86Å; G16-L19 PolarHBondContact O-N 3.05Å; G16-L20 WeakPolarHBondContact O-CG 3.37Å; G16-L20 PolarHBondContact O-N 3.16Å
17A83.6Confident86.2Confident56 Ų5672.3 Ų72.346%0.46343%0.434SS..Hα-helixtrans-63.5-40.6175.100000112.2A13 L14 L20 A21A13-A17 VanDerWaalsContact O-CB 3.27Å; A13-A17 WeakPolarHBondContact O-CB 3.05Å; A13-A17 PolarHBondContact O-N 3.29Å; L14-A17 PolarHBondContact O-N 3.42Å; A17-L20 PolarHBondContact O-N 3.29Å; A17-A21 VanDerWaalsContact O-CB 3.27Å; A17-A21 WeakPolarHBondContact O-CB 3.36Å; A17-A21 PolarHBondContact O-N 3.46Å
18A82.9Confident86.6Confident34 Ų3475.2 Ų75.228%0.28145%0.445SS..Hα-helixtrans-65.9-36.117600000112.7L14 G15 S22 P54L14-A18 VanDerWaalsContact O-CB 3.31Å; L14-A18 WeakPolarHBondContact O-CB 3.28Å; L14-A18 PolarHBondContact O-N 2.87Å; G15-A18 PolarHBondContact O-N 3.03Å; A18-S22 WeakPolarHBondContact O-CB 3.39Å; A18-S22 PolarHBondContact O-N 3.46Å; A18-P54 HydrophobicContact CB-CG 4.29Å
19L82.3Confident86.9Confident121 Ų12168.2 Ų68.263%0.63442%0.419SS*.Hα-helixtrans-70.6-38173.9-72.5171.2000112.5G15 G16 A21 S22G15-L19 WeakPolarHBondContact O-CG 3.47Å; G15-L19 PolarHBondContact O-N 3.42Å; G16-L19 PolarHBondContact O-N 3.05Å; L19-A21 VanDerWaalsContact C-N 3.34Å; L19-S22 PolarHBondContact O-N 3.35Å; L19-S22 PolarHBondContact O-OG 3.28Å
20L81.7Confident87.4Confident143 Ų14367 Ų6775%0.74941%0.405SS*.Hα-helixtrans-68.7-35.5173.8-70.5170.5000111.7G16 A17 S22G16-L20 WeakPolarHBondContact O-CG 3.37Å; G16-L20 PolarHBondContact O-N 3.16Å; A17-L20 PolarHBondContact O-N 3.29Å; L20-S22 VanDerWaalsContact C-N 3.33Å
21A82Confident87.8Confident52 Ų5262.9 Ų62.943%0.4339%0.385SS..Hα-helixtrans-76.7-14.4175.100000114.1A17 L19 P54A17-A21 VanDerWaalsContact O-CB 3.27Å; A17-A21 WeakPolarHBondContact O-CB 3.36Å; A17-A21 PolarHBondContact O-N 3.46Å; L19-A21 VanDerWaalsContact C-N 3.34Å; A21-P54 HydrophobicContact CB-CB 4.35Å
22S85.8Confident88.1Confident14 Ų1458.4 Ų58.410%0.09836%0.358CS..Hα-helixtrans-82.3-27.8176.471.80000112.6A18 L19 L20 L51 M52A18-S22 WeakPolarHBondContact O-CB 3.39Å; A18-S22 PolarHBondContact O-N 3.46Å; L19-S22 PolarHBondContact O-N 3.35Å; L19-S22 PolarHBondContact O-OG 3.28Å; L20-S22 VanDerWaalsContact C-N 3.33Å; S22-L51 CarbonylContact O-C 3.19Å; S22-L51 WeakPolarHBondContact O-CA 3.47Å; S22-M52 VanDerWaalsContact CA-O 3.25Å; S22-M52 WeakPolarHBondContact CA-O 3.45Å; S22-M52 WeakPolarHBondContact CB-O 3.38Å; S22-M52 WeakPolarHBondContact O-CG 3.5Å; S22-M52 PolarHBondContact O-N 2.89Å
23V89.8Confident88.4Confident68 Ų6855.7 Ų55.741%0.41234%0.335SS..EExtended strand (participates in β ladder)trans-83.5128.4175.7-178.40000109.8F49 L51V23-F49 HydrophobicContact CG1-CD1 3.9Å; V23-L51 HydrophobicContact CG2-CD2 3.66Å
24H90.6Very high88.8Confident11 Ų1153.6 Ų53.65%0.05131%0.314CS..EExtended strand (participates in β ladder)trans-133.4164.7165.969.7-62.3000110.5Y34 F49 H50 M52 Y59H24-Y34 AromaticContact CE1-CE1 3.5Å; H24-Y34 VanDerWaalsContact CE1-CE1 3.5Å; H24-Y34 WeakPolarHBondContact CE1-CE1 3.3Å; H24-Y34 AromaticContact CE1-CZ 3.89Å; H24-Y34 PolarHBondContact CE1-OH 2.9Å; H24-Y34 AromaticContact NE2-CE1 3.58Å; H24-Y34 AromaticContact NE2-CZ 3.85Å; H24-Y34 PolarHBondContact NE2-OH 3.35Å; H24-F49 WeakPolarHBondContact O-CA 3.32Å; H24-H50 VanDerWaalsContact CE1-CB 3.43Å; H24-H50 WeakPolarHBondContact CE1-CB 3.45Å; H24-H50 PolarHBondContact CE1-O 2.92Å; H24-H50 PolarHBondContact N-O 3.39Å; H24-H50 PolarHBondContact ND1-O 3.15Å; H24-H50 PolarHBondContact O-N 3.25Å; H24-M52 HydrophobicContact CB-CE 4.2Å; H24-Y59 HydrophobicContact CB-CE1 3.84Å; H24-Y59 AromaticContact CD2-CD1 3.62Å; H24-Y59 AromaticContact CD2-CD2 3.62Å; H24-Y59 AromaticContact CD2-CE1 3.52Å; H24-Y59 AromaticContact CD2-CE2 3.53Å; H24-Y59 AromaticContact CD2-CG 3.67Å; H24-Y59 AromaticContact CD2-CZ 3.47Å; H24-Y59 VanDerWaalsContact CD2-CZ 3.47Å; H24-Y59 AromaticContact CG-CD1 4Å; H24-Y59 AromaticContact CG-CE1 3.74Å; H24-Y59 AromaticContact CG-CZ 3.99Å; H24-Y59 AromaticContact NE2-CD2 3.92Å; H24-Y59 AromaticContact NE2-CG 3.79Å
25K92.9Very high89.2Confident111 Ų11150.1 Ų50.148%0.48329%0.293SS..EExtended strand (participates in β ladder)trans-113.1132.9178.7-174-162.4176.6-152.40108.5D27 G48 F49K25-D27 VanDerWaalsContact CE-OD1 3.25Å; K25-D27 WeakPolarHBondContact CE-OD1 3.44Å; K25-D27 IonicContact NZ-OD1 2.86Å; K25-D27 PolarHBondContact NZ-OD1 3.48Å; K25-G48 WeakPolarHBondContact CA-O 3.32Å; K25-F49 HydrophobicContact CB-CD1 4.17Å; K25-F49 HydrophobicContact CB-CE1 4.02Å; K25-F49 HydrophobicContact CG-CE1 4.27Å
26I94.2Very high89.6Confident2 Ų255.2 Ų55.21%0.0130%0.301CS..EExtended strand (participates in β ladder)trans-99.5124.8163.7-59.9169.2000106.4H30 G48I26-H30 HydrophobicContact CG2-CB 3.92Å; I26-H30 WeakPolarHBondContact CG2-O 3.25Å; I26-G48 PolarHBondContact N-O 3.45Å; I26-G48 PolarHBondContact O-N 3.09Å
27D93Very high89.8Confident85 Ų8557.2 Ų57.246%0.45532%0.322SS..PPolyproline II helixtrans-71.3156.9177.3-74.6-50.8000112K25 H30K25-D27 VanDerWaalsContact CE-OD1 3.25Å; K25-D27 WeakPolarHBondContact CE-OD1 3.44Å; K25-D27 IonicContact NZ-OD1 2.86Å; K25-D27 PolarHBondContact NZ-OD1 3.48Å; D27-H30 WeakPolarHBondContact O-CB 3.26Å; D27-H30 PolarHBondContact O-N 2.93Å
28E92.2Very high89.9Confident154 Ų15457.6 Ų57.672%0.7233%0.332SS*.THydrogen-bonded Turntrans-55.9146.6174.4-79.7-64.3165.500111.6H30 P47E28-H30 PolarHBondContact O-N 2.98Å; E28-H30 PolarHBondContact O-ND1 3.44Å; E28-H30 VanDerWaalsContact O-ND1 3.1Å; E28-P47 HydrophobicContact CG-CB 4.42Å; E28-P47 WeakPolarHBondContact OE2-CG 3.47Å
29G90.9Very high90.3Very high16 Ų1659 Ų5917%0.16534%0.344CS..THydrogen-bonded Turntrans72.19.9-17600000115.8T64 T65G29-T64 PolarHBondContact O-N 3.46Å; G29-T64 PolarHBondContact O-OG1 2.95Å; G29-T65 VanDerWaalsContact CA-CG2 3.42Å; G29-T65 PolarHBondContact O-N 3.37Å
30H93.9Very high90.8Very high44 Ų4455.1 Ų55.120%0.20432%0.323CS..EExtended strand (participates in β ladder)trans-120.8149.7174-62.670.5000111.6I26 D27 E28 V62I26-H30 HydrophobicContact CG2-CB 3.92Å; I26-H30 WeakPolarHBondContact CG2-O 3.25Å; D27-H30 WeakPolarHBondContact O-CB 3.26Å; D27-H30 PolarHBondContact O-N 2.93Å; E28-H30 PolarHBondContact O-N 2.98Å; E28-H30 PolarHBondContact O-ND1 3.44Å; E28-H30 VanDerWaalsContact O-ND1 3.1Å; H30-V62 CarbonylContact C-O 3.58Å; H30-V62 WeakPolarHBondContact CA-O 3.3Å
31T94.1Very high91.3Very high11 Ų1151.4 Ų51.47%0.06730%0.304CS..EExtended strand (participates in β ladder)trans-113.9122172.1-59.20000108.7T44 S45 V62 T64 V100T31-T44 HydrophobicContact CG2-CG2 4.14Å; T31-S45 CarbonylContact C-O 3.57Å; T31-S45 WeakPolarHBondContact CA-O 3.31Å; T31-V62 PolarHBondContact N-O 2.72Å; T31-V62 PolarHBondContact O-N 3.09Å; T31-T64 WeakPolarHBondContact OG1-CG2 3.2Å; T31-V100 HydrophobicContact CG2-CB 4.32Å; T31-V100 HydrophobicContact CG2-CG1 4.05Å; T31-V100 HydrophobicContact CG2-CG2 4.31Å
32G93.7Very high91.7Very high0 Ų054.2 Ų54.20%032%0.316CS..EExtended strand (participates in β ladder)trans-81.8129.3177.300000111.5T44 S45G32-T44 WeakPolarHBondContact O-CA 3.34Å; G32-S45 PolarHBondContact N-O 3.34Å; G32-S45 PolarHBondContact O-N 2.89Å
33V94.1Very high91.8Very high0 Ų056.8 Ų56.80%034%0.338CS..EExtended strand (participates in β ladder)trans-118.3133.8174.2-155.80000109L40 T44 Y59 K60 V62 V100 V104V33-L40 HydrophobicContact CG1-CD1 3.56Å; V33-L40 HydrophobicContact CG1-CG 4.21Å; V33-T44 HydrophobicContact CG1-CG2 4.37Å; V33-T44 HydrophobicContact CG2-CG2 4.3Å; V33-Y59 CarbonylContact O-C 3.58Å; V33-Y59 WeakPolarHBondContact O-CA 3.33Å; V33-K60 PolarHBondContact N-O 3.16Å; V33-K60 PolarHBondContact O-N 2.86Å; V33-V62 HydrophobicContact CG2-CG2 4.07Å; V33-V100 HydrophobicContact CG2-CG1 3.54Å; V33-V104 HydrophobicContact CG1-CG1 4.3Å; V33-V104 HydrophobicContact CG2-CG2 4.32Å
34Y93.4Very high91.8Very high21 Ų2156.3 Ų56.38%0.08234%0.335CS..EExtended strand (participates in β ladder)trans-110.9142.7-170.2-58.6-89.7000112H24 L41 S45 H50H24-Y34 AromaticContact CE1-CE1 3.5Å; H24-Y34 VanDerWaalsContact CE1-CE1 3.5Å; H24-Y34 WeakPolarHBondContact CE1-CE1 3.3Å; H24-Y34 AromaticContact CE1-CZ 3.89Å; H24-Y34 PolarHBondContact CE1-OH 2.9Å; H24-Y34 AromaticContact NE2-CE1 3.58Å; H24-Y34 AromaticContact NE2-CZ 3.85Å; H24-Y34 PolarHBondContact NE2-OH 3.35Å; Y34-L41 PolarHBondContact O-N 2.9Å; Y34-S45 WeakPolarHBondContact CE2-OG 3.31Å; Y34-S45 WeakPolarHBondContact OH-CB 3.29Å; Y34-S45 PolarHBondContact OH-OG 3.18Å; Y34-S45 VanDerWaalsContact OH-OG 3.07Å; Y34-H50 VanDerWaalsContact OH-CB 3.24Å; Y34-H50 WeakPolarHBondContact OH-CB 3.44Å
35Y93.5Very high91.9Very high44 Ų4456.9 Ų56.917%0.17334%0.34CS..EExtended strand (participates in β ladder)trans-116.3131172.9-58.4-98.5000108.5A39 L40 T57 T58 K60 V104Y35-A39 CarbonylContact C-O 3.5Å; Y35-A39 VanDerWaalsContact CA-O 3.27Å; Y35-A39 WeakPolarHBondContact CA-O 3.49Å; Y35-L40 HydrophobicContact CD1-CD1 3.87Å; Y35-L40 HydrophobicContact CE1-CD1 3.4Å; Y35-L40 HydrophobicContact CE2-CD1 4.1Å; Y35-L40 HydrophobicContact CG-CD1 4.41Å; Y35-T57 CarbonylContact O-C 3.56Å; Y35-T57 WeakPolarHBondContact O-CA 3.31Å; Y35-T58 PolarHBondContact N-O 3.49Å; Y35-T58 PolarHBondContact O-N 2.9Å; Y35-K60 HydrophobicContact CE2-CB 4.35Å; Y35-K60 HydrophobicContact CE2-CG 4.34Å; Y35-V104 VanDerWaalsContact OH-CG1 3.22Å; Y35-V104 WeakPolarHBondContact OH-CG1 3.05Å
36R93.2Very high91.9Very high141 Ų14153.3 Ų53.353%0.53234%0.335SS..EExtended strand (participates in β ladder)trans-116110.7175.5-173177.7176.1169.8-1.7109G38 A39 L41 I56 T57R36-G38 PolarHBondContact O-N 3.37Å; R36-A39 PolarHBondContact N-O 2.95Å; R36-A39 PolarHBondContact O-N 2.89Å; R36-A39 VanDerWaalsContact O-N 3.08Å; R36-L41 HydrophobicContact CB-CD1 4.05Å; R36-L41 HydrophobicContact CB-CG 4.25Å; R36-I56 HydrophobicContact CG-CG2 3.96Å; R36-T57 HydrophobicContact CB-CG2 3.91Å; R36-T57 HydrophobicContact CG-CG2 3.87Å
37G89.1Confident91.8Very high74 Ų7455.9 Ų55.976%0.76335%0.352SS*.THydrogen-bonded Turntrans56.331.2-174.500000113.6I56G37-I56 PolarHBondContact N-O 2.89Å
38G85.2Confident91.9Very high64 Ų6453.2 Ų53.266%0.6634%0.344SS*.THydrogen-bonded Turntrans90.4-15.7-176.500000115.8R36R36-G38 PolarHBondContact O-N 3.37Å
39A90.9Very high91.9Very high64 Ų6453.3 Ų53.353%0.52934%0.342SS..EExtended strand (participates in β ladder)trans-85.6133.1177.200000111.8Y35 R36Y35-A39 CarbonylContact C-O 3.5Å; Y35-A39 VanDerWaalsContact CA-O 3.27Å; Y35-A39 WeakPolarHBondContact CA-O 3.49Å; R36-A39 PolarHBondContact N-O 2.95Å; R36-A39 PolarHBondContact O-N 2.89Å; R36-A39 VanDerWaalsContact O-N 3.08Å
40L93.3Very high91.9Very high39 Ų3954.9 Ų54.920%0.20435%0.345CS..EExtended strand (participates in β ladder)trans-66.6131176.3-162.372.3000110.9V33 Y35 Y101 V104 R105V33-L40 HydrophobicContact CG1-CD1 3.56Å; V33-L40 HydrophobicContact CG1-CG 4.21Å; Y35-L40 HydrophobicContact CD1-CD1 3.87Å; Y35-L40 HydrophobicContact CE1-CD1 3.4Å; Y35-L40 HydrophobicContact CE2-CD1 4.1Å; Y35-L40 HydrophobicContact CG-CD1 4.41Å; L40-Y101 HydrophobicContact CD2-CD2 3.79Å; L40-Y101 HydrophobicContact CD2-CE2 3.56Å; L40-Y101 HydrophobicContact CG-CD2 4.32Å; L40-Y101 HydrophobicContact CG-CE2 3.98Å; L40-V104 HydrophobicContact CD1-CG1 3.85Å; L40-V104 HydrophobicContact CD2-CG1 4.24Å; L40-R105 HydrophobicContact CD2-CB 3.83Å; L40-R105 HydrophobicContact CD2-CG 4.49Å
41L91.9Very high91.7Very high65 Ų6559.2 Ų59.234%0.3437%0.37SS..PPolyproline II helixtrans-83.7141.9173.1-75.2161000110.4Y34 R36 A43 Y101Y34-L41 PolarHBondContact O-N 2.9Å; R36-L41 HydrophobicContact CB-CD1 4.05Å; R36-L41 HydrophobicContact CB-CG 4.25Å; L41-A43 VanDerWaalsContact C-N 3.29Å; L41-A43 PolarHBondContact O-N 3.33Å; L41-Y101 WeakPolarHBondContact O-CE2 3.22Å
42T89.1Confident91.4Very high111 Ų11160.4 Ų60.468%0.68138%0.375SS*.SBendtrans-72.1-19.8-177.8510000114.2Y101T42-Y101 HydrophobicContact CG2-CE2 4.31Å
43A87.8Confident91.1Very high68 Ų6864.8 Ų64.856%0.56240%0.398SS*.PPolyproline II helixtrans-92.5119.6177.800000110.5L41L41-A43 VanDerWaalsContact C-N 3.29Å; L41-A43 PolarHBondContact O-N 3.33Å
44T91.3Very high90.5Very high57 Ų5766.4 Ų66.435%0.3541%0.408SS..PPolyproline II helixtrans-89.1146166.451.20000110.6T31 G32 V33T31-T44 HydrophobicContact CG2-CG2 4.14Å; G32-T44 WeakPolarHBondContact O-CA 3.34Å; V33-T44 HydrophobicContact CG1-CG2 4.37Å; V33-T44 HydrophobicContact CG2-CG2 4.3Å
45S92.7Very high90Very high24 Ų2475.3 Ų75.317%0.16845%0.448CS..BIsolated β-bridgetrans-104138.3172.7-78.90000111.2T31 G32 Y34 H50T31-S45 CarbonylContact C-O 3.57Å; T31-S45 WeakPolarHBondContact CA-O 3.31Å; G32-S45 PolarHBondContact N-O 3.34Å; G32-S45 PolarHBondContact O-N 2.89Å; Y34-S45 WeakPolarHBondContact CE2-OG 3.31Å; Y34-S45 WeakPolarHBondContact OH-CB 3.29Å; Y34-S45 PolarHBondContact OH-OG 3.18Å; Y34-S45 VanDerWaalsContact OH-OG 3.07Å; S45-H50 VanDerWaalsContact CB-CE1 3.49Å; S45-H50 WeakPolarHBondContact CB-CE1 3.43Å; S45-H50 PolarHBondContact OG-CE1 2.91Å; S45-H50 PolarHBondContact OG-ND1 3.28Å; S45-H50 VanDerWaalsContact OG-ND1 3.13Å
46G91.8Very high89.8Confident36 Ų3677.7 Ų77.737%0.37146%0.463SS..  trans-74.5-174.7165.900000113.1H50G46-H50 PolarHBondContact O-NE2 3.31Å
47P93.6Very high89.6Confident55 Ų5571.7 Ų71.736%0.35744%0.442SS..SBendtrans-61.5157.1179.727-35.9000112.8E28E28-P47 HydrophobicContact CG-CB 4.42Å; E28-P47 WeakPolarHBondContact OE2-CG 3.47Å
48G93.7Very high89.7Confident29 Ų2972.4 Ų72.430%0.29943%0.431SS..EExtended strand (participates in β ladder)trans119-166.1179.600000114.4K25 I26 H50K25-G48 WeakPolarHBondContact CA-O 3.32Å; I26-G48 PolarHBondContact N-O 3.45Å; I26-G48 PolarHBondContact O-N 3.09Å; G48-H50 PolarHBondContact O-CD2 2.96Å
49F91.9Very high90Very high156 Ų15673.4 Ų73.468%0.68442%0.416SS*.EExtended strand (participates in β ladder)trans-90.1128.5179-70.8-79.2000111.3V23 H24 K25V23-F49 HydrophobicContact CG1-CD1 3.9Å; H24-F49 WeakPolarHBondContact O-CA 3.32Å; K25-F49 HydrophobicContact CB-CD1 4.17Å; K25-F49 HydrophobicContact CB-CE1 4.02Å; K25-F49 HydrophobicContact CG-CE1 4.27Å
50H92.1Very high90.1Very high49 Ų4974.3 Ų74.323%0.22741%0.407CS..EExtended strand (participates in β ladder)trans-130.9151.5-179.6-65-87000111.5H24 Y34 S45 G46 G48H24-H50 VanDerWaalsContact CE1-CB 3.43Å; H24-H50 WeakPolarHBondContact CE1-CB 3.45Å; H24-H50 PolarHBondContact CE1-O 2.92Å; H24-H50 PolarHBondContact N-O 3.39Å; H24-H50 PolarHBondContact ND1-O 3.15Å; H24-H50 PolarHBondContact O-N 3.25Å; Y34-H50 VanDerWaalsContact OH-CB 3.24Å; Y34-H50 WeakPolarHBondContact OH-CB 3.44Å; S45-H50 VanDerWaalsContact CB-CE1 3.49Å; S45-H50 WeakPolarHBondContact CB-CE1 3.43Å; S45-H50 PolarHBondContact OG-CE1 2.91Å; S45-H50 PolarHBondContact OG-ND1 3.28Å; S45-H50 VanDerWaalsContact OG-ND1 3.13Å; G46-H50 PolarHBondContact O-NE2 3.31Å; G48-H50 PolarHBondContact O-CD2 2.96Å
51L89.1Confident90Very high136 Ų13675.5 Ų75.571%0.71242%0.419SS*.EExtended strand (participates in β ladder)trans-99.8124.1179-71.5168.1000110.3S22 V23S22-L51 CarbonylContact O-C 3.19Å; S22-L51 WeakPolarHBondContact O-CA 3.47Å; V23-L51 HydrophobicContact CG2-CD2 3.66Å
52M88.8Confident90.1Very high36 Ų3672.9 Ų72.918%0.17741%0.406CS..  trans-117.6154.8171.765.9165.6168.800110.6S22 H24 P54 Y59S22-M52 VanDerWaalsContact CA-O 3.25Å; S22-M52 WeakPolarHBondContact CA-O 3.45Å; S22-M52 WeakPolarHBondContact CB-O 3.38Å; S22-M52 WeakPolarHBondContact O-CG 3.5Å; S22-M52 PolarHBondContact O-N 2.89Å; H24-M52 HydrophobicContact CB-CE 4.2Å; M52-P54 WeakPolarHBondContact O-CD 3.35Å; M52-Y59 HydrophobicContact CE-CD1 3.96Å; M52-Y59 HydrophobicContact CE-CE1 3.85Å; M52-Y59 HydrophobicContact SD-CD1 3.68Å; M52-Y59 HydrophobicContact SD-CE1 4.21Å
53L86.9Confident90.3Very high91 Ų9170.6 Ų70.648%0.47639%0.388SS..  trans-81.1116.1175.1-66.7173.7000109.5I56 T57L53-I56 HydrophobicContact CB-CB 4.5Å; L53-I56 PolarHBondContact O-N 3.04Å; L53-T57 WeakPolarHBondContact CA-OG1 3.3Å; L53-T57 HydrophobicContact CB-CG2 4.44Å; L53-T57 PolarHBondContact N-OG1 3.37Å; L53-T57 PolarHBondContact O-N 2.84Å; L53-T57 VanDerWaalsContact O-N 3.07Å; L53-T57 PolarHBondContact O-OG1 3.27Å
54P81.6Confident90.5Very high34 Ų3468.4 Ų68.422%0.22137%0.367CS..THydrogen-bonded Turntrans-58.2148.3177.926.1-34.6000110.4A18 A21 M52 I56A18-P54 HydrophobicContact CB-CG 4.29Å; A21-P54 HydrophobicContact CB-CB 4.35Å; M52-P54 WeakPolarHBondContact O-CD 3.35Å; P54-I56 PolarHBondContact O-N 3.37Å
55F82.6Confident90.6Very high208 Ų20868.5 Ų68.591%0.91237%0.368SS*.THydrogen-bonded Turntrans66.5-28.8-176.9-45.3-77.5000117.3
56I88.6Confident90.6Very high95 Ų9572.3 Ų72.349%0.48739%0.386SS..THydrogen-bonded Turntrans-99.8-36-175.1-56.9175.3000112.3R36 G37 L53 P54R36-I56 HydrophobicContact CG-CG2 3.96Å; G37-I56 PolarHBondContact N-O 2.89Å; L53-I56 HydrophobicContact CB-CB 4.5Å; L53-I56 PolarHBondContact O-N 3.04Å; P54-I56 PolarHBondContact O-N 3.37Å
57T90.1Very high90.7Very high15 Ų1571.9 Ų71.99%0.09237%0.374CS..EExtended strand (participates in β ladder)trans-111.7138178.951.30000112Y35 R36 L53Y35-T57 CarbonylContact O-C 3.56Å; Y35-T57 WeakPolarHBondContact O-CA 3.31Å; R36-T57 HydrophobicContact CB-CG2 3.91Å; R36-T57 HydrophobicContact CG-CG2 3.87Å; L53-T57 WeakPolarHBondContact CA-OG1 3.3Å; L53-T57 HydrophobicContact CB-CG2 4.44Å; L53-T57 PolarHBondContact N-OG1 3.37Å; L53-T57 PolarHBondContact O-N 2.84Å; L53-T57 VanDerWaalsContact O-N 3.07Å; L53-T57 PolarHBondContact O-OG1 3.27Å
58T90.3Very high90.7Very high89 Ų8972.8 Ų72.855%0.54638%0.378SS..EExtended strand (participates in β ladder)trans-119150.1168.655.70000108.8Y35Y35-T58 PolarHBondContact N-O 3.49Å; Y35-T58 PolarHBondContact O-N 2.9Å
59Y91.6Very high90.7Very high85 Ų8572.9 Ų72.933%0.33337%0.372SS..EExtended strand (participates in β ladder)trans-116.9152.5174.575.4-79.6000110.2H24 V33 M52H24-Y59 HydrophobicContact CB-CE1 3.84Å; H24-Y59 AromaticContact CD2-CD1 3.62Å; H24-Y59 AromaticContact CD2-CD2 3.62Å; H24-Y59 AromaticContact CD2-CE1 3.52Å; H24-Y59 AromaticContact CD2-CE2 3.53Å; H24-Y59 AromaticContact CD2-CG 3.67Å; H24-Y59 AromaticContact CD2-CZ 3.47Å; H24-Y59 VanDerWaalsContact CD2-CZ 3.47Å; H24-Y59 AromaticContact CG-CD1 4Å; H24-Y59 AromaticContact CG-CE1 3.74Å; H24-Y59 AromaticContact CG-CZ 3.99Å; H24-Y59 AromaticContact NE2-CD2 3.92Å; H24-Y59 AromaticContact NE2-CG 3.79Å; V33-Y59 CarbonylContact O-C 3.58Å; V33-Y59 WeakPolarHBondContact O-CA 3.33Å; M52-Y59 HydrophobicContact CE-CD1 3.96Å; M52-Y59 HydrophobicContact CE-CE1 3.85Å; M52-Y59 HydrophobicContact SD-CD1 3.68Å; M52-Y59 HydrophobicContact SD-CE1 4.21Å
60K92.6Very high90.8Very high82 Ų8269.4 Ų69.436%0.35736%0.358SS..EExtended strand (participates in β ladder)trans-123132.3160.5-79.6-167.7165.9-161.80108V33 Y35 A109 D110V33-K60 PolarHBondContact N-O 3.16Å; V33-K60 PolarHBondContact O-N 2.86Å; Y35-K60 HydrophobicContact CE2-CB 4.35Å; Y35-K60 HydrophobicContact CE2-CG 4.34Å; K60-A109 HydrophobicContact CB-CB 4.3Å; K60-A109 HydrophobicContact CD-CB 3.26Å; K60-A109 HydrophobicContact CG-CB 4.41Å; K60-D110 IonicContact NZ-OD1 2.83Å; K60-D110 PolarHBondContact NZ-OD1 3.43Å; K60-D110 IonicContact NZ-OD2 2.66Å; K60-D110 PolarHBondContact NZ-OD2 2.89Å
61S93Very high90.8Very high65 Ų6567.2 Ų67.246%0.45535%0.348SS..EExtended strand (participates in β ladder)trans-86112.1171.149.80000109.1
62V93.7Very high91Very high9 Ų965.8 Ų65.86%0.05534%0.336CS..EExtended strand (participates in β ladder)trans-93.3129.1172.6177.80000108H30 T31 V33 L95 V100 V104 A109 Y111H30-V62 CarbonylContact C-O 3.58Å; H30-V62 WeakPolarHBondContact CA-O 3.3Å; T31-V62 PolarHBondContact N-O 2.72Å; T31-V62 PolarHBondContact O-N 3.09Å; V33-V62 HydrophobicContact CG2-CG2 4.07Å; V62-L95 HydrophobicContact CG1-CD2 3.82Å; V62-V100 HydrophobicContact CB-CG1 4.14Å; V62-V100 HydrophobicContact CG1-CG1 4.29Å; V62-V100 HydrophobicContact CG2-CG1 4.41Å; V62-V104 HydrophobicContact CG2-CG2 3.84Å; V62-A109 HydrophobicContact CG2-CB 4.47Å; V62-Y111 HydrophobicContact CG1-CE1 3.89Å
63Q92.9Very high91.2Very high64 Ų6469.1 Ų69.130%0.29936%0.355SS..EExtended strand (participates in β ladder)trans-76.1140178.2-171.91706.500109.9T65 Q67Q63-T65 WeakPolarHBondContact CG-OG1 3.38Å; Q63-T65 PolarHBondContact NE2-OG1 2.81Å; Q63-Q67 HydrophobicContact CB-CG 4.23Å; Q63-Q67 HydrophobicContact CG-CG 3.75Å; Q63-Q67 PolarHBondContact O-OE1 3.18Å
64T91.9Very high91.5Very high21 Ų2164.8 Ų64.813%0.12933%0.332CS..  trans-126.5-0.1-178.351.80000113.1G29 T31 L95 P97 V100G29-T64 PolarHBondContact O-N 3.46Å; G29-T64 PolarHBondContact O-OG1 2.95Å; T31-T64 WeakPolarHBondContact OG1-CG2 3.2Å; T64-L95 VanDerWaalsContact CB-O 3.27Å; T64-L95 WeakPolarHBondContact CB-O 3.46Å; T64-L95 HydrophobicContact CG2-CG 4.45Å; T64-P97 HydrophobicContact CG2-CG 4.26Å; T64-V100 HydrophobicContact CG2-CG2 3.53Å
65T92.6Very high92.1Very high59 Ų5965.4 Ų65.436%0.36234%0.336SS..SBendtrans-75.9173.9166.154.50000111.4G29 Q63 Q67G29-T65 VanDerWaalsContact CA-CG2 3.42Å; G29-T65 PolarHBondContact O-N 3.37Å; Q63-T65 WeakPolarHBondContact CG-OG1 3.38Å; Q63-T65 PolarHBondContact NE2-OG1 2.81Å; T65-Q67 PolarHBondContact O-N 3.49Å
66L93.8Very high92.7Very high104 Ų10455.5 Ų55.555%0.54529%0.292SS..  trans-56.8125.6165.2-172.7150.9000110.6V92 N93L66-V92 HydrophobicContact CD1-CG1 3.89Å; L66-V92 HydrophobicContact CD2-CG1 3.57Å; L66-V92 HydrophobicContact CG-CG1 3.64Å; L66-N93 WeakPolarHBondContact CA-O 3.32Å
67Q92.5Very high93Very high28 Ų2852 Ų5213%0.13128%0.279CS..EExtended strand (participates in β ladder)trans-122.2163.3179-74175.7-94.600110.1Q63 T65 V92 N93Q63-Q67 HydrophobicContact CB-CG 4.23Å; Q63-Q67 HydrophobicContact CG-CG 3.75Å; Q63-Q67 PolarHBondContact O-OE1 3.18Å; T65-Q67 PolarHBondContact O-N 3.49Å; Q67-V92 VanDerWaalsContact O-CA 3.29Å; Q67-V92 WeakPolarHBondContact O-CA 3.48Å; Q67-N93 PolarHBondContact N-O 3.27Å; Q67-N93 PolarHBondContact O-N 3.07Å
68T94.2Very high93.2Very high73 Ų7351.6 Ų51.645%0.44828%0.277SS..EExtended strand (participates in β ladder)trans-131.2111.5173.1-55.20000109.1E90 V91 V92T68-E90 HydrophobicContact CG2-CB 3.89Å; T68-E90 HydrophobicContact CG2-CG 4.33Å; T68-V91 WeakPolarHBondContact CA-O 3.42Å; T68-V92 HydrophobicContact CG2-CG2 4.27Å
69D93.1Very high93.4Very high31 Ų3150.6 Ų50.617%0.16627%0.274CS..EExtended strand (participates in β ladder)trans-89.2125.8176.6-64.2-34.6000110.3E90 V91 N93 I116D69-E90 WeakPolarHBondContact O-CA 3.41Å; D69-V91 PolarHBondContact N-O 2.88Å; D69-V91 PolarHBondContact O-N 3.49Å; D69-N93 PolarHBondContact OD2-ND2 3.48Å; D69-I116 VanDerWaalsContact OD2-CD1 3.22Å; D69-I116 WeakPolarHBondContact OD2-CD1 3.34Å
70E93.8Very high93.3Very high83 Ų8349.3 Ų49.339%0.38829%0.287SS..EExtended strand (participates in β ladder)trans-98.1107.2177-65.2-169.8149.900111.1K72 R88 I89 E90E70-K72 WeakPolarHBondContact OE2-CE 3.46Å; E70-K72 IonicContact OE2-NZ 3.6Å; E70-K72 PolarHBondContact OE2-NZ 2.86Å; E70-R88 IonicContact OE1-CZ 2.71Å; E70-R88 VanDerWaalsContact OE1-CZ 3.23Å; E70-R88 IonicContact OE1-NE 3.61Å; E70-R88 IonicContact OE1-NH1 3.93Å; E70-R88 PolarHBondContact OE1-NH1 2.85Å; E70-R88 IonicContact OE1-NH2 3.7Å; E70-I89 WeakPolarHBondContact CA-O 3.36Å; E70-E90 HydrophobicContact CG-CG 4.46Å
71V93.5Very high93.1Very high3 Ų348.6 Ų48.62%0.01830%0.302CS..EExtended strand (participates in β ladder)trans-87.7129.6166.4-172.10000108V74 R88 I89 F117 V120V71-V74 HydrophobicContact CB-CG2 4.4Å; V71-V74 HydrophobicContact CG1-CG2 3.39Å; V71-R88 CarbonylContact O-C 3.52Å; V71-R88 WeakPolarHBondContact O-CA 3.38Å; V71-I89 HydrophobicContact CB-CB 4.31Å; V71-I89 PolarHBondContact N-O 3.38Å; V71-I89 PolarHBondContact O-N 2.97Å; V71-F117 HydrophobicContact CB-CD2 4.28Å; V71-F117 HydrophobicContact CG1-CD2 3.7Å; V71-F117 HydrophobicContact CG1-CE2 3.78Å; V71-F117 HydrophobicContact CG1-CG 4.49Å; V71-F117 HydrophobicContact CG2-CB 4.5Å; V71-F117 HydrophobicContact CG2-CD2 4.04Å; V71-V120 HydrophobicContact CG1-CG1 4.4Å; V71-V120 HydrophobicContact CG2-CB 4.49Å; V71-V120 HydrophobicContact CG2-CG1 4.36Å
72K93.7Very high93Very high107 Ų10747.3 Ų47.347%0.46529%0.292SS..EExtended strand (participates in β ladder)trans-125.3144.8-172.9-71.6172.8-179.9157.70112.5E70 D87E70-K72 WeakPolarHBondContact OE2-CE 3.46Å; E70-K72 IonicContact OE2-NZ 3.6Å; E70-K72 PolarHBondContact OE2-NZ 2.86Å; K72-D87 WeakPolarHBondContact CA-O 3.16Å
73N92.1Very high93Very high106 Ų10651.1 Ų51.157%0.56731%0.31SS*.EExtended strand (participates in β ladder)trans53.452178-57.1-59.8000113.4P75 F86 D87N73-P75 VanDerWaalsContact O-CD 3.24Å; N73-P75 WeakPolarHBondContact O-CD 3.28Å; N73-F86 CarbonylContact C-O 3.58Å; N73-F86 VanDerWaalsContact CA-O 3.28Å; N73-F86 WeakPolarHBondContact CA-O 3.42Å; N73-F86 PolarHBondContact N-O 3Å; N73-F86 VanDerWaalsContact N-O 3.15Å; N73-D87 PolarHBondContact N-O 2.62Å; N73-D87 VanDerWaalsContact N-O 3.16Å
74V93.8Very high93.1Very high0 Ų048.1 Ų48.10%030%0.296CS..EExtended strand (participates in β ladder)trans-75.8114.3177.8179.80000109.7V71 Y85 F86 I89 L124V71-V74 HydrophobicContact CB-CG2 4.4Å; V71-V74 HydrophobicContact CG1-CG2 3.39Å; V74-Y85 CarbonylContact O-C 3.51Å; V74-Y85 WeakPolarHBondContact O-CA 3.47Å; V74-F86 HydrophobicContact CB-CB 4.25Å; V74-F86 PolarHBondContact N-O 2.89Å; V74-F86 PolarHBondContact O-N 3.44Å; V74-I89 HydrophobicContact CB-CD1 4.49Å; V74-I89 HydrophobicContact CG2-CD1 4.02Å; V74-L124 HydrophobicContact CB-CD2 4.32Å; V74-L124 HydrophobicContact CG1-CD2 3.76Å
75P94.3Very high93.2Very high46 Ų4652.2 Ų52.230%0.29931%0.31SS..EExtended strand (participates in β ladder)trans-71.3138.2171.930.5-33.1000110N73 M83 Y85 N125N73-P75 VanDerWaalsContact O-CD 3.24Å; N73-P75 WeakPolarHBondContact O-CD 3.28Å; P75-M83 HydrophobicContact CB-CE 4.02Å; P75-Y85 HydrophobicContact CB-CD1 4.05Å; P75-Y85 HydrophobicContact CB-CE1 3.77Å; P75-N125 PolarHBondContact O-ND2 3.26Å; P75-N125 PolarHBondContact O-OD1 3.39Å
76C94.6Very high93.3Very high0 Ų049.4 Ų49.40%029%0.293CS..EExtended strand (participates in β ladder)trans-131.8127.4174.8-129.50000110.7M83 I84 F86 L124 N125 C128C76-M83 WeakPolarHBondContact O-CA 3.46Å; C76-I84 HydrophobicContact CB-CD1 4.17Å; C76-I84 HydrophobicContact CB-CG1 3.63Å; C76-I84 PolarHBondContact N-O 2.91Å; C76-I84 WeakPolarHBondContact O-CG1 3.4Å; C76-I84 PolarHBondContact O-N 3.39Å; C76-F86 HydrophobicContact CB-CD2 4.12Å; C76-F86 HydrophobicContact CB-CE2 3.76Å; C76-L124 VanDerWaalsContact SG-C 3.54Å; C76-L124 PolarHBondContact SG-O 3.42Å; C76-N125 WeakPolarHBondContact CA-OD1 3.21Å; C76-C128 HydrophobicContact CB-CB 3.88Å; C76-C128 WeakPolarHBondContact CB-SG 3.4Å; C76-C128 WeakPolarHBondContact SG-CB 3.26Å; C76-C128 CovalentContact SG-SG 2.04Å; C76-C128 PolarHBondContact SG-SG 3.32Å
77G94.1Very high93.3Very high21 Ų2147.9 Ų47.922%0.21629%0.285CS..EExtended strand (participates in β ladder)trans-89.7116.4170.400000110.9N125 C128 S129G77-N125 PolarHBondContact N-OD1 2.97Å; G77-C128 CarbonylContact O-C 3.5Å; G77-C128 VanDerWaalsContact O-CB 3.23Å; G77-C128 WeakPolarHBondContact O-CB 3.27Å; G77-S129 PolarHBondContact O-N 3.47Å
78T95Very high93.4Very high7 Ų750.9 Ų50.94%0.04330%0.295CS..  trans-76.2157.7173.459.10000111.8G80 G81 V82 I84 C128 L133T78-G80 PolarHBondContact O-N 3.3Å; T78-G80 VanDerWaalsContact O-N 3.1Å; T78-G81 PolarHBondContact O-N 2.93Å; T78-V82 PolarHBondContact N-O 3.12Å; T78-V82 PolarHBondContact OG1-N 2.85Å; T78-V82 PolarHBondContact OG1-O 2.84Å; T78-I84 HydrophobicContact CG2-CD1 3.81Å; T78-I84 HydrophobicContact CG2-CG1 4.19Å; T78-I84 HydrophobicContact CG2-CG2 4.45Å; T78-C128 CarbonylContact C-O 3.53Å; T78-C128 VanDerWaalsContact CA-O 3.31Å; T78-C128 WeakPolarHBondContact CA-O 3.39Å; T78-L133 HydrophobicContact CG2-CB 4.31Å; T78-L133 HydrophobicContact CG2-CD1 4.2Å
79S94.1Very high93.5Very high68 Ų6847.4 Ų47.448%0.47627%0.274SS..THydrogen-bonded Turntrans-58.2-24.8176.570.30000113.8G81 C128 S129 H131 S132S79-G81 VanDerWaalsContact C-N 3.25Å; S79-G81 PolarHBondContact O-N 3.39Å; S79-C128 PolarHBondContact N-O 2.91Å; S79-C128 VanDerWaalsContact N-O 3.15Å; S79-S129 VanDerWaalsContact CB-O 3.27Å; S79-S129 WeakPolarHBondContact CB-O 3.31Å; S79-H131 PolarHBondContact N-O 2.81Å; S79-H131 VanDerWaalsContact OG-C 3.23Å; S79-H131 PolarHBondContact OG-O 2.89Å; S79-H131 VanDerWaalsContact OG-O 3.12Å; S79-S132 PolarHBondContact OG-N 3.31Å
80G89.6Confident93.6Very high59 Ų5947.4 Ų47.461%0.60827%0.273SS*.THydrogen-bonded Turntrans-79.16.3172.700000115.3T78 V82T78-G80 PolarHBondContact O-N 3.3Å; T78-G80 VanDerWaalsContact O-N 3.1Å; G80-V82 VanDerWaalsContact C-N 3.25Å; G80-V82 PolarHBondContact O-N 3.17Å
81G88.7Confident93.7Very high66 Ų6643.5 Ų43.568%0.6825%0.254SS*.SBendtrans75.26.2179.200000115.2T78 S79T78-G81 PolarHBondContact O-N 2.93Å; S79-G81 VanDerWaalsContact C-N 3.25Å; S79-G81 PolarHBondContact O-N 3.39Å
82V92.1Very high93.8Very high38 Ų3844.8 Ų44.823%0.2326%0.262CS..  trans-85.9125.5175.2-177.20000109.2T78 G80 I84 L133T78-V82 PolarHBondContact N-O 3.12Å; T78-V82 PolarHBondContact OG1-N 2.85Å; T78-V82 PolarHBondContact OG1-O 2.84Å; G80-V82 VanDerWaalsContact C-N 3.25Å; G80-V82 PolarHBondContact O-N 3.17Å; V82-I84 HydrophobicContact CG1-CG2 4.4Å; V82-L133 HydrophobicContact CB-CD2 4.48Å; V82-L133 HydrophobicContact CG1-CD2 4.25Å
83M92.8Very high93.8Very high90 Ų9039.7 Ų39.744%0.44324%0.24SC..EExtended strand (participates in β ladder)trans-78.9125.3169.8-65.6-59.9-61.500110P75 C76P75-M83 HydrophobicContact CB-CE 4.02Å; C76-M83 WeakPolarHBondContact O-CA 3.46Å
84I94.6Very high93.9Very high0 Ų038.3 Ų38.30%023%0.228CC..EExtended strand (participates in β ladder)trans-117.9161.5172.160.2177.1000109.9C76 T78 V82 F86 L133 V136 P173 I175C76-I84 HydrophobicContact CB-CD1 4.17Å; C76-I84 HydrophobicContact CB-CG1 3.63Å; C76-I84 PolarHBondContact N-O 2.91Å; C76-I84 WeakPolarHBondContact O-CG1 3.4Å; C76-I84 PolarHBondContact O-N 3.39Å; T78-I84 HydrophobicContact CG2-CD1 3.81Å; T78-I84 HydrophobicContact CG2-CG1 4.19Å; T78-I84 HydrophobicContact CG2-CG2 4.45Å; V82-I84 HydrophobicContact CG1-CG2 4.4Å; I84-F86 HydrophobicContact CD1-CE2 3.94Å; I84-F86 HydrophobicContact CD1-CZ 4.25Å; I84-F86 HydrophobicContact CG1-CE2 4.34Å; I84-L133 HydrophobicContact CG2-CD1 3.47Å; I84-L133 VanDerWaalsContact CG2-CD1 3.47Å; I84-V136 HydrophobicContact CD1-CG1 3.96Å; I84-P173 HydrophobicContact CB-CB 4.23Å; I84-P173 HydrophobicContact CD1-CB 3.91Å; I84-P173 HydrophobicContact CD1-CG 4.05Å; I84-P173 HydrophobicContact CG1-CB 4.34Å; I84-I175 HydrophobicContact CG2-CG1 4.15Å
85Y95Very high94Very high108 Ų10838.3 Ų38.342%0.42423%0.228SC..EExtended strand (participates in β ladder)trans-128.1128.9179.4-64.6-93.4000110.3V74 P75 P173 N174V74-Y85 CarbonylContact O-C 3.51Å; V74-Y85 WeakPolarHBondContact O-CA 3.47Å; P75-Y85 HydrophobicContact CB-CD1 4.05Å; P75-Y85 HydrophobicContact CB-CE1 3.77Å; Y85-P173 CarbonylContact O-C 3.53Å; Y85-P173 VanDerWaalsContact O-CA 3.31Å; Y85-P173 WeakPolarHBondContact O-CA 3.41Å; Y85-N174 PolarHBondContact N-O 3.43Å; Y85-N174 PolarHBondContact O-N 3.39Å
86F95.1Very high94Very high0 Ų038.9 Ų38.90%023%0.227CC..EExtended strand (participates in β ladder)trans-89112.8170-67.4-97.7000108.6N73 V74 C76 I84 R88 I89 L124 V136 I144 V170 T171 P173N73-F86 CarbonylContact C-O 3.58Å; N73-F86 VanDerWaalsContact CA-O 3.28Å; N73-F86 WeakPolarHBondContact CA-O 3.42Å; N73-F86 PolarHBondContact N-O 3Å; N73-F86 VanDerWaalsContact N-O 3.15Å; V74-F86 HydrophobicContact CB-CB 4.25Å; V74-F86 PolarHBondContact N-O 2.89Å; V74-F86 PolarHBondContact O-N 3.44Å; C76-F86 HydrophobicContact CB-CD2 4.12Å; C76-F86 HydrophobicContact CB-CE2 3.76Å; I84-F86 HydrophobicContact CD1-CE2 3.94Å; I84-F86 HydrophobicContact CD1-CZ 4.25Å; I84-F86 HydrophobicContact CG1-CE2 4.34Å; F86-R88 VanDerWaalsContact C-N 3.32Å; F86-R88 PolarHBondContact O-N 2.73Å; F86-I89 HydrophobicContact CB-CD1 4.28Å; F86-I89 HydrophobicContact CB-CG1 4.32Å; F86-L124 HydrophobicContact CB-CD2 4.39Å; F86-L124 HydrophobicContact CD1-CD2 4.42Å; F86-L124 HydrophobicContact CD2-CD2 3.4Å; F86-L124 VanDerWaalsContact CD2-CD2 3.4Å; F86-L124 HydrophobicContact CD2-CG 4.27Å; F86-L124 HydrophobicContact CE2-CD1 4.27Å; F86-L124 HydrophobicContact CE2-CD2 3.64Å; F86-L124 HydrophobicContact CE2-CG 4.01Å; F86-L124 HydrophobicContact CG-CD2 3.83Å; F86-L124 HydrophobicContact CZ-CD1 4.2Å; F86-L124 HydrophobicContact CZ-CD2 4.24Å; F86-L124 HydrophobicContact CZ-CG 4.44Å; F86-V136 HydrophobicContact CZ-CG1 4.01Å; F86-I144 HydrophobicContact CZ-CD1 4.49Å; F86-V170 HydrophobicContact CD1-CG1 3.3Å; F86-V170 HydrophobicContact CE1-CG1 3.45Å; F86-V170 VanDerWaalsContact CE1-CG1 3.45Å; F86-V170 HydrophobicContact CG-CG1 4.37Å; F86-T171 VanDerWaalsContact CD1-O 3.31Å; F86-T171 WeakPolarHBondContact CD1-O 3.43Å; F86-P173 HydrophobicContact CD1-CB 3.88Å; F86-P173 HydrophobicContact CD1-CG 4.38Å; F86-P173 HydrophobicContact CD2-CB 4.17Å; F86-P173 HydrophobicContact CE1-CB 3.76Å; F86-P173 HydrophobicContact CE1-CG 3.82Å; F86-P173 HydrophobicContact CE2-CB 4.04Å; F86-P173 HydrophobicContact CG-CB 4.11Å; F86-P173 HydrophobicContact CZ-CB 3.85Å; F86-P173 HydrophobicContact CZ-CG 3.93Å
87D93.1Very high93.9Very high71 Ų7142.2 Ų42.238%0.3825%0.249SC..EExtended strand (participates in β ladder)trans-62-41.6-174.1-69.4-14000111.2K72 N73K72-D87 WeakPolarHBondContact CA-O 3.16Å; N73-D87 PolarHBondContact N-O 2.62Å; N73-D87 VanDerWaalsContact N-O 3.16Å
88R94.7Very high93.8Very high91 Ų9146.2 Ų46.234%0.34327%0.274SS..EExtended strand (participates in β ladder)trans-147.3140.5177.2-167.1-165-62.2-149.9-8.7112.9E70 V71 F86 E90 T171E70-R88 IonicContact OE1-CZ 2.71Å; E70-R88 VanDerWaalsContact OE1-CZ 3.23Å; E70-R88 IonicContact OE1-NE 3.61Å; E70-R88 IonicContact OE1-NH1 3.93Å; E70-R88 PolarHBondContact OE1-NH1 2.85Å; E70-R88 IonicContact OE1-NH2 3.7Å; V71-R88 CarbonylContact O-C 3.52Å; V71-R88 WeakPolarHBondContact O-CA 3.38Å; F86-R88 VanDerWaalsContact C-N 3.32Å; F86-R88 PolarHBondContact O-N 2.73Å; R88-E90 WeakPolarHBondContact CD-OE1 3.5Å; R88-E90 HydrophobicContact CG-CG 4.08Å; R88-E90 IonicContact CZ-OE1 3.97Å; R88-E90 IonicContact NE-OE1 3.95Å; R88-E90 IonicContact NH1-OE1 2.78Å; R88-E90 PolarHBondContact NH1-OE1 3.01Å; R88-T171 HydrophobicContact CB-CG2 4.03Å; R88-T171 PolarHBondContact N-OG1 3.03Å; R88-T171 VanDerWaalsContact N-OG1 3.07Å; R88-T171 WeakPolarHBondContact O-CB 3.31Å; R88-T171 PolarHBondContact O-N 2.92Å; R88-T171 PolarHBondContact O-OG1 2.99Å
89I95.6Very high93.7Very high0 Ų046.3 Ų46.30%028%0.275CS..EExtended strand (participates in β ladder)trans-127.5128.7164.3-56174.7000107.1E70 V71 V74 F86 V91 V120 L124 L148 V168 R169 V170E70-I89 WeakPolarHBondContact CA-O 3.36Å; V71-I89 HydrophobicContact CB-CB 4.31Å; V71-I89 PolarHBondContact N-O 3.38Å; V71-I89 PolarHBondContact O-N 2.97Å; V74-I89 HydrophobicContact CB-CD1 4.49Å; V74-I89 HydrophobicContact CG2-CD1 4.02Å; F86-I89 HydrophobicContact CB-CD1 4.28Å; F86-I89 HydrophobicContact CB-CG1 4.32Å; I89-V91 HydrophobicContact CG2-CG2 4.34Å; I89-V120 HydrophobicContact CD1-CG1 3.69Å; I89-V120 HydrophobicContact CG2-CG1 4.28Å; I89-L124 HydrophobicContact CD1-CD2 3.53Å; I89-L148 HydrophobicContact CG2-CD2 4.46Å; I89-V168 HydrophobicContact CG2-CG1 4.04Å; I89-R169 WeakPolarHBondContact CA-O 3.28Å; I89-V170 HydrophobicContact CD1-CG2 4.37Å; I89-V170 HydrophobicContact CG1-CG1 4.25Å; I89-V170 HydrophobicContact CG1-CG2 4.18Å; I89-V170 HydrophobicContact CG2-CG2 3.96Å
90E95.5Very high93.7Very high32 Ų3243.1 Ų43.115%0.1525%0.253CS..EExtended strand (participates in β ladder)trans-107.7113.1-179.6-65.6173.6172.800108.2T68 D69 E70 R88 V168 R169T68-E90 HydrophobicContact CG2-CB 3.89Å; T68-E90 HydrophobicContact CG2-CG 4.33Å; D69-E90 WeakPolarHBondContact O-CA 3.41Å; E70-E90 HydrophobicContact CG-CG 4.46Å; R88-E90 WeakPolarHBondContact CD-OE1 3.5Å; R88-E90 HydrophobicContact CG-CG 4.08Å; R88-E90 IonicContact CZ-OE1 3.97Å; R88-E90 IonicContact NE-OE1 3.95Å; R88-E90 IonicContact NH1-OE1 2.78Å; R88-E90 PolarHBondContact NH1-OE1 3.01Å; E90-V168 WeakPolarHBondContact O-CA 3.47Å; E90-R169 HydrophobicContact CB-CB 4.38Å; E90-R169 PolarHBondContact N-O 3.44Å; E90-R169 PolarHBondContact O-N 3.23Å; E90-R169 IonicContact OE2-NH1 3.26Å; E90-R169 PolarHBondContact OE2-NH1 2.82Å
91V96.1Very high93.9Very high0 Ų042.4 Ų42.40%023%0.232CC..EExtended strand (participates in β ladder)trans-104.4111.6175.3-1800000108.7T68 D69 I89 I116 V120 I165 V168T68-V91 WeakPolarHBondContact CA-O 3.42Å; D69-V91 PolarHBondContact N-O 2.88Å; D69-V91 PolarHBondContact O-N 3.49Å; I89-V91 HydrophobicContact CG2-CG2 4.34Å; V91-I116 HydrophobicContact CB-CG2 3.89Å; V91-I116 HydrophobicContact CG1-CG2 3.89Å; V91-I116 HydrophobicContact CG2-CG2 3.86Å; V91-V120 HydrophobicContact CG2-CG2 4.02Å; V91-I165 HydrophobicContact CG1-CD1 4.22Å; V91-I165 HydrophobicContact CG1-CG1 4.18Å; V91-I165 HydrophobicContact CG1-CG2 4.21Å; V91-V168 HydrophobicContact CG1-CG2 4.35Å; V91-V168 HydrophobicContact CG2-CG1 4.26Å; V91-V168 HydrophobicContact CG2-CG2 4.34Å
92V95.8Very high94.2Very high30 Ų3043.2 Ų43.218%0.18222%0.221CC..EExtended strand (participates in β ladder)trans-87.7114176.9-1750000108.6L66 Q67 T68 Q166 A167L66-V92 HydrophobicContact CD1-CG1 3.89Å; L66-V92 HydrophobicContact CD2-CG1 3.57Å; L66-V92 HydrophobicContact CG-CG1 3.64Å; Q67-V92 VanDerWaalsContact O-CA 3.29Å; Q67-V92 WeakPolarHBondContact O-CA 3.48Å; T68-V92 HydrophobicContact CG2-CG2 4.27Å; V92-Q166 HydrophobicContact CB-CB 4.41Å; V92-Q166 HydrophobicContact CG1-CB 4.03Å; V92-Q166 PolarHBondContact O-N 3.2Å; V92-A167 HydrophobicContact CB-CB 4.34Å; V92-A167 HydrophobicContact CG2-CB 4.48Å; V92-A167 PolarHBondContact N-O 2.84Å; V92-A167 PolarHBondContact O-N 3.44Å
93N94.3Very high94.2Very high0 Ų041.7 Ų41.70%021%0.211CC..EExtended strand (participates in β ladder)trans-129.7167.9-179.37982000112L66 Q67 D69 I116 L163 I164 I165L66-N93 WeakPolarHBondContact CA-O 3.32Å; Q67-N93 PolarHBondContact N-O 3.27Å; Q67-N93 PolarHBondContact O-N 3.07Å; D69-N93 PolarHBondContact OD2-ND2 3.48Å; N93-I116 HydrophobicContact CB-CD1 4.35Å; N93-L163 HydrophobicContact CB-CD1 4.35Å; N93-L163 WeakPolarHBondContact OD1-CD1 3.37Å; N93-I164 CarbonylContact C-O 3.6Å; N93-I164 WeakPolarHBondContact CA-O 3.39Å; N93-I164 WeakPolarHBondContact CB-O 3.45Å; N93-I165 HydrophobicContact CB-CG1 4.47Å
94Y94.1Very high94.3Very high78 Ų7837.7 Ų37.731%0.30619%0.192SC..EExtended strand (participates in β ladder)trans-146.8151.7161.674.2-81.3000110.8I96 I164Y94-I96 HydrophobicContact CE2-CG1 4.1Å; Y94-I164 HydrophobicContact CD1-CB 4.14Å; Y94-I164 HydrophobicContact CD1-CG2 4.32Å; Y94-I164 HydrophobicContact CE1-CB 3.68Å; Y94-I164 HydrophobicContact CE1-CD1 4.33Å; Y94-I164 HydrophobicContact CE1-CG2 3.61Å; Y94-I164 HydrophobicContact CE2-CD1 4.33Å; Y94-I164 PolarHBondContact N-O 3.06Å; Y94-I164 PolarHBondContact O-N 3.28Å; Y94-I164 WeakPolarHBondContact OH-CD1 3.47Å
95L94.3Very high94.2Very high0 Ų045.2 Ų45.20%022%0.22CC..EExtended strand (participates in β ladder)trans-108.3121.6179.4173.950000110.9V62 T64 A99 V100 I103 Y111 G162 L163V62-L95 HydrophobicContact CG1-CD2 3.82Å; T64-L95 VanDerWaalsContact CB-O 3.27Å; T64-L95 WeakPolarHBondContact CB-O 3.46Å; T64-L95 HydrophobicContact CG2-CG 4.45Å; L95-A99 HydrophobicContact CD1-CB 4.11Å; L95-V100 HydrophobicContact CD2-CG2 3.83Å; L95-V100 HydrophobicContact CG-CG2 3.84Å; L95-I103 HydrophobicContact CD1-CD1 3.52Å; L95-Y111 HydrophobicContact CD2-CE1 3.81Å; L95-G162 WeakPolarHBondContact CD1-O 3.37Å; L95-L163 HydrophobicContact CB-CD1 4.26Å
96I94.3Very high94.1Very high57 Ų5745.2 Ų45.229%0.29223%0.228SC..  trans-63.1126.4174.1-57.5178.6000109.8Y94 S98 A99 G162 I164Y94-I96 HydrophobicContact CE2-CG1 4.1Å; I96-S98 WeakPolarHBondContact CG2-OG 3.36Å; I96-S98 PolarHBondContact O-N 2.9Å; I96-A99 PolarHBondContact O-N 3.43Å; I96-G162 WeakPolarHBondContact CG1-O 3.4Å; I96-G162 PolarHBondContact N-O 3.11Å; I96-I164 HydrophobicContact CD1-CD1 3.9Å; I96-I164 HydrophobicContact CG1-CD1 4.31Å
97P92.3Very high93.9Very high71 Ų7147.9 Ų47.946%0.46124%0.24SC..G310 helixtrans-53.7-30.9-176.8-3035.2000115.9T64 A99 V100T64-P97 HydrophobicContact CG2-CG 4.26Å; P97-A99 VanDerWaalsContact C-N 3.32Å; P97-A99 PolarHBondContact O-N 3.14Å; P97-V100 WeakPolarHBondContact O-CG2 3.35Å
98S92.6Very high93.8Very high104 Ų10448.4 Ų48.473%0.72725%0.245SC*.G310 helixtrans-70.1-24.617857.60000114I96I96-S98 WeakPolarHBondContact CG2-OG 3.36Å; I96-S98 PolarHBondContact O-N 2.9Å
99A94.3Very high93.5Very high10 Ų1044.6 Ų44.68%0.08323%0.233CC..G310 helixtrans-91.1-10.9-178.700000113.4L95 I96 P97 Y101 D102 I103 P161L95-A99 HydrophobicContact CD1-CB 4.11Å; I96-A99 PolarHBondContact O-N 3.43Å; P97-A99 VanDerWaalsContact C-N 3.32Å; P97-A99 PolarHBondContact O-N 3.14Å; A99-Y101 VanDerWaalsContact C-N 3.3Å; A99-Y101 PolarHBondContact O-N 3.1Å; A99-D102 PolarHBondContact O-N 2.87Å; A99-D102 VanDerWaalsContact O-N 3.17Å; A99-I103 PolarHBondContact O-N 3.42Å; A99-P161 WeakPolarHBondContact CB-O 3.28Å
100V94Very high93.3Very high0 Ų049.2 Ų49.20%026%0.258CS..Hα-helixtrans-53.3-44.7-175.3174.10000112.1T31 V33 V62 T64 L95 P97 D102 V104T31-V100 HydrophobicContact CG2-CB 4.32Å; T31-V100 HydrophobicContact CG2-CG1 4.05Å; T31-V100 HydrophobicContact CG2-CG2 4.31Å; V33-V100 HydrophobicContact CG2-CG1 3.54Å; V62-V100 HydrophobicContact CB-CG1 4.14Å; V62-V100 HydrophobicContact CG1-CG1 4.29Å; V62-V100 HydrophobicContact CG2-CG1 4.41Å; T64-V100 HydrophobicContact CG2-CG2 3.53Å; L95-V100 HydrophobicContact CD2-CG2 3.83Å; L95-V100 HydrophobicContact CG-CG2 3.84Å; P97-V100 WeakPolarHBondContact O-CG2 3.35Å; V100-D102 PolarHBondContact O-N 3.2Å; V100-V104 HydrophobicContact CG1-CG2 4.2Å; V100-V104 VanDerWaalsContact O-CB 3.29Å; V100-V104 WeakPolarHBondContact O-CB 3.33Å; V100-V104 WeakPolarHBondContact O-CG2 3.49Å; V100-V104 PolarHBondContact O-N 2.85Å
101Y93.6Very high93.1Very high45 Ų4547.9 Ų47.918%0.17625%0.252CS..Hα-helixtrans-61.6-46.4-179.3172.6-101.2000112.4L40 L41 T42 A99 R105L40-Y101 HydrophobicContact CD2-CD2 3.79Å; L40-Y101 HydrophobicContact CD2-CE2 3.56Å; L40-Y101 HydrophobicContact CG-CD2 4.32Å; L40-Y101 HydrophobicContact CG-CE2 3.98Å; L41-Y101 WeakPolarHBondContact O-CE2 3.22Å; T42-Y101 HydrophobicContact CG2-CE2 4.31Å; A99-Y101 VanDerWaalsContact C-N 3.3Å; A99-Y101 PolarHBondContact O-N 3.1Å; Y101-R105 VanDerWaalsContact O-CB 3.22Å; Y101-R105 WeakPolarHBondContact O-CB 3.44Å; Y101-R105 PolarHBondContact O-N 3.07Å
102D93.5Very high92.9Very high83 Ų8349.7 Ų49.744%0.44426%0.261SS..Hα-helixtrans-72.4-38.5-176.4-68.7-42.3000112.1A99 V100 R105 N106A99-D102 PolarHBondContact O-N 2.87Å; A99-D102 VanDerWaalsContact O-N 3.17Å; V100-D102 PolarHBondContact O-N 3.2Å; D102-R105 PolarHBondContact O-N 2.9Å; D102-N106 WeakPolarHBondContact O-CB 3.37Å; D102-N106 VanDerWaalsContact O-CG 3.28Å; D102-N106 PolarHBondContact O-N 3.34Å; D102-N106 PolarHBondContact O-ND2 3.41Å
103I93.7Very high92.6Very high5 Ų555 Ų553%0.02628%0.282CS..Hα-helixtrans-64.6-47.7174-64.7-170.5000110.6L95 A99 R105 N106 F107 Y111 L115 A160 L163L95-I103 HydrophobicContact CD1-CD1 3.52Å; A99-I103 PolarHBondContact O-N 3.42Å; I103-R105 PolarHBondContact O-N 2.91Å; I103-N106 PolarHBondContact O-N 3.45Å; I103-F107 HydrophobicContact CG2-CD2 4.34Å; I103-F107 PolarHBondContact O-N 2.97Å; I103-Y111 HydrophobicContact CG2-CD1 3.8Å; I103-Y111 HydrophobicContact CG2-CD2 4.14Å; I103-Y111 HydrophobicContact CG2-CE1 4.48Å; I103-Y111 HydrophobicContact CG2-CG 3.64Å; I103-L115 HydrophobicContact CG2-CD1 4.48Å; I103-A160 HydrophobicContact CD1-CB 4.07Å; I103-A160 HydrophobicContact CG1-CB 4.36Å; I103-L163 HydrophobicContact CD1-CB 3.96Å
104V93.6Very high92.4Very high6 Ų657.3 Ų57.34%0.03630%0.301CS..Hα-helixtrans-65.2-29.6179.3174.30000112V33 Y35 L40 V62 V100 T108 A109V33-V104 HydrophobicContact CG1-CG1 4.3Å; V33-V104 HydrophobicContact CG2-CG2 4.32Å; Y35-V104 VanDerWaalsContact OH-CG1 3.22Å; Y35-V104 WeakPolarHBondContact OH-CG1 3.05Å; L40-V104 HydrophobicContact CD1-CG1 3.85Å; L40-V104 HydrophobicContact CD2-CG1 4.24Å; V62-V104 HydrophobicContact CG2-CG2 3.84Å; V100-V104 HydrophobicContact CG1-CG2 4.2Å; V100-V104 VanDerWaalsContact O-CB 3.29Å; V100-V104 WeakPolarHBondContact O-CB 3.33Å; V100-V104 WeakPolarHBondContact O-CG2 3.49Å; V100-V104 PolarHBondContact O-N 2.85Å; V104-T108 WeakPolarHBondContact O-CA 3.48Å; V104-T108 PolarHBondContact O-N 3.34Å; V104-A109 HydrophobicContact CG1-CB 4.32Å
105R92.7Very high92.4Very high158 Ų15853.9 Ų53.960%0.59629%0.288SS*.Hα-helixtrans-70.4-41.2174.1-176.1179.1-179.7-174.20.4112.9L40 Y101 D102 I103L40-R105 HydrophobicContact CD2-CB 3.83Å; L40-R105 HydrophobicContact CD2-CG 4.49Å; Y101-R105 VanDerWaalsContact O-CB 3.22Å; Y101-R105 WeakPolarHBondContact O-CB 3.44Å; Y101-R105 PolarHBondContact O-N 3.07Å; D102-R105 PolarHBondContact O-N 2.9Å; I103-R105 PolarHBondContact O-N 2.91Å
106N92.7Very high92.3Very high108 Ų10854 Ų5458%0.57829%0.289SS*.Hα-helixtrans-88.7-37.3-173.7-66.5-16.8000113D102 I103D102-N106 WeakPolarHBondContact O-CB 3.37Å; D102-N106 VanDerWaalsContact O-CG 3.28Å; D102-N106 PolarHBondContact O-N 3.34Å; D102-N106 PolarHBondContact O-ND2 3.41Å; I103-N106 PolarHBondContact O-N 3.45Å
107F91.4Very high92.2Very high57 Ų5754.8 Ų54.825%0.2529%0.29CS..Hα-helixtrans-118.94.8-171.6-59.9-75.3000114I103 L115 M159 A160I103-F107 HydrophobicContact CG2-CD2 4.34Å; I103-F107 PolarHBondContact O-N 2.97Å; F107-L115 HydrophobicContact CB-CD1 4.43Å; F107-L115 HydrophobicContact CD1-CD1 4.45Å; F107-L115 HydrophobicContact CD1-CD2 3.85Å; F107-L115 HydrophobicContact CD1-CG 4.1Å; F107-L115 HydrophobicContact CD2-CD1 3.94Å; F107-L115 HydrophobicContact CD2-CD2 4.38Å; F107-L115 HydrophobicContact CD2-CG 4.45Å; F107-L115 HydrophobicContact CE1-CD2 3.65Å; F107-L115 HydrophobicContact CE1-CG 4.4Å; F107-L115 HydrophobicContact CE2-CD1 4.32Å; F107-L115 HydrophobicContact CE2-CD2 4.2Å; F107-L115 HydrophobicContact CG-CD1 4.01Å; F107-L115 HydrophobicContact CG-CD2 4.22Å; F107-L115 HydrophobicContact CG-CG 4.13Å; F107-L115 HydrophobicContact CZ-CD2 3.83Å; F107-M159 WeakPolarHBondContact CE2-O 3.41Å; F107-M159 HydrophobicContact CZ-CB 4.32Å; F107-A160 HydrophobicContact CE2-CB 4.11Å
108T91.6Very high92.2Very high81 Ų8155.6 Ų55.650%0.49729%0.291SS..  trans65.1177.7-170.881.70000113.1V104 D110V104-T108 WeakPolarHBondContact O-CA 3.48Å; V104-T108 PolarHBondContact O-N 3.34Å; T108-D110 PolarHBondContact O-N 2.72Å; T108-D110 PolarHBondContact OG1-N 2.63Å
109A88.3Confident92.3Very high12 Ų1252.5 Ų52.510%0.09926%0.264CS..THydrogen-bonded Turntrans-72.6-14.9178.700000114K60 V62 V104 Y111K60-A109 HydrophobicContact CB-CB 4.3Å; K60-A109 HydrophobicContact CD-CB 3.26Å; K60-A109 HydrophobicContact CG-CB 4.41Å; V62-A109 HydrophobicContact CG2-CB 4.47Å; V104-A109 HydrophobicContact CG1-CB 4.32Å; A109-Y111 VanDerWaalsContact C-N 3.3Å; A109-Y111 PolarHBondContact O-N 3.47Å
110D90.2Very high92.3Very high97 Ų9752 Ų5252%0.51926%0.26SS..THydrogen-bonded Turntrans-100.942.5-179.2-46.4-56.2000109.6K60 T108 D112 K113K60-D110 IonicContact NZ-OD1 2.83Å; K60-D110 PolarHBondContact NZ-OD1 3.43Å; K60-D110 IonicContact NZ-OD2 2.66Å; K60-D110 PolarHBondContact NZ-OD2 2.89Å; T108-D110 PolarHBondContact O-N 2.72Å; T108-D110 PolarHBondContact OG1-N 2.63Å; D110-D112 VanDerWaalsContact C-N 3.32Å; D110-D112 PolarHBondContact O-N 2.86Å; D110-K113 PolarHBondContact O-N 3.44Å
111Y91.4Very high92.3Very high3 Ų353.9 Ų53.91%0.01227%0.269CS..Hα-helixtrans-65.9-29.8-16864.1-96000113.2V62 L95 I103 A109 K113 A114 L115 L163V62-Y111 HydrophobicContact CG1-CE1 3.89Å; L95-Y111 HydrophobicContact CD2-CE1 3.81Å; I103-Y111 HydrophobicContact CG2-CD1 3.8Å; I103-Y111 HydrophobicContact CG2-CD2 4.14Å; I103-Y111 HydrophobicContact CG2-CE1 4.48Å; I103-Y111 HydrophobicContact CG2-CG 3.64Å; A109-Y111 VanDerWaalsContact C-N 3.3Å; A109-Y111 PolarHBondContact O-N 3.47Å; Y111-K113 PolarHBondContact O-N 3.45Å; Y111-K113 VanDerWaalsContact O-N 3.14Å; Y111-A114 PolarHBondContact O-N 3.37Å; Y111-L115 HydrophobicContact CD2-CD1 4.16Å; Y111-L115 WeakPolarHBondContact O-CB 3.36Å; Y111-L115 PolarHBondContact O-N 2.96Å; Y111-L163 HydrophobicContact CD2-CD2 4.02Å; Y111-L163 HydrophobicContact CE2-CD1 3.87Å; Y111-L163 HydrophobicContact CE2-CD2 3.88Å
112D91.7Very high92.3Very high38 Ų3856.9 Ų56.920%0.20328%0.284CS..Hα-helixtrans-54.2-36.4-179.9-44.6-61.7000111.5D110 A114 I116 F117D110-D112 VanDerWaalsContact C-N 3.32Å; D110-D112 PolarHBondContact O-N 2.86Å; D112-A114 PolarHBondContact O-N 3.04Å; D112-I116 CarbonylContact O-C 3.55Å; D112-I116 WeakPolarHBondContact O-CA 3.25Å; D112-I116 WeakPolarHBondContact O-CB 3.35Å; D112-I116 PolarHBondContact O-N 3.18Å; D112-F117 PolarHBondContact O-N 2.84Å
113K91.1Very high92.3Very high141 Ų14154 Ų5461%0.61327%0.268SS*.Iπ-helixtrans-67.2-38.5179.5-170.6174.2-178.1178.10112.5D110 Y111 N118D110-K113 PolarHBondContact O-N 3.44Å; Y111-K113 PolarHBondContact O-N 3.45Å; Y111-K113 VanDerWaalsContact O-N 3.14Å; K113-N118 PolarHBondContact O-N 2.97Å; K113-N118 VanDerWaalsContact O-N 3.16Å; K113-N118 PolarHBondContact O-ND2 3.28Å; K113-N118 PolarHBondContact O-OD1 3.42Å
114A90.1Very high92.3Very high49 Ų4953.9 Ų53.941%0.40527%0.267SS..Iπ-helixtrans-82.1-44.7-178.300000111.9Y111 D112Y111-A114 PolarHBondContact O-N 3.37Å; D112-A114 PolarHBondContact O-N 3.04Å
115L92.3Very high92.2Very high7 Ų756.2 Ų56.24%0.03728%0.28CS..Iπ-helixtrans-87.7-36.7-171.6-70.1179.2000113.7I103 F107 Y111 K119 L156 A160 L163I103-L115 HydrophobicContact CG2-CD1 4.48Å; F107-L115 HydrophobicContact CB-CD1 4.43Å; F107-L115 HydrophobicContact CD1-CD1 4.45Å; F107-L115 HydrophobicContact CD1-CD2 3.85Å; F107-L115 HydrophobicContact CD1-CG 4.1Å; F107-L115 HydrophobicContact CD2-CD1 3.94Å; F107-L115 HydrophobicContact CD2-CD2 4.38Å; F107-L115 HydrophobicContact CD2-CG 4.45Å; F107-L115 HydrophobicContact CE1-CD2 3.65Å; F107-L115 HydrophobicContact CE1-CG 4.4Å; F107-L115 HydrophobicContact CE2-CD1 4.32Å; F107-L115 HydrophobicContact CE2-CD2 4.2Å; F107-L115 HydrophobicContact CG-CD1 4.01Å; F107-L115 HydrophobicContact CG-CD2 4.22Å; F107-L115 HydrophobicContact CG-CG 4.13Å; F107-L115 HydrophobicContact CZ-CD2 3.83Å; Y111-L115 HydrophobicContact CD2-CD1 4.16Å; Y111-L115 WeakPolarHBondContact O-CB 3.36Å; Y111-L115 PolarHBondContact O-N 2.96Å; L115-K119 VanDerWaalsContact O-CB 3.28Å; L115-K119 WeakPolarHBondContact O-CB 3.33Å; L115-L156 HydrophobicContact CB-CD2 3.97Å; L115-L156 HydrophobicContact CD1-CD2 4.31Å; L115-L156 HydrophobicContact CD2-CD2 4.21Å; L115-L156 HydrophobicContact CG-CD2 4.4Å; L115-A160 HydrophobicContact CD1-CB 3.64Å; L115-A160 HydrophobicContact CD2-CB 4.39Å; L115-L163 HydrophobicContact CB-CD2 4.47Å; L115-L163 HydrophobicContact CD1-CD2 4.04Å
116I93.4Very high92.3Very high1 Ų153.8 Ų53.81%0.00528%0.275CS..Iπ-helixtrans-104.1-63.5-175.8-60.3171.1000110D69 V91 N93 D112 N118 K119 V120 L163D69-I116 VanDerWaalsContact OD2-CD1 3.22Å; D69-I116 WeakPolarHBondContact OD2-CD1 3.34Å; V91-I116 HydrophobicContact CB-CG2 3.89Å; V91-I116 HydrophobicContact CG1-CG2 3.89Å; V91-I116 HydrophobicContact CG2-CG2 3.86Å; N93-I116 HydrophobicContact CB-CD1 4.35Å; D112-I116 CarbonylContact O-C 3.55Å; D112-I116 WeakPolarHBondContact O-CA 3.25Å; D112-I116 WeakPolarHBondContact O-CB 3.35Å; D112-I116 PolarHBondContact O-N 3.18Å; I116-N118 PolarHBondContact O-N 2.95Å; I116-K119 PolarHBondContact O-N 2.89Å; I116-V120 HydrophobicContact CG2-CG2 4.22Å; I116-V120 WeakPolarHBondContact O-CB 3.34Å; I116-V120 VanDerWaalsContact O-CG2 3.3Å; I116-V120 WeakPolarHBondContact O-CG2 3.45Å; I116-V120 PolarHBondContact O-N 2.81Å; I116-L163 HydrophobicContact CD1-CD2 4.3Å; I116-L163 HydrophobicContact CG1-CD2 4.5Å
117F92.5Very high92.3Very high75 Ų7550 Ų5033%0.32925%0.254SS..Iπ-helixtrans-56-57.7-173.7178.5-83.5000112.4V71 D112 K119 V120 H121V71-F117 HydrophobicContact CB-CD2 4.28Å; V71-F117 HydrophobicContact CG1-CD2 3.7Å; V71-F117 HydrophobicContact CG1-CE2 3.78Å; V71-F117 HydrophobicContact CG1-CG 4.49Å; V71-F117 HydrophobicContact CG2-CB 4.5Å; V71-F117 HydrophobicContact CG2-CD2 4.04Å; D112-F117 PolarHBondContact O-N 2.84Å; F117-K119 VanDerWaalsContact C-N 3.25Å; F117-K119 PolarHBondContact O-N 3.31Å; F117-V120 PolarHBondContact O-N 3.29Å; F117-H121 AromaticContact CD1-CD2 3.81Å; F117-H121 AromaticContact CE1-CD2 3.51Å; F117-H121 AromaticContact CE1-NE2 3.52Å; F117-H121 AromaticContact CE2-NE2 3.67Å; F117-H121 AromaticContact CZ-CD2 3.66Å; F117-H121 AromaticContact CZ-NE2 3.19Å; F117-H121 WeakPolarHBondContact CZ-NE2 3.34Å; F117-H121 PolarHBondContact O-CD2 2.97Å; F117-H121 VanDerWaalsContact O-CD2 3.28Å; F117-H121 PolarHBondContact O-N 3.18Å; F117-H121 VanDerWaalsContact O-N 3.09Å
118N92.6Very high92.4Very high88 Ų8847.3 Ų47.347%0.47124%0.242SC..Hα-helixtrans-61.1-34.8-178.8-72.5-17.9000112.6K113 I116 H122K113-N118 PolarHBondContact O-N 2.97Å; K113-N118 VanDerWaalsContact O-N 3.16Å; K113-N118 PolarHBondContact O-ND2 3.28Å; K113-N118 PolarHBondContact O-OD1 3.42Å; I116-N118 PolarHBondContact O-N 2.95Å; N118-H122 PolarHBondContact O-N 3.46Å; N118-H122 VanDerWaalsContact O-N 3.14Å
119K92.8Very high92.6Very high38 Ų3846.8 Ų46.817%0.16524%0.241CC..Hα-helixtrans-76.8-41.3-177.5-172.862.6170.1172.50111.9L115 I116 F117 H121 H122 E123 L152 D155L115-K119 VanDerWaalsContact O-CB 3.28Å; L115-K119 WeakPolarHBondContact O-CB 3.33Å; I116-K119 PolarHBondContact O-N 2.89Å; F117-K119 VanDerWaalsContact C-N 3.25Å; F117-K119 PolarHBondContact O-N 3.31Å; K119-H121 VanDerWaalsContact C-N 3.27Å; K119-H121 PolarHBondContact O-N 2.94Å; K119-H122 WeakPolarHBondContact O-CB 3.42Å; K119-H122 PolarHBondContact O-N 2.89Å; K119-E123 HydrophobicContact CD-CG 4.13Å; K119-E123 WeakPolarHBondContact CE-OE1 3.18Å; K119-E123 HydrophobicContact CG-CG 4.29Å; K119-E123 IonicContact NZ-OE1 3.65Å; K119-E123 PolarHBondContact NZ-OE1 3.33Å; K119-E123 PolarHBondContact O-N 3.13Å; K119-L152 HydrophobicContact CB-CD2 3.87Å; K119-L152 HydrophobicContact CG-CD2 3.4Å; K119-D155 VanDerWaalsContact CE-CG 3.45Å; K119-D155 WeakPolarHBondContact CE-OD2 3.3Å; K119-D155 VanDerWaalsContact NZ-CG 3.35Å; K119-D155 IonicContact NZ-OD1 2.76Å; K119-D155 IonicContact NZ-OD2 3.65Å; K119-D155 PolarHBondContact NZ-OD2 2.89Å
120V95Very high92.9Very high0 Ų051 Ų510%027%0.266CS..Hα-helixtrans-54.6-45.2169.1167.80000110.7V71 I89 V91 I116 F117 H122 L124 L148 L152V71-V120 HydrophobicContact CG1-CG1 4.4Å; V71-V120 HydrophobicContact CG2-CB 4.49Å; V71-V120 HydrophobicContact CG2-CG1 4.36Å; I89-V120 HydrophobicContact CD1-CG1 3.69Å; I89-V120 HydrophobicContact CG2-CG1 4.28Å; V91-V120 HydrophobicContact CG2-CG2 4.02Å; I116-V120 HydrophobicContact CG2-CG2 4.22Å; I116-V120 WeakPolarHBondContact O-CB 3.34Å; I116-V120 VanDerWaalsContact O-CG2 3.3Å; I116-V120 WeakPolarHBondContact O-CG2 3.45Å; I116-V120 PolarHBondContact O-N 2.81Å; F117-V120 PolarHBondContact O-N 3.29Å; V120-H122 VanDerWaalsContact C-N 3.3Å; V120-H122 PolarHBondContact O-N 3.45Å; V120-L124 WeakPolarHBondContact O-CB 3.49Å; V120-L124 PolarHBondContact O-N 3.22Å; V120-L124 VanDerWaalsContact O-N 3.08Å; V120-L148 HydrophobicContact CG1-CD2 4.36Å; V120-L152 HydrophobicContact CG2-CD1 3.83Å; V120-L152 HydrophobicContact CG2-CD2 4.33Å
121H93.8Very high93.1Very high40 Ų4048.4 Ų48.419%0.18525%0.25CS..Hα-helixtrans-60.1-37175.1-90.4-87.1000113.1F117 K119 N125F117-H121 AromaticContact CD1-CD2 3.81Å; F117-H121 AromaticContact CE1-CD2 3.51Å; F117-H121 AromaticContact CE1-NE2 3.52Å; F117-H121 AromaticContact CE2-NE2 3.67Å; F117-H121 AromaticContact CZ-CD2 3.66Å; F117-H121 AromaticContact CZ-NE2 3.19Å; F117-H121 WeakPolarHBondContact CZ-NE2 3.34Å; F117-H121 PolarHBondContact O-CD2 2.97Å; F117-H121 VanDerWaalsContact O-CD2 3.28Å; F117-H121 PolarHBondContact O-N 3.18Å; F117-H121 VanDerWaalsContact O-N 3.09Å; K119-H121 VanDerWaalsContact C-N 3.27Å; K119-H121 PolarHBondContact O-N 2.94Å; H121-N125 WeakPolarHBondContact O-CB 3.42Å; H121-N125 PolarHBondContact O-ND2 3.39Å
122H93.3Very high93.2Very high107 Ų10749.7 Ų49.750%0.49526%0.26SS..Hα-helixtrans-73.9-55.3179.2-175.760.6000112.1N118 K119 V120 L124 N125 Q126N118-H122 PolarHBondContact O-N 3.46Å; N118-H122 VanDerWaalsContact O-N 3.14Å; K119-H122 WeakPolarHBondContact O-CB 3.42Å; K119-H122 PolarHBondContact O-N 2.89Å; V120-H122 VanDerWaalsContact C-N 3.3Å; V120-H122 PolarHBondContact O-N 3.45Å; H122-L124 PolarHBondContact O-N 3.17Å; H122-N125 PolarHBondContact O-N 3.46Å; H122-Q126 PolarHBondContact O-N 2.85Å
123E93.7Very high93.3Very high23 Ų2348.4 Ų48.411%0.10725%0.253CS..Hα-helixtrans-62-41.3-176.4-66.8-46.7131.700112.4K119 N125 Q126 F127 L148 T151K119-E123 HydrophobicContact CD-CG 4.13Å; K119-E123 WeakPolarHBondContact CE-OE1 3.18Å; K119-E123 HydrophobicContact CG-CG 4.29Å; K119-E123 IonicContact NZ-OE1 3.65Å; K119-E123 PolarHBondContact NZ-OE1 3.33Å; K119-E123 PolarHBondContact O-N 3.13Å; E123-N125 PolarHBondContact O-N 3.31Å; E123-Q126 PolarHBondContact O-N 3.48Å; E123-F127 WeakPolarHBondContact O-CB 3.44Å; E123-F127 PolarHBondContact O-N 3.37Å; E123-L148 HydrophobicContact CB-CD1 3.73Å; E123-L148 HydrophobicContact CG-CD1 4.42Å; E123-T151 HydrophobicContact CG-CG2 4.05Å
124L93.8Very high93.2Very high2 Ų244.5 Ų44.51%0.0124%0.237CC..Hα-helixtrans-66.1-40.3178.8-164.768.6000111.4V74 C76 F86 I89 V120 H122 F127 C128 I144V74-L124 HydrophobicContact CB-CD2 4.32Å; V74-L124 HydrophobicContact CG1-CD2 3.76Å; C76-L124 VanDerWaalsContact SG-C 3.54Å; C76-L124 PolarHBondContact SG-O 3.42Å; F86-L124 HydrophobicContact CB-CD2 4.39Å; F86-L124 HydrophobicContact CD1-CD2 4.42Å; F86-L124 HydrophobicContact CD2-CD2 3.4Å; F86-L124 VanDerWaalsContact CD2-CD2 3.4Å; F86-L124 HydrophobicContact CD2-CG 4.27Å; F86-L124 HydrophobicContact CE2-CD1 4.27Å; F86-L124 HydrophobicContact CE2-CD2 3.64Å; F86-L124 HydrophobicContact CE2-CG 4.01Å; F86-L124 HydrophobicContact CG-CD2 3.83Å; F86-L124 HydrophobicContact CZ-CD1 4.2Å; F86-L124 HydrophobicContact CZ-CD2 4.24Å; F86-L124 HydrophobicContact CZ-CG 4.44Å; I89-L124 HydrophobicContact CD1-CD2 3.53Å; V120-L124 WeakPolarHBondContact O-CB 3.49Å; V120-L124 PolarHBondContact O-N 3.22Å; V120-L124 VanDerWaalsContact O-N 3.08Å; H122-L124 PolarHBondContact O-N 3.17Å; L124-F127 PolarHBondContact O-N 2.83Å; L124-C128 PolarHBondContact O-N 3.27Å; L124-C128 PolarHBondContact O-SG 3.47Å; L124-I144 HydrophobicContact CD1-CG2 3.63Å
125N92.8Very high93.3Very high55 Ų5545.9 Ų45.929%0.29424%0.235SC..Hα-helixtrans-64.3-39.5174.2-89.1-72.6000112.1P75 C76 G77 H121 H122 E123 C128 S129P75-N125 PolarHBondContact O-ND2 3.26Å; P75-N125 PolarHBondContact O-OD1 3.39Å; C76-N125 WeakPolarHBondContact CA-OD1 3.21Å; G77-N125 PolarHBondContact N-OD1 2.97Å; H121-N125 WeakPolarHBondContact O-CB 3.42Å; H121-N125 PolarHBondContact O-ND2 3.39Å; H122-N125 PolarHBondContact O-N 3.46Å; E123-N125 PolarHBondContact O-N 3.31Å; N125-C128 PolarHBondContact O-N 3.06Å; N125-S129 VanDerWaalsContact O-CB 3.32Å; N125-S129 WeakPolarHBondContact O-CB 3.34Å; N125-S129 PolarHBondContact O-N 2.87Å
126Q93Very high93.3Very high108 Ų10845.5 Ų45.551%0.50523%0.233SC..Hα-helixtrans-60.7-47.4173.5-179.3167.5-38.200111.1H122 E123 S129H122-Q126 PolarHBondContact O-N 2.85Å; E123-Q126 PolarHBondContact O-N 3.48Å; Q126-S129 PolarHBondContact O-N 2.91Å; Q126-S129 PolarHBondContact O-OG 2.91Å
127F93.4Very high93.1Very high29 Ų2948.8 Ų48.813%0.12725%0.246CC..Hα-helixtrans-58.7-50.9175.9-175-90.9000112.4E123 L124 S129 V130 H131 V136 L140 I144E123-F127 WeakPolarHBondContact O-CB 3.44Å; E123-F127 PolarHBondContact O-N 3.37Å; L124-F127 PolarHBondContact O-N 2.83Å; F127-S129 VanDerWaalsContact C-N 3.29Å; F127-S129 PolarHBondContact O-N 3.31Å; F127-V130 PolarHBondContact O-N 3.45Å; F127-H131 AromaticContact CD2-CD2 3.95Å; F127-H131 AromaticContact CE1-CD2 3.73Å; F127-H131 AromaticContact CE2-CD2 3.63Å; F127-H131 AromaticContact CE2-NE2 3.76Å; F127-H131 AromaticContact CZ-CD2 3.51Å; F127-H131 AromaticContact CZ-NE2 3.91Å; F127-H131 PolarHBondContact O-CD2 2.91Å; F127-H131 PolarHBondContact O-N 2.77Å; F127-V136 HydrophobicContact CE1-CG2 4.26Å; F127-L140 HydrophobicContact CZ-CB 4.27Å; F127-L140 HydrophobicContact CZ-CD1 4.49Å; F127-I144 HydrophobicContact CD1-CD1 4.37Å; F127-I144 HydrophobicContact CD1-CG1 4.21Å; F127-I144 HydrophobicContact CE1-CD1 3.86Å; F127-I144 HydrophobicContact CE1-CG1 3.58Å; F127-I144 HydrophobicContact CZ-CG1 3.89Å
128C94.1Very high92.8Very high0 Ų049.1 Ų49.10%025%0.25CS..Hα-helixtrans-61.3-35.5177.8-63.60000112.7C76 G77 T78 S79 L124 N125 V130 H131C76-C128 HydrophobicContact CB-CB 3.88Å; C76-C128 WeakPolarHBondContact CB-SG 3.4Å; C76-C128 WeakPolarHBondContact SG-CB 3.26Å; C76-C128 CovalentContact SG-SG 2.04Å; C76-C128 PolarHBondContact SG-SG 3.32Å; G77-C128 CarbonylContact O-C 3.5Å; G77-C128 VanDerWaalsContact O-CB 3.23Å; G77-C128 WeakPolarHBondContact O-CB 3.27Å; T78-C128 CarbonylContact C-O 3.53Å; T78-C128 VanDerWaalsContact CA-O 3.31Å; T78-C128 WeakPolarHBondContact CA-O 3.39Å; S79-C128 PolarHBondContact N-O 2.91Å; S79-C128 VanDerWaalsContact N-O 3.15Å; L124-C128 PolarHBondContact O-N 3.27Å; L124-C128 PolarHBondContact O-SG 3.47Å; N125-C128 PolarHBondContact O-N 3.06Å; C128-V130 PolarHBondContact O-N 2.87Å; C128-H131 PolarHBondContact O-N 3.38Å
129S94.5Very high92.5Very high69 Ų6947.6 Ų47.648%0.48326%0.255SS..Hα-helixtrans-64-26.5-176.874.20000113.7G77 S79 N125 Q126 F127G77-S129 PolarHBondContact O-N 3.47Å; S79-S129 VanDerWaalsContact CB-O 3.27Å; S79-S129 WeakPolarHBondContact CB-O 3.31Å; N125-S129 VanDerWaalsContact O-CB 3.32Å; N125-S129 WeakPolarHBondContact O-CB 3.34Å; N125-S129 PolarHBondContact O-N 2.87Å; Q126-S129 PolarHBondContact O-N 2.91Å; Q126-S129 PolarHBondContact O-OG 2.91Å; F127-S129 VanDerWaalsContact C-N 3.29Å; F127-S129 PolarHBondContact O-N 3.31Å
130V94.6Very high92.3Very high102 Ų10247.3 Ų47.362%0.61826%0.255SS*.Hα-helixtrans-88-33.3177.2-1780000111.2F127 C128F127-V130 PolarHBondContact O-N 3.45Å; C128-V130 PolarHBondContact O-N 2.87Å
131H94.6Very high92Very high41 Ų4148.5 Ų48.519%0.1926%0.26CS..SBendtrans-98.7146.8-170.7-72.6-60000115.2S79 F127 C128 E135 V136 L140S79-H131 PolarHBondContact N-O 2.81Å; S79-H131 VanDerWaalsContact OG-C 3.23Å; S79-H131 PolarHBondContact OG-O 2.89Å; S79-H131 VanDerWaalsContact OG-O 3.12Å; F127-H131 AromaticContact CD2-CD2 3.95Å; F127-H131 AromaticContact CE1-CD2 3.73Å; F127-H131 AromaticContact CE2-CD2 3.63Å; F127-H131 AromaticContact CE2-NE2 3.76Å; F127-H131 AromaticContact CZ-CD2 3.51Å; F127-H131 AromaticContact CZ-NE2 3.91Å; F127-H131 PolarHBondContact O-CD2 2.91Å; F127-H131 PolarHBondContact O-N 2.77Å; C128-H131 PolarHBondContact O-N 3.38Å; H131-E135 WeakPolarHBondContact CA-OE2 3.44Å; H131-E135 HydrophobicContact CB-CB 4.3Å; H131-E135 IonicContact CE1-OE2 2.65Å; H131-E135 IonicContact CG-OE2 2.89Å; H131-E135 IonicContact ND1-OE2 2.62Å; H131-E135 PolarHBondContact ND1-OE2 2.91Å; H131-V136 HydrophobicContact CB-CG2 3.61Å; H131-L140 WeakPolarHBondContact CE1-CD1 3.33Å; H131-L140 WeakPolarHBondContact ND1-CD1 3.46Å
132S94.7Very high91.7Very high31 Ų3153.1 Ų53.122%0.21729%0.286CS..  trans-75.2159175.7730000112.1S79 Q134 E135 V136S79-S132 PolarHBondContact OG-N 3.31Å; S132-Q134 PolarHBondContact O-N 3.5Å; S132-E135 PolarHBondContact N-OE2 2.99Å; S132-E135 WeakPolarHBondContact O-CB 3.2Å; S132-E135 PolarHBondContact O-N 3.1Å; S132-E135 VanDerWaalsContact O-N 3.11Å; S132-E135 WeakPolarHBondContact OG-CG 3.43Å; S132-E135 PolarHBondContact OG-N 2.66Å; S132-E135 PolarHBondContact OG-OE1 3.4Å; S132-V136 WeakPolarHBondContact O-CG2 3.39Å; S132-V136 PolarHBondContact O-N 2.71Å
133L92.6Very high91.5Very high10 Ų1053.6 Ų53.65%0.05229%0.289CS..Hα-helixtrans-55.9-39.1176.5-179.562.7000112.7T78 V82 I84 Y137 I175 I179 Y183T78-L133 HydrophobicContact CG2-CB 4.31Å; T78-L133 HydrophobicContact CG2-CD1 4.2Å; V82-L133 HydrophobicContact CB-CD2 4.48Å; V82-L133 HydrophobicContact CG1-CD2 4.25Å; I84-L133 HydrophobicContact CG2-CD1 3.47Å; I84-L133 VanDerWaalsContact CG2-CD1 3.47Å; L133-Y137 WeakPolarHBondContact O-CB 3.35Å; L133-Y137 PolarHBondContact O-N 2.98Å; L133-I175 HydrophobicContact CD1-CD1 3.85Å; L133-I175 HydrophobicContact CD1-CG1 4.17Å; L133-I175 HydrophobicContact CD2-CG2 4.28Å; L133-I175 HydrophobicContact CG-CD1 4.37Å; L133-I179 HydrophobicContact CD2-CG2 3.71Å; L133-Y183 HydrophobicContact CD2-CE2 4.21Å
134Q89.7Confident91.5Very high60 Ų6052.6 Ų52.628%0.2828%0.284SS..Hα-helixtrans-62.8-44.1176.8-174.38620.800111.5S132 I138 G139 Y183S132-Q134 PolarHBondContact O-N 3.5Å; Q134-I138 WeakPolarHBondContact O-CB 3.31Å; Q134-I138 PolarHBondContact O-N 3.08Å; Q134-G139 PolarHBondContact O-N 2.78Å; Q134-Y183 HydrophobicContact CB-CE1 4.47Å
135E91.9Very high91.4Very high77 Ų7754.3 Ų54.336%0.3629%0.293SS..Iπ-helixtrans-63.9-52.9177.7-76.9152.3-132.500111.2H131 S132 Y137 G139 L140H131-E135 WeakPolarHBondContact CA-OE2 3.44Å; H131-E135 HydrophobicContact CB-CB 4.3Å; H131-E135 IonicContact CE1-OE2 2.65Å; H131-E135 IonicContact CG-OE2 2.89Å; H131-E135 IonicContact ND1-OE2 2.62Å; H131-E135 PolarHBondContact ND1-OE2 2.91Å; S132-E135 PolarHBondContact N-OE2 2.99Å; S132-E135 WeakPolarHBondContact O-CB 3.2Å; S132-E135 PolarHBondContact O-N 3.1Å; S132-E135 VanDerWaalsContact O-N 3.11Å; S132-E135 WeakPolarHBondContact OG-CG 3.43Å; S132-E135 PolarHBondContact OG-N 2.66Å; S132-E135 PolarHBondContact OG-OE1 3.4Å; E135-Y137 VanDerWaalsContact C-N 3.31Å; E135-Y137 PolarHBondContact O-N 2.64Å; E135-G139 PolarHBondContact O-N 3.38Å; E135-L140 HydrophobicContact CB-CD1 4.06Å; E135-L140 HydrophobicContact CB-CG 4.4Å; E135-L140 HydrophobicContact CG-CD1 4.43Å; E135-L140 PolarHBondContact O-N 2.93Å
136V92.3Very high91.4Very high0 Ų056.5 Ų56.50%030%0.302CS..Iπ-helixtrans-62.2-37-178178.60000112.1I84 F86 F127 H131 S132 I144I84-V136 HydrophobicContact CD1-CG1 3.96Å; F86-V136 HydrophobicContact CZ-CG1 4.01Å; F127-V136 HydrophobicContact CE1-CG2 4.26Å; H131-V136 HydrophobicContact CB-CG2 3.61Å; S132-V136 WeakPolarHBondContact O-CG2 3.39Å; S132-V136 PolarHBondContact O-N 2.71Å; V136-I144 HydrophobicContact CG1-CD1 4.05Å
137Y90.3Very high91.4Very high70 Ų7055 Ų5528%0.27530%0.297SS..Iπ-helixtrans-86.2-27.9-174.9-170.2-112.6000114.7L133 E135 K172 P173 I175L133-Y137 WeakPolarHBondContact O-CB 3.35Å; L133-Y137 PolarHBondContact O-N 2.98Å; E135-Y137 VanDerWaalsContact C-N 3.31Å; E135-Y137 PolarHBondContact O-N 2.64Å; Y137-K172 HydrophobicContact CE2-CD 4.44Å; Y137-P173 HydrophobicContact CD2-CG 4.12Å; Y137-I175 HydrophobicContact CD1-CD1 4.09Å; Y137-I175 HydrophobicContact CD2-CD1 3.54Å; Y137-I175 HydrophobicContact CD2-CG1 4.42Å; Y137-I175 HydrophobicContact CE1-CD1 4.34Å; Y137-I175 HydrophobicContact CE2-CD1 3.81Å; Y137-I175 HydrophobicContact CG-CD1 3.69Å
138I85.9Confident91.4Very high82 Ų8254 Ų5442%0.42129%0.293SS..Iπ-helixtrans-126.9-50.1-172.3-53.8-176.8000112.7Q134Q134-I138 WeakPolarHBondContact O-CB 3.31Å; Q134-I138 PolarHBondContact O-N 3.08Å
139G85.1Confident91.4Very high55 Ų5556.6 Ų56.657%0.56731%0.305SS*.Iπ-helixtrans-85.4-34.3-16600000115.8Q134 E135Q134-G139 PolarHBondContact O-N 2.78Å; E135-G139 PolarHBondContact O-N 3.38Å
140L89.7Confident91.5Very high33 Ų3358.6 Ų58.617%0.17331%0.309CS..SBendtrans-123.83.8-170.7-62.3177.1000113.3F127 H131 E135 D142 Q143 I144F127-L140 HydrophobicContact CZ-CB 4.27Å; F127-L140 HydrophobicContact CZ-CD1 4.49Å; H131-L140 WeakPolarHBondContact CE1-CD1 3.33Å; H131-L140 WeakPolarHBondContact ND1-CD1 3.46Å; E135-L140 HydrophobicContact CB-CD1 4.06Å; E135-L140 HydrophobicContact CB-CG 4.4Å; E135-L140 HydrophobicContact CG-CD1 4.43Å; E135-L140 PolarHBondContact O-N 2.93Å; L140-D142 VanDerWaalsContact C-N 3.3Å; L140-D142 PolarHBondContact O-N 3.45Å; L140-Q143 WeakPolarHBondContact O-CB 3.45Å; L140-Q143 PolarHBondContact O-N 2.84Å; L140-I144 PolarHBondContact O-N 3.39Å
141F88.3Confident91.5Very high25 Ų2555.3 Ų55.311%0.1129%0.29CS..Hα-helixtrans-51.5-47.6-176.7179.9-102.1000112.5Q143 I144 V170 K172F141-Q143 PolarHBondContact O-N 3.31Å; F141-I144 HydrophobicContact CD2-CD1 4.28Å; F141-I144 WeakPolarHBondContact O-CB 3.36Å; F141-I144 WeakPolarHBondContact O-CG1 3.46Å; F141-I144 PolarHBondContact O-N 2.9Å; F141-I144 VanDerWaalsContact O-N 3.11Å; F141-V170 HydrophobicContact CE2-CG1 4.33Å; F141-V170 WeakPolarHBondContact CZ-O 3.44Å; F141-K172 HydrophobicContact CD1-CG 4.45Å; F141-K172 HydrophobicContact CD2-CG 4.3Å; F141-K172 HydrophobicContact CE1-CG 3.96Å; F141-K172 HydrophobicContact CE2-CB 4.35Å; F141-K172 HydrophobicContact CE2-CG 3.81Å; F141-K172 HydrophobicContact CZ-CB 4.42Å; F141-K172 HydrophobicContact CZ-CG 3.62Å
142D87.1Confident91.4Very high137 Ų13753.5 Ų53.573%0.73328%0.281SS*.Hα-helixtrans-66.4-17.5-179.4-52.6-29.7000113.4L140L140-D142 VanDerWaalsContact C-N 3.3Å; L140-D142 PolarHBondContact O-N 3.45Å
143Q90.4Very high91.5Very high116 Ų11654.2 Ų54.254%0.54228%0.281SS..Hα-helixtrans-87.2-17.1177.5-57.3-175.519.400112.6L140 F141 N147L140-Q143 WeakPolarHBondContact O-CB 3.45Å; L140-Q143 PolarHBondContact O-N 2.84Å; F141-Q143 PolarHBondContact O-N 3.31Å; Q143-N147 WeakPolarHBondContact O-CB 3.3Å; Q143-N147 PolarHBondContact O-N 3.43Å
144I92.2Very high91.6Very high3 Ų360.8 Ų60.82%0.01531%0.311CS..Hα-helixtrans-64.1-44.7-179.7-55.3178.8000110F86 L124 F127 V136 L140 F141 N147 L148 V170F86-I144 HydrophobicContact CZ-CD1 4.49Å; L124-I144 HydrophobicContact CD1-CG2 3.63Å; F127-I144 HydrophobicContact CD1-CD1 4.37Å; F127-I144 HydrophobicContact CD1-CG1 4.21Å; F127-I144 HydrophobicContact CE1-CD1 3.86Å; F127-I144 HydrophobicContact CE1-CG1 3.58Å; F127-I144 HydrophobicContact CZ-CG1 3.89Å; V136-I144 HydrophobicContact CG1-CD1 4.05Å; L140-I144 PolarHBondContact O-N 3.39Å; F141-I144 HydrophobicContact CD2-CD1 4.28Å; F141-I144 WeakPolarHBondContact O-CB 3.36Å; F141-I144 WeakPolarHBondContact O-CG1 3.46Å; F141-I144 PolarHBondContact O-N 2.9Å; F141-I144 VanDerWaalsContact O-N 3.11Å; I144-N147 PolarHBondContact O-N 2.82Å; I144-L148 WeakPolarHBondContact O-CB 3.37Å; I144-L148 PolarHBondContact O-N 3.21Å; I144-V170 HydrophobicContact CG2-CG2 4.03Å
145D92.9Very high91.7Very high37 Ų3760 Ų6020%0.19831%0.309CS..Hα-helixtrans-57.9-51.7-178.9-78.2-3.2000112.2K149 V170D145-K149 VanDerWaalsContact O-CB 3.22Å; D145-K149 WeakPolarHBondContact O-CB 3.24Å; D145-K149 PolarHBondContact O-N 3.32Å; D145-V170 WeakPolarHBondContact OD1-CB 3.34Å; D145-V170 VanDerWaalsContact OD1-CG2 3.28Å; D145-V170 WeakPolarHBondContact OD1-CG2 3.35Å; D145-V170 PolarHBondContact OD1-N 2.72Å
146E92Very high91.8Very high101 Ų10156.4 Ų56.447%0.47229%0.292SS..Hα-helixtrans-73-38.6-179-72.3-63.6156.400112.5K149 L150E146-K149 PolarHBondContact O-N 3.17Å; E146-K149 IonicContact OE1-NZ 3.64Å; E146-K149 PolarHBondContact OE1-NZ 3.11Å; E146-K149 IonicContact OE2-NZ 2.72Å; E146-K149 PolarHBondContact OE2-NZ 3.41Å; E146-L150 WeakPolarHBondContact O-CB 3.33Å; E146-L150 VanDerWaalsContact O-CG 3.24Å; E146-L150 WeakPolarHBondContact O-CG 3.48Å; E146-L150 PolarHBondContact O-N 3.26Å
147N92.8Very high91.9Very high77 Ų7760.7 Ų60.741%0.41232%0.319SS..Hα-helixtrans-64.8-47.9177.7-165.914.2000111Q143 I144 K149 L150 T151Q143-N147 WeakPolarHBondContact O-CB 3.3Å; Q143-N147 PolarHBondContact O-N 3.43Å; I144-N147 PolarHBondContact O-N 2.82Å; N147-K149 VanDerWaalsContact C-N 3.34Å; N147-K149 PolarHBondContact O-N 2.96Å; N147-L150 PolarHBondContact O-N 3.42Å; N147-T151 PolarHBondContact O-N 2.7Å; N147-T151 PolarHBondContact O-OG1 3.37Å
148L94.1Very high92Very high9 Ų961.7 Ų61.75%0.04734%0.336CS..Hα-helixtrans-61.4-41.6177.8-176.457.2000111.6I89 V120 E123 I144 L152 V168 V170I89-L148 HydrophobicContact CG2-CD2 4.46Å; V120-L148 HydrophobicContact CG1-CD2 4.36Å; E123-L148 HydrophobicContact CB-CD1 3.73Å; E123-L148 HydrophobicContact CG-CD1 4.42Å; I144-L148 WeakPolarHBondContact O-CB 3.37Å; I144-L148 PolarHBondContact O-N 3.21Å; L148-L152 HydrophobicContact CD1-CD1 3.81Å; L148-L152 HydrophobicContact CD1-CG 3.94Å; L148-L152 HydrophobicContact CG-CD1 3.81Å; L148-L152 HydrophobicContact CG-CG 4.38Å; L148-L152 VanDerWaalsContact O-CB 3.24Å; L148-L152 WeakPolarHBondContact O-CB 3.43Å; L148-L152 WeakPolarHBondContact O-CD1 3.32Å; L148-L152 WeakPolarHBondContact O-CG 3.29Å; L148-L152 PolarHBondContact O-N 2.89Å; L148-V168 HydrophobicContact CD2-CG1 3.86Å; L148-V168 HydrophobicContact CG-CG1 4.22Å; L148-V170 HydrophobicContact CD2-CG2 4.14Å
149K94.7Very high92.2Very high54 Ų5461.6 Ų61.624%0.23534%0.335CS..Hα-helixtrans-59.7-46.2173.2172.3-176.5158.4-150.60112.6D145 E146 N147 Q153 I165 V168D145-K149 VanDerWaalsContact O-CB 3.22Å; D145-K149 WeakPolarHBondContact O-CB 3.24Å; D145-K149 PolarHBondContact O-N 3.32Å; E146-K149 PolarHBondContact O-N 3.17Å; E146-K149 IonicContact OE1-NZ 3.64Å; E146-K149 PolarHBondContact OE1-NZ 3.11Å; E146-K149 IonicContact OE2-NZ 2.72Å; E146-K149 PolarHBondContact OE2-NZ 3.41Å; N147-K149 VanDerWaalsContact C-N 3.34Å; N147-K149 PolarHBondContact O-N 2.96Å; K149-Q153 VanDerWaalsContact O-CB 3.31Å; K149-Q153 WeakPolarHBondContact O-CB 3.47Å; K149-Q153 PolarHBondContact O-N 2.81Å; K149-I165 HydrophobicContact CG-CG2 4.3Å; K149-V168 HydrophobicContact CB-CB 4.26Å; K149-V168 HydrophobicContact CB-CG2 3.83Å
150L95Very high92.5Very high111 Ų11159 Ų5958%0.58131%0.308SS*.Hα-helixtrans-64.9-51.8-179.1-73.4169.5000111.5E146 N147 L152 Q153 E154E146-L150 WeakPolarHBondContact O-CB 3.33Å; E146-L150 VanDerWaalsContact O-CG 3.24Å; E146-L150 WeakPolarHBondContact O-CG 3.48Å; E146-L150 PolarHBondContact O-N 3.26Å; N147-L150 PolarHBondContact O-N 3.42Å; L150-L152 PolarHBondContact O-N 3.44Å; L150-Q153 PolarHBondContact O-N 3.03Å; L150-E154 PolarHBondContact O-N 2.71Å
151T94.6Very high92.7Very high33 Ų3361.9 Ų61.920%0.20233%0.329CS..Hα-helixtrans-62.1-45.5-180-54.20000111.8E123 N147 Q153 E154 D155E123-T151 HydrophobicContact CG-CG2 4.05Å; N147-T151 PolarHBondContact O-N 2.7Å; N147-T151 PolarHBondContact O-OG1 3.37Å; T151-Q153 VanDerWaalsContact C-N 3.32Å; T151-Q153 PolarHBondContact O-N 2.91Å; T151-E154 PolarHBondContact O-N 2.72Å; T151-D155 WeakPolarHBondContact O-CB 3.47Å; T151-D155 PolarHBondContact O-N 2.87Å
152L94.4Very high92.8Very high2 Ų261.4 Ų61.41%0.0133%0.331CS..Hα-helixtrans-60.3-41.6176.1-69.6170.2000111.8K119 V120 L148 L150 L156 I165 V168K119-L152 HydrophobicContact CB-CD2 3.87Å; K119-L152 HydrophobicContact CG-CD2 3.4Å; V120-L152 HydrophobicContact CG2-CD1 3.83Å; V120-L152 HydrophobicContact CG2-CD2 4.33Å; L148-L152 HydrophobicContact CD1-CD1 3.81Å; L148-L152 HydrophobicContact CD1-CG 3.94Å; L148-L152 HydrophobicContact CG-CD1 3.81Å; L148-L152 HydrophobicContact CG-CG 4.38Å; L148-L152 VanDerWaalsContact O-CB 3.24Å; L148-L152 WeakPolarHBondContact O-CB 3.43Å; L148-L152 WeakPolarHBondContact O-CD1 3.32Å; L148-L152 WeakPolarHBondContact O-CG 3.29Å; L148-L152 PolarHBondContact O-N 2.89Å; L150-L152 PolarHBondContact O-N 3.44Å; L152-L156 WeakPolarHBondContact O-CB 3.36Å; L152-L156 WeakPolarHBondContact O-CG 3.37Å; L152-L156 PolarHBondContact O-N 3.18Å; L152-I165 HydrophobicContact CB-CD1 3.32Å; L152-I165 HydrophobicContact CD1-CD1 3.95Å; L152-I165 HydrophobicContact CG-CD1 4.23Å; L152-V168 HydrophobicContact CD1-CG2 4.31Å
153Q94.9Very high93.2Very high46 Ų4655 Ų5522%0.21530%0.296CS..Hα-helixtrans-69.2-38.1179.4-174.258.266.100112.4K149 L150 T151 T157K149-Q153 VanDerWaalsContact O-CB 3.31Å; K149-Q153 WeakPolarHBondContact O-CB 3.47Å; K149-Q153 PolarHBondContact O-N 2.81Å; L150-Q153 PolarHBondContact O-N 3.03Å; T151-Q153 VanDerWaalsContact C-N 3.32Å; T151-Q153 PolarHBondContact O-N 2.91Å; Q153-T157 PolarHBondContact NE2-OG1 2.64Å; Q153-T157 WeakPolarHBondContact O-CB 3.28Å; Q153-T157 PolarHBondContact O-N 3.24Å; Q153-T157 PolarHBondContact O-OG1 3.05Å
154E95Very high93.4Very high148 Ų14851.7 Ų51.769%0.69228%0.282SS*.Hα-helixtrans-59.9-50.7174.5-177.2171.1-168.300110.8L150 T151 T157 S158L150-E154 PolarHBondContact O-N 2.71Å; T151-E154 PolarHBondContact O-N 2.72Å; E154-T157 WeakPolarHBondContact O-CB 3.47Å; E154-T157 PolarHBondContact O-N 2.95Å; E154-S158 PolarHBondContact O-N 3.33Å
155D93.1Very high93.5Very high43 Ų4352 Ų5223%0.2328%0.284CS..Hα-helixtrans-61.4-46.4178.2-86.7-57.7000112.8K119 T151 T157 S158 M159K119-D155 VanDerWaalsContact CE-CG 3.45Å; K119-D155 WeakPolarHBondContact CE-OD2 3.3Å; K119-D155 VanDerWaalsContact NZ-CG 3.35Å; K119-D155 IonicContact NZ-OD1 2.76Å; K119-D155 IonicContact NZ-OD2 3.65Å; K119-D155 PolarHBondContact NZ-OD2 2.89Å; T151-D155 WeakPolarHBondContact O-CB 3.47Å; T151-D155 PolarHBondContact O-N 2.87Å; D155-T157 VanDerWaalsContact C-N 3.29Å; D155-T157 PolarHBondContact O-N 3.02Å; D155-S158 PolarHBondContact O-N 3.05Å; D155-S158 VanDerWaalsContact O-N 3.11Å; D155-S158 PolarHBondContact O-OG 3.48Å; D155-M159 HydrophobicContact CB-CE 3.75Å; D155-M159 PolarHBondContact O-N 2.92Å
156L93.5Very high93.6Very high2 Ų255.5 Ų55.51%0.0130%0.299CS..Hα-helixtrans-63.6-33.2176.7-72.4179.6000112.8L115 L152 S158 M159 A160 L163 I165L115-L156 HydrophobicContact CB-CD2 3.97Å; L115-L156 HydrophobicContact CD1-CD2 4.31Å; L115-L156 HydrophobicContact CD2-CD2 4.21Å; L115-L156 HydrophobicContact CG-CD2 4.4Å; L152-L156 WeakPolarHBondContact O-CB 3.36Å; L152-L156 WeakPolarHBondContact O-CG 3.37Å; L152-L156 PolarHBondContact O-N 3.18Å; L156-S158 PolarHBondContact O-N 3.27Å; L156-M159 PolarHBondContact O-N 3.14Å; L156-A160 HydrophobicContact CD2-CB 4.3Å; L156-A160 CarbonylContact O-C 3.53Å; L156-A160 WeakPolarHBondContact O-CA 3.39Å; L156-A160 PolarHBondContact O-N 2.95Å; L156-L163 HydrophobicContact CD1-CD2 4Å; L156-L163 HydrophobicContact CD1-CG 4.09Å; L156-L163 HydrophobicContact CD2-CD2 3.97Å; L156-I165 HydrophobicContact CD1-CD1 3.58Å; L156-I165 HydrophobicContact CD1-CG1 3.84Å
157T93.8Very high93.7Very high90 Ų9052.6 Ų52.655%0.55229%0.292SS*.Hα-helixtrans-62.6-29.9175.7-56.50000111.5Q153 E154 D155Q153-T157 PolarHBondContact NE2-OG1 2.64Å; Q153-T157 WeakPolarHBondContact O-CB 3.28Å; Q153-T157 PolarHBondContact O-N 3.24Å; Q153-T157 PolarHBondContact O-OG1 3.05Å; E154-T157 WeakPolarHBondContact O-CB 3.47Å; E154-T157 PolarHBondContact O-N 2.95Å; D155-T157 VanDerWaalsContact C-N 3.29Å; D155-T157 PolarHBondContact O-N 3.02Å
158S92.4Very high93.9Very high91 Ų9149.4 Ų49.464%0.63628%0.276SS*.Hα-helixtrans-85.8-39.4175.778.90000114E154 D155 L156E154-S158 PolarHBondContact O-N 3.33Å; D155-S158 PolarHBondContact O-N 3.05Å; D155-S158 VanDerWaalsContact O-N 3.11Å; D155-S158 PolarHBondContact O-OG 3.48Å; L156-S158 PolarHBondContact O-N 3.27Å
159M90.6Very high93.9Very high80 Ų8056.4 Ų56.439%0.39430%0.301SS..Hα-helixtrans-92.4-37.5-171.6-72-172.5-77.500114.5F107 D155 L156F107-M159 WeakPolarHBondContact CE2-O 3.41Å; F107-M159 HydrophobicContact CZ-CB 4.32Å; D155-M159 HydrophobicContact CB-CE 3.75Å; D155-M159 PolarHBondContact O-N 2.92Å; L156-M159 PolarHBondContact O-N 3.14Å
160A92Very high93.9Very high2 Ų254.1 Ų54.12%0.01729%0.292CS..SBendtrans-142.864.6-167.300000111I103 F107 L115 L156 G162 L163I103-A160 HydrophobicContact CD1-CB 4.07Å; I103-A160 HydrophobicContact CG1-CB 4.36Å; F107-A160 HydrophobicContact CE2-CB 4.11Å; L115-A160 HydrophobicContact CD1-CB 3.64Å; L115-A160 HydrophobicContact CD2-CB 4.39Å; L156-A160 HydrophobicContact CD2-CB 4.3Å; L156-A160 CarbonylContact O-C 3.53Å; L156-A160 WeakPolarHBondContact O-CA 3.39Å; L156-A160 PolarHBondContact O-N 2.95Å; A160-G162 PolarHBondContact O-N 3.46Å; A160-G162 VanDerWaalsContact O-N 3.09Å; A160-L163 PolarHBondContact O-N 2.88Å; A160-L163 VanDerWaalsContact O-N 3.14Å
161P92.8Very high93.8Very high93 Ų9351 Ų5160%0.60428%0.278SS*.THydrogen-bonded Turntrans-59.7117-176.625.4-34.9000110.9A99A99-P161 WeakPolarHBondContact CB-O 3.28Å
162G91.1Very high93.7Very high15 Ų1554.8 Ų54.816%0.15529%0.291CS..THydrogen-bonded Turntrans116.3-8.4-177.600000115.1L95 I96 A160L95-G162 WeakPolarHBondContact CD1-O 3.37Å; I96-G162 WeakPolarHBondContact CG1-O 3.4Å; I96-G162 PolarHBondContact N-O 3.11Å; A160-G162 PolarHBondContact O-N 3.46Å; A160-G162 VanDerWaalsContact O-N 3.09Å
163L94.5Very high93.6Very high1 Ų155 Ų551%0.00529%0.292CS..EExtended strand (participates in β ladder)trans-89.6123.2161.2-173.461.2000109N93 L95 I103 Y111 L115 I116 L156 A160N93-L163 HydrophobicContact CB-CD1 4.35Å; N93-L163 WeakPolarHBondContact OD1-CD1 3.37Å; L95-L163 HydrophobicContact CB-CD1 4.26Å; I103-L163 HydrophobicContact CD1-CB 3.96Å; Y111-L163 HydrophobicContact CD2-CD2 4.02Å; Y111-L163 HydrophobicContact CE2-CD1 3.87Å; Y111-L163 HydrophobicContact CE2-CD2 3.88Å; L115-L163 HydrophobicContact CB-CD2 4.47Å; L115-L163 HydrophobicContact CD1-CD2 4.04Å; I116-L163 HydrophobicContact CD1-CD2 4.3Å; I116-L163 HydrophobicContact CG1-CD2 4.5Å; L156-L163 HydrophobicContact CD1-CD2 4Å; L156-L163 HydrophobicContact CD1-CG 4.09Å; L156-L163 HydrophobicContact CD2-CD2 3.97Å; A160-L163 PolarHBondContact O-N 2.88Å; A160-L163 VanDerWaalsContact O-N 3.14Å
164I94.5Very high93.5Very high48 Ų4856.5 Ų56.525%0.24630%0.302CS..EExtended strand (participates in β ladder)trans-124.2129.5-174.8-64.9170.9000109.9N93 Y94 I96N93-I164 CarbonylContact C-O 3.6Å; N93-I164 WeakPolarHBondContact CA-O 3.39Å; N93-I164 WeakPolarHBondContact CB-O 3.45Å; Y94-I164 HydrophobicContact CD1-CB 4.14Å; Y94-I164 HydrophobicContact CD1-CG2 4.32Å; Y94-I164 HydrophobicContact CE1-CB 3.68Å; Y94-I164 HydrophobicContact CE1-CD1 4.33Å; Y94-I164 HydrophobicContact CE1-CG2 3.61Å; Y94-I164 HydrophobicContact CE2-CD1 4.33Å; Y94-I164 PolarHBondContact N-O 3.06Å; Y94-I164 PolarHBondContact O-N 3.28Å; Y94-I164 WeakPolarHBondContact OH-CD1 3.47Å; I96-I164 HydrophobicContact CD1-CD1 3.9Å; I96-I164 HydrophobicContact CG1-CD1 4.31Å
165I95.6Very high93.4Very high10 Ų1049.9 Ų49.95%0.05127%0.272CS..EExtended strand (participates in β ladder)trans-91.6119.3174.1-65.1172.3000108.8V91 N93 K149 L152 L156 V168V91-I165 HydrophobicContact CG1-CD1 4.22Å; V91-I165 HydrophobicContact CG1-CG1 4.18Å; V91-I165 HydrophobicContact CG1-CG2 4.21Å; N93-I165 HydrophobicContact CB-CG1 4.47Å; K149-I165 HydrophobicContact CG-CG2 4.3Å; L152-I165 HydrophobicContact CB-CD1 3.32Å; L152-I165 HydrophobicContact CD1-CD1 3.95Å; L152-I165 HydrophobicContact CG-CD1 4.23Å; L156-I165 HydrophobicContact CD1-CD1 3.58Å; L156-I165 HydrophobicContact CD1-CG1 3.84Å; I165-V168 HydrophobicContact CG2-CG2 3.8Å
166Q94.2Very high93.4Very high109 Ų10950.7 Ų50.751%0.50928%0.279SS..EExtended strand (participates in β ladder)trans-81.7-45.6177.9-173.164.13400111.1V92V92-Q166 HydrophobicContact CB-CB 4.41Å; V92-Q166 HydrophobicContact CG1-CB 4.03Å; V92-Q166 PolarHBondContact O-N 3.2Å
167A95.1Very high93.3Very high40 Ų4055.2 Ų55.233%0.33130%0.3SS..EExtended strand (participates in β ladder)trans-157.3153-17800000110.8V92V92-A167 HydrophobicContact CB-CB 4.34Å; V92-A167 HydrophobicContact CG2-CB 4.48Å; V92-A167 PolarHBondContact N-O 2.84Å; V92-A167 PolarHBondContact O-N 3.44Å
168V95.7Very high93.1Very high11 Ų1154.6 Ų54.67%0.06730%0.299CS..EExtended strand (participates in β ladder)trans-122.4141.6167.8-178.30000107.4I89 E90 V91 L148 K149 L152 I165 V170I89-V168 HydrophobicContact CG2-CG1 4.04Å; E90-V168 WeakPolarHBondContact O-CA 3.47Å; V91-V168 HydrophobicContact CG1-CG2 4.35Å; V91-V168 HydrophobicContact CG2-CG1 4.26Å; V91-V168 HydrophobicContact CG2-CG2 4.34Å; L148-V168 HydrophobicContact CD2-CG1 3.86Å; L148-V168 HydrophobicContact CG-CG1 4.22Å; K149-V168 HydrophobicContact CB-CB 4.26Å; K149-V168 HydrophobicContact CB-CG2 3.83Å; L152-V168 HydrophobicContact CD1-CG2 4.31Å; I165-V168 HydrophobicContact CG2-CG2 3.8Å; V168-V170 HydrophobicContact CG1-CG2 4.38Å
169R94.8Very high93Very high155 Ų15552.6 Ų52.659%0.58528%0.281SS*.EExtended strand (participates in β ladder)trans-132.6118.9172.6176.7-172.2-69.4152.5-5.3109.9I89 E90I89-R169 WeakPolarHBondContact CA-O 3.28Å; E90-R169 HydrophobicContact CB-CB 4.38Å; E90-R169 PolarHBondContact N-O 3.44Å; E90-R169 PolarHBondContact O-N 3.23Å; E90-R169 IonicContact OE2-NH1 3.26Å; E90-R169 PolarHBondContact OE2-NH1 2.82Å
170V94.3Very high93Very high6 Ų652.5 Ų52.54%0.03628%0.276CS..EExtended strand (participates in β ladder)trans-97.6135.9174.9178.50000108.9F86 I89 F141 I144 D145 L148 V168F86-V170 HydrophobicContact CD1-CG1 3.3Å; F86-V170 HydrophobicContact CE1-CG1 3.45Å; F86-V170 VanDerWaalsContact CE1-CG1 3.45Å; F86-V170 HydrophobicContact CG-CG1 4.37Å; I89-V170 HydrophobicContact CD1-CG2 4.37Å; I89-V170 HydrophobicContact CG1-CG1 4.25Å; I89-V170 HydrophobicContact CG1-CG2 4.18Å; I89-V170 HydrophobicContact CG2-CG2 3.96Å; F141-V170 HydrophobicContact CE2-CG1 4.33Å; F141-V170 WeakPolarHBondContact CZ-O 3.44Å; I144-V170 HydrophobicContact CG2-CG2 4.03Å; D145-V170 WeakPolarHBondContact OD1-CB 3.34Å; D145-V170 VanDerWaalsContact OD1-CG2 3.28Å; D145-V170 WeakPolarHBondContact OD1-CG2 3.35Å; D145-V170 PolarHBondContact OD1-N 2.72Å; L148-V170 HydrophobicContact CD2-CG2 4.14Å; V168-V170 HydrophobicContact CG1-CG2 4.38Å
171T92.9Very high93Very high46 Ų4659 Ų5928%0.28230%0.3SS..PPolyproline II helixtrans-84.6157169.556.30000110.7F86 R88F86-T171 VanDerWaalsContact CD1-O 3.31Å; F86-T171 WeakPolarHBondContact CD1-O 3.43Å; R88-T171 HydrophobicContact CB-CG2 4.03Å; R88-T171 PolarHBondContact N-OG1 3.03Å; R88-T171 VanDerWaalsContact N-OG1 3.07Å; R88-T171 WeakPolarHBondContact O-CB 3.31Å; R88-T171 PolarHBondContact O-N 2.92Å; R88-T171 PolarHBondContact O-OG1 2.99Å
172K92.3Very high92.9Very high113 Ų11359.2 Ų59.249%0.49130%0.297SS..PPolyproline II helixtrans-59.8136.2178.3-74.1-160.7172.3-154.20111.1Y137 F141Y137-K172 HydrophobicContact CE2-CD 4.44Å; F141-K172 HydrophobicContact CD1-CG 4.45Å; F141-K172 HydrophobicContact CD2-CG 4.3Å; F141-K172 HydrophobicContact CE1-CG 3.96Å; F141-K172 HydrophobicContact CE2-CB 4.35Å; F141-K172 HydrophobicContact CE2-CG 3.81Å; F141-K172 HydrophobicContact CZ-CB 4.42Å; F141-K172 HydrophobicContact CZ-CG 3.62Å
173P92.6Very high92.8Very high5 Ų561.1 Ų61.13%0.03230%0.299CS..PPolyproline II helixtrans-70.2141.8-178.627.7-32.6000111.2I84 Y85 F86 Y137I84-P173 HydrophobicContact CB-CB 4.23Å; I84-P173 HydrophobicContact CD1-CB 3.91Å; I84-P173 HydrophobicContact CD1-CG 4.05Å; I84-P173 HydrophobicContact CG1-CB 4.34Å; Y85-P173 CarbonylContact O-C 3.53Å; Y85-P173 VanDerWaalsContact O-CA 3.31Å; Y85-P173 WeakPolarHBondContact O-CA 3.41Å; F86-P173 HydrophobicContact CD1-CB 3.88Å; F86-P173 HydrophobicContact CD1-CG 4.38Å; F86-P173 HydrophobicContact CD2-CB 4.17Å; F86-P173 HydrophobicContact CE1-CB 3.76Å; F86-P173 HydrophobicContact CE1-CG 3.82Å; F86-P173 HydrophobicContact CE2-CB 4.04Å; F86-P173 HydrophobicContact CG-CB 4.11Å; F86-P173 HydrophobicContact CZ-CB 3.85Å; F86-P173 HydrophobicContact CZ-CG 3.93Å; Y137-P173 HydrophobicContact CD2-CG 4.12Å
174N92.8Very high92.5Very high78 Ų7866.4 Ų66.442%0.41732%0.324SS..BIsolated β-bridgetrans-77.9127.5173.7-162.6-19.5000109.8Y85Y85-N174 PolarHBondContact N-O 3.43Å; Y85-N174 PolarHBondContact O-N 3.39Å
175I93.3Very high92.5Very high10 Ų1069.3 Ų69.35%0.05134%0.339CS..  trans-115.5136.4-175.3-58175000108.6I84 L133 Y137 E177 I179I84-I175 HydrophobicContact CG2-CG1 4.15Å; L133-I175 HydrophobicContact CD1-CD1 3.85Å; L133-I175 HydrophobicContact CD1-CG1 4.17Å; L133-I175 HydrophobicContact CD2-CG2 4.28Å; L133-I175 HydrophobicContact CG-CD1 4.37Å; Y137-I175 HydrophobicContact CD1-CD1 4.09Å; Y137-I175 HydrophobicContact CD2-CD1 3.54Å; Y137-I175 HydrophobicContact CD2-CG1 4.42Å; Y137-I175 HydrophobicContact CE1-CD1 4.34Å; Y137-I175 HydrophobicContact CE2-CD1 3.81Å; Y137-I175 HydrophobicContact CG-CD1 3.69Å; I175-E177 PolarHBondContact O-N 3.04Å; I175-I179 HydrophobicContact CG2-CB 3.94Å; I175-I179 HydrophobicContact CG2-CG2 4.04Å
176P92.1Very high92.2Very high59 Ų5972.7 Ų72.738%0.38336%0.356SS..  trans-50.3137.3174.5-28.635.5000113.5S178 I179 R180P176-S178 PolarHBondContact O-N 3.32Å; P176-S178 VanDerWaalsContact O-N 3.1Å; P176-I179 PolarHBondContact O-N 3.33Å; P176-R180 PolarHBondContact O-N 3.47Å; P176-R180 VanDerWaalsContact O-N 3.07Å
177E91.1Very high91.9Very high97 Ų9770.1 Ų70.145%0.45334%0.344SS..Hα-helixtrans-56.5-34.2-171.2-60.9-137.8136.100114.5I175 I179 R180 R181I175-E177 PolarHBondContact O-N 3.04Å; E177-I179 VanDerWaalsContact C-N 3.3Å; E177-I179 PolarHBondContact O-N 3.07Å; E177-R180 PolarHBondContact O-N 3.19Å; E177-R180 IonicContact OE1-CZ 3.19Å; E177-R180 IonicContact OE1-NH1 2.61Å; E177-R180 IonicContact OE1-NH2 2.82Å; E177-R180 PolarHBondContact OE1-NH2 3.1Å; E177-R181 WeakPolarHBondContact O-CG 3.48Å; E177-R181 PolarHBondContact O-N 3.07Å; E177-R181 IonicContact OE2-CZ 2.63Å; E177-R181 IonicContact OE2-NE 3.77Å; E177-R181 IonicContact OE2-NH2 2.73Å; E177-R181 PolarHBondContact OE2-NH2 2.9Å
178S89.8Confident91.9Very high77 Ų7770.4 Ų70.454%0.53834%0.344SS..Hα-helixtrans-60-40.7179.349.40000112.1P176 N182P176-S178 PolarHBondContact O-N 3.32Å; P176-S178 VanDerWaalsContact O-N 3.1Å; S178-N182 PolarHBondContact O-ND2 3.23Å
179I90.4Very high91.8Very high49 Ų4974.8 Ų74.825%0.25136%0.363SS..Hα-helixtrans-78.3-41.7176.9-55.4-57.4000110.1L133 I175 P176 E177 R181 N182 Y183L133-I179 HydrophobicContact CD2-CG2 3.71Å; I175-I179 HydrophobicContact CG2-CB 3.94Å; I175-I179 HydrophobicContact CG2-CG2 4.04Å; P176-I179 PolarHBondContact O-N 3.33Å; E177-I179 VanDerWaalsContact C-N 3.3Å; E177-I179 PolarHBondContact O-N 3.07Å; I179-R181 VanDerWaalsContact C-N 3.35Å; I179-R181 PolarHBondContact O-N 3.39Å; I179-N182 WeakPolarHBondContact O-CB 3.47Å; I179-N182 PolarHBondContact O-N 2.86Å; I179-Y183 HydrophobicContact CG2-CD2 3.71Å; I179-Y183 HydrophobicContact CG2-CE2 3.55Å; I179-Y183 WeakPolarHBondContact O-CD2 3.28Å; I179-Y183 PolarHBondContact O-N 2.74Å; I179-Y183 VanDerWaalsContact O-N 3.07Å
180R90.6Very high91.7Very high79 Ų7972 Ų7230%0.29836%0.356SS..Hα-helixtrans-54.9-46.8-179.5-164.7176.869.7-129.71.9112.4P176 E177 N182 Y183 E184P176-R180 PolarHBondContact O-N 3.47Å; P176-R180 VanDerWaalsContact O-N 3.07Å; E177-R180 PolarHBondContact O-N 3.19Å; E177-R180 IonicContact OE1-CZ 3.19Å; E177-R180 IonicContact OE1-NH1 2.61Å; E177-R180 IonicContact OE1-NH2 2.82Å; E177-R180 PolarHBondContact OE1-NH2 3.1Å; R180-N182 VanDerWaalsContact C-N 3.33Å; R180-N182 PolarHBondContact O-N 2.76Å; R180-Y183 PolarHBondContact O-N 2.63Å; R180-E184 WeakPolarHBondContact CG-OE1 3.41Å; R180-E184 IonicContact NE-OE1 3.58Å; R180-E184 WeakPolarHBondContact O-CG 3.45Å; R180-E184 PolarHBondContact O-N 2.8Å
181R91.9Very high91.7Very high137 Ų13775.2 Ų75.252%0.51738%0.375SS..Hα-helixtrans-61.7-37.4177.1-66.2173.4-158.8171.25.7112.8E177 I179 E184 L185E177-R181 WeakPolarHBondContact O-CG 3.48Å; E177-R181 PolarHBondContact O-N 3.07Å; E177-R181 IonicContact OE2-CZ 2.63Å; E177-R181 IonicContact OE2-NE 3.77Å; E177-R181 IonicContact OE2-NH2 2.73Å; E177-R181 PolarHBondContact OE2-NH2 2.9Å; I179-R181 VanDerWaalsContact C-N 3.35Å; I179-R181 PolarHBondContact O-N 3.39Å; R181-E184 PolarHBondContact O-N 3.25Å; R181-L185 VanDerWaalsContact O-CG 3.31Å; R181-L185 WeakPolarHBondContact O-CG 3.28Å; R181-L185 PolarHBondContact O-N 3.06Å
182N90.5Very high91.8Very high99 Ų9978.2 Ų78.253%0.52938%0.384SS..Hα-helixtrans-67.1-37.6177.1-68-18.2000111.7S178 I179 R180 M186S178-N182 PolarHBondContact O-ND2 3.23Å; I179-N182 WeakPolarHBondContact O-CB 3.47Å; I179-N182 PolarHBondContact O-N 2.86Å; R180-N182 VanDerWaalsContact C-N 3.33Å; R180-N182 PolarHBondContact O-N 2.76Å; N182-M186 VanDerWaalsContact O-CB 3.31Å; N182-M186 WeakPolarHBondContact O-CB 3.46Å; N182-M186 PolarHBondContact O-N 2.89Å
183Y89Confident92Very high54 Ų5477.5 Ų77.521%0.21239%0.385CS..Hα-helixtrans-69-42.9175.5-86.6-116.7000112L133 Q134 I179 R180 L185 M186 E187L133-Y183 HydrophobicContact CD2-CE2 4.21Å; Q134-Y183 HydrophobicContact CB-CE1 4.47Å; I179-Y183 HydrophobicContact CG2-CD2 3.71Å; I179-Y183 HydrophobicContact CG2-CE2 3.55Å; I179-Y183 WeakPolarHBondContact O-CD2 3.28Å; I179-Y183 PolarHBondContact O-N 2.74Å; I179-Y183 VanDerWaalsContact O-N 3.07Å; R180-Y183 PolarHBondContact O-N 2.63Å; Y183-L185 VanDerWaalsContact C-N 3.33Å; Y183-L185 PolarHBondContact O-N 2.91Å; Y183-M186 HydrophobicContact CD1-CE 4.34Å; Y183-M186 PolarHBondContact O-N 2.82Å; Y183-E187 PolarHBondContact O-N 2.7Å
184E89.9Confident92.1Very high113 Ų11381.6 Ų81.653%0.52841%0.406SS..Hα-helixtrans-57.4-45.7173.9-71.5163.8-175.100111.3R180 R181 S188R180-E184 WeakPolarHBondContact CG-OE1 3.41Å; R180-E184 IonicContact NE-OE1 3.58Å; R180-E184 WeakPolarHBondContact O-CG 3.45Å; R180-E184 PolarHBondContact O-N 2.8Å; R181-E184 PolarHBondContact O-N 3.25Å; E184-S188 WeakPolarHBondContact O-CB 3.33Å; E184-S188 PolarHBondContact O-N 3.32Å; E184-S188 VanDerWaalsContact O-N 3.11Å
185L92.9Very high92.3Very high108 Ų10882.5 Ų82.557%0.56541%0.41SS*.Hα-helixtrans-62.9-48.3174.2-71.6171.5000111.9R181 Y183 S188 E189R181-L185 VanDerWaalsContact O-CG 3.31Å; R181-L185 WeakPolarHBondContact O-CG 3.28Å; R181-L185 PolarHBondContact O-N 3.06Å; Y183-L185 VanDerWaalsContact C-N 3.33Å; Y183-L185 PolarHBondContact O-N 2.91Å; L185-S188 WeakPolarHBondContact O-CB 3.34Å; L185-S188 PolarHBondContact O-N 3.04Å; L185-S188 VanDerWaalsContact O-N 3.14Å; L185-S188 PolarHBondContact O-OG 3.26Å; L185-E189 PolarHBondContact O-N 2.79Å
186M89.6Confident92.5Very high82 Ų8284 Ų8440%0.40442%0.422SS..Hα-helixtrans-61.1-46-178.6-177.7-172.768.900112.8N182 Y183 S188 E189 K190N182-M186 VanDerWaalsContact O-CB 3.31Å; N182-M186 WeakPolarHBondContact O-CB 3.46Å; N182-M186 PolarHBondContact O-N 2.89Å; Y183-M186 HydrophobicContact CD1-CE 4.34Å; Y183-M186 PolarHBondContact O-N 2.82Å; M186-S188 VanDerWaalsContact C-N 3.27Å; M186-S188 PolarHBondContact O-N 2.99Å; M186-E189 PolarHBondContact O-N 3.36Å; M186-K190 VanDerWaalsContact O-CB 3.28Å; M186-K190 WeakPolarHBondContact O-CB 3.37Å; M186-K190 PolarHBondContact O-N 3.42Å
187E89.6Confident92.7Very high55 Ų5585.1 Ų85.126%0.25742%0.422SS..Hα-helixtrans-67.5-30.1176.5-71.7-63.7140.600111.3Y183 K190 T191Y183-E187 PolarHBondContact O-N 2.7Å; E187-K190 IonicContact OE1-NZ 2.64Å; E187-K190 PolarHBondContact OE1-NZ 3.07Å; E187-K190 WeakPolarHBondContact OE2-CD 3.36Å; E187-K190 IonicContact OE2-NZ 2.64Å; E187-K190 PolarHBondContact OE2-NZ 3.16Å; E187-T191 VanDerWaalsContact O-CB 3.28Å; E187-T191 WeakPolarHBondContact O-CB 3.31Å; E187-T191 PolarHBondContact O-N 2.94Å; E187-T191 PolarHBondContact O-OG1 2.81Å
188S93.5Very high92.9Very high45 Ų4586 Ų8632%0.31543%0.426SS..Hα-helixtrans-65.5-43.3171.287.80000112.5E184 L185 M186 T191 K192E184-S188 WeakPolarHBondContact O-CB 3.33Å; E184-S188 PolarHBondContact O-N 3.32Å; E184-S188 VanDerWaalsContact O-N 3.11Å; L185-S188 WeakPolarHBondContact O-CB 3.34Å; L185-S188 PolarHBondContact O-N 3.04Å; L185-S188 VanDerWaalsContact O-N 3.14Å; L185-S188 PolarHBondContact O-OG 3.26Å; M186-S188 VanDerWaalsContact C-N 3.27Å; M186-S188 PolarHBondContact O-N 2.99Å; S188-T191 PolarHBondContact O-N 3.03Å; S188-K192 WeakPolarHBondContact O-CG 3.42Å; S188-K192 PolarHBondContact O-N 3.11Å
189E94.7Very high93.2Very high103 Ų10385.9 Ų85.948%0.48142%0.422SS..Hα-helixtrans-69.6-40.5177.5-68.3-53.5141.100112.2L185 M186 T191 K192 L193L185-E189 PolarHBondContact O-N 2.79Å; M186-E189 PolarHBondContact O-N 3.36Å; E189-T191 VanDerWaalsContact C-N 3.31Å; E189-T191 PolarHBondContact O-N 3.48Å; E189-K192 WeakPolarHBondContact O-CB 3.21Å; E189-K192 PolarHBondContact O-N 3.06Å; E189-K192 IonicContact OE1-NZ 2.62Å; E189-K192 PolarHBondContact OE1-NZ 2.61Å; E189-K192 WeakPolarHBondContact OE2-CD 3.39Å; E189-K192 IonicContact OE2-NZ 3.92Å; E189-L193 WeakPolarHBondContact O-CB 3.49Å; E189-L193 PolarHBondContact O-N 2.75Å
190K92.8Very high93.4Very high98 Ų9889.1 Ų89.143%0.42644%0.436SS..Hα-helixtrans-60.5-40.6172.6-178.4-179.7166-151.20111.6M186 E187 L193 L194M186-K190 VanDerWaalsContact O-CB 3.28Å; M186-K190 WeakPolarHBondContact O-CB 3.37Å; M186-K190 PolarHBondContact O-N 3.42Å; E187-K190 IonicContact OE1-NZ 2.64Å; E187-K190 PolarHBondContact OE1-NZ 3.07Å; E187-K190 WeakPolarHBondContact OE2-CD 3.36Å; E187-K190 IonicContact OE2-NZ 2.64Å; E187-K190 PolarHBondContact OE2-NZ 3.16Å; K190-L193 PolarHBondContact O-N 2.88Å; K190-L194 WeakPolarHBondContact O-CG 3.24Å; K190-L194 PolarHBondContact O-N 2.82Å
191T93.1Very high93.7Very high72 Ų7290.8 Ų90.844%0.44245%0.445SS..Hα-helixtrans-65.2-44.8173.9-58.90000111.4E187 S188 E189 L193 L194 I195E187-T191 VanDerWaalsContact O-CB 3.28Å; E187-T191 WeakPolarHBondContact O-CB 3.31Å; E187-T191 PolarHBondContact O-N 2.94Å; E187-T191 PolarHBondContact O-OG1 2.81Å; S188-T191 PolarHBondContact O-N 3.03Å; E189-T191 VanDerWaalsContact C-N 3.31Å; E189-T191 PolarHBondContact O-N 3.48Å; T191-L193 VanDerWaalsContact C-N 3.33Å; T191-L193 PolarHBondContact O-N 3.15Å; T191-L194 PolarHBondContact O-N 3.35Å; T191-I195 HydrophobicContact CG2-CD1 3.92Å; T191-I195 HydrophobicContact CG2-CG1 4.5Å; T191-I195 VanDerWaalsContact O-CG1 3.29Å; T191-I195 WeakPolarHBondContact O-CG1 3.5Å; T191-I195 PolarHBondContact O-N 3.03Å
192K95.9Very high93.9Very high110 Ų11087.8 Ų87.848%0.47844%0.442SS..Hα-helixtrans-58.5-42.7173.5-70.8168.9-169171.90112.1S188 E189 I195 S196S188-K192 WeakPolarHBondContact O-CG 3.42Å; S188-K192 PolarHBondContact O-N 3.11Å; E189-K192 WeakPolarHBondContact O-CB 3.21Å; E189-K192 PolarHBondContact O-N 3.06Å; E189-K192 IonicContact OE1-NZ 2.62Å; E189-K192 PolarHBondContact OE1-NZ 2.61Å; E189-K192 WeakPolarHBondContact OE2-CD 3.39Å; E189-K192 IonicContact OE2-NZ 3.92Å; K192-I195 PolarHBondContact O-N 2.74Å; K192-S196 WeakPolarHBondContact O-CB 3.03Å; K192-S196 PolarHBondContact O-N 2.97Å
193L96.5Very high94.2Very high97 Ų9787.4 Ų87.451%0.50844%0.443SS..Hα-helixtrans-61.9-48.6177.2-179.862.6000111.1E189 K190 T191 I195 S196 Q197E189-L193 WeakPolarHBondContact O-CB 3.49Å; E189-L193 PolarHBondContact O-N 2.75Å; K190-L193 PolarHBondContact O-N 2.88Å; T191-L193 VanDerWaalsContact C-N 3.33Å; T191-L193 PolarHBondContact O-N 3.15Å; L193-I195 VanDerWaalsContact C-N 3.35Å; L193-I195 PolarHBondContact O-N 3.17Å; L193-S196 PolarHBondContact O-N 3.11Å; L193-S196 VanDerWaalsContact O-N 3.17Å; L193-S196 PolarHBondContact O-OG 2.87Å; L193-Q197 WeakPolarHBondContact O-CG 3.39Å; L193-Q197 PolarHBondContact O-N 3.19Å
194L94.9Very high94.5Very high91 Ų9191 Ų9148%0.47646%0.462SS..Hα-helixtrans-60.3-43176.7-71.4170.4000111.9K190 T191 Q197 Q198K190-L194 WeakPolarHBondContact O-CG 3.24Å; K190-L194 PolarHBondContact O-N 2.82Å; T191-L194 PolarHBondContact O-N 3.35Å; L194-Q197 PolarHBondContact O-N 3.38Å; L194-Q198 WeakPolarHBondContact O-CG 3.46Å; L194-Q198 PolarHBondContact O-N 3.44Å
195I96.9Very high94.7Very high98 Ų9891.4 Ų91.450%0.50346%0.462SS..Hα-helixtrans-59.4-49173.4-69.1166.4000110T191 K192 L193 Q197 Q198 T199T191-I195 HydrophobicContact CG2-CD1 3.92Å; T191-I195 HydrophobicContact CG2-CG1 4.5Å; T191-I195 VanDerWaalsContact O-CG1 3.29Å; T191-I195 WeakPolarHBondContact O-CG1 3.5Å; T191-I195 PolarHBondContact O-N 3.03Å; K192-I195 PolarHBondContact O-N 2.74Å; L193-I195 VanDerWaalsContact C-N 3.35Å; L193-I195 PolarHBondContact O-N 3.17Å; I195-Q197 VanDerWaalsContact C-N 3.31Å; I195-Q197 PolarHBondContact O-N 2.88Å; I195-Q198 PolarHBondContact O-N 2.93Å; I195-Q198 VanDerWaalsContact O-N 3.11Å; I195-T199 HydrophobicContact CG2-CG2 4.19Å; I195-T199 WeakPolarHBondContact O-CG2 3.31Å; I195-T199 PolarHBondContact O-N 3.25Å; I195-T199 PolarHBondContact O-OG1 3.03Å
196S96.6Very high94.7Very high41 Ų4191.5 Ų91.529%0.28746%0.459SS..Hα-helixtrans-58.5-42-17975.80000112.3K192 L193 T199 Q200K192-S196 WeakPolarHBondContact O-CB 3.03Å; K192-S196 PolarHBondContact O-N 2.97Å; L193-S196 PolarHBondContact O-N 3.11Å; L193-S196 VanDerWaalsContact O-N 3.17Å; L193-S196 PolarHBondContact O-OG 2.87Å; S196-T199 WeakPolarHBondContact CA-OG1 3.36Å; S196-T199 PolarHBondContact O-N 3.42Å; S196-T199 PolarHBondContact O-OG1 3.15Å; S196-Q200 WeakPolarHBondContact O-CB 3.36Å; S196-Q200 VanDerWaalsContact O-CG 3.28Å; S196-Q200 WeakPolarHBondContact O-CG 3.45Å; S196-Q200 PolarHBondContact O-N 2.84Å
197Q96.7Very high95Very high83 Ų8389.4 Ų89.439%0.38846%0.455SS..Hα-helixtrans-65.7-39176.4-71.9177.3-6.600112.4L193 L194 I195 K201L193-Q197 WeakPolarHBondContact O-CG 3.39Å; L193-Q197 PolarHBondContact O-N 3.19Å; L194-Q197 PolarHBondContact O-N 3.38Å; I195-Q197 VanDerWaalsContact C-N 3.31Å; I195-Q197 PolarHBondContact O-N 2.88Å; Q197-K201 WeakPolarHBondContact O-CG 3.48Å; Q197-K201 PolarHBondContact O-N 3.32Å
198Q95.4Very high95.2Very high115 Ų11590.9 Ų90.954%0.53746%0.462SS..Hα-helixtrans-70.7-40.4175.3-64.5-65.1-2.700111.3L194 I195 Q200 K201 V202L194-Q198 WeakPolarHBondContact O-CG 3.46Å; L194-Q198 PolarHBondContact O-N 3.44Å; I195-Q198 PolarHBondContact O-N 2.93Å; I195-Q198 VanDerWaalsContact O-N 3.11Å; Q198-Q200 VanDerWaalsContact C-N 3.33Å; Q198-Q200 PolarHBondContact O-N 3.38Å; Q198-K201 PolarHBondContact O-N 3.22Å; Q198-V202 WeakPolarHBondContact O-CG2 3.38Å; Q198-V202 PolarHBondContact O-N 2.04Å
199T95.5Very high95.1Very high75 Ų7592.9 Ų92.946%0.4647%0.473SS..Hα-helixtrans-64.2-36.9175.254.60000112.3I195 S196 V202 V203I195-T199 HydrophobicContact CG2-CG2 4.19Å; I195-T199 WeakPolarHBondContact O-CG2 3.31Å; I195-T199 PolarHBondContact O-N 3.25Å; I195-T199 PolarHBondContact O-OG1 3.03Å; S196-T199 WeakPolarHBondContact CA-OG1 3.36Å; S196-T199 PolarHBondContact O-N 3.42Å; S196-T199 PolarHBondContact O-OG1 3.15Å; T199-V202 PolarHBondContact O-N 3.1Å; T199-V203 WeakPolarHBondContact O-CG2 3.19Å; T199-V203 PolarHBondContact O-N 3.49Å
200Q94.4Very high95.1Very high117 Ų11794.6 Ų94.655%0.54748%0.481SS..Hα-helixtrans-60.6-47.5173-77.1168.6-100111.1S196 Q198 V202 V203 E204S196-Q200 WeakPolarHBondContact O-CB 3.36Å; S196-Q200 VanDerWaalsContact O-CG 3.28Å; S196-Q200 WeakPolarHBondContact O-CG 3.45Å; S196-Q200 PolarHBondContact O-N 2.84Å; Q198-Q200 VanDerWaalsContact C-N 3.33Å; Q198-Q200 PolarHBondContact O-N 3.38Å; Q200-V202 VanDerWaalsContact C-N 3.33Å; Q200-V202 PolarHBondContact O-N 3.12Å; Q200-V203 PolarHBondContact O-N 3.28Å; Q200-E204 WeakPolarHBondContact O-CG 3.28Å; Q200-E204 PolarHBondContact O-N 2.93Å
201K96.6Very high95.2Very high113 Ų11399 Ų9949%0.49150%0.495SS..Hα-helixtrans-61.8-37.3175.7-71.3173.4-177.8177.90113.2Q197 Q198 K205Q197-K201 WeakPolarHBondContact O-CG 3.48Å; Q197-K201 PolarHBondContact O-N 3.32Å; Q198-K201 PolarHBondContact O-N 3.22Å; K201-K205 WeakPolarHBondContact O-CB 3.31Å; K201-K205 VanDerWaalsContact O-CG 3.28Å; K201-K205 WeakPolarHBondContact O-CG 2.98Å; K201-K205 PolarHBondContact O-N 3.21Å
202V96.8Very high95.2Very high75 Ų7599.9 Ų99.946%0.45550%0.495SS..Hα-helixtrans-64.2-50.3174.4170.20000110Q198 T199 Q200 E204 K205 E206Q198-V202 WeakPolarHBondContact O-CG2 3.38Å; Q198-V202 PolarHBondContact O-N 2.04Å; T199-V202 PolarHBondContact O-N 3.1Å; Q200-V202 VanDerWaalsContact C-N 3.33Å; Q200-V202 PolarHBondContact O-N 3.12Å; V202-E204 VanDerWaalsContact C-N 3.34Å; V202-E204 PolarHBondContact O-N 3.32Å; V202-K205 CarbonylContact O-C 3.56Å; V202-K205 PolarHBondContact O-N 2.89Å; V202-K205 VanDerWaalsContact O-N 3.1Å; V202-E206 HydrophobicContact CG1-CG 4.18Å; V202-E206 WeakPolarHBondContact O-CB 3.44Å; V202-E206 WeakPolarHBondContact O-CG 3.47Å; V202-E206 PolarHBondContact O-N 3.21Å
203V96.4Very high95.1Very high90 Ų90101.1 Ų101.155%0.54550%0.501SS..Hα-helixtrans-61.2-39.9178.3171.20000112.1T199 Q200 K205 E206 A207T199-V203 WeakPolarHBondContact O-CG2 3.19Å; T199-V203 PolarHBondContact O-N 3.49Å; Q200-V203 PolarHBondContact O-N 3.28Å; V203-K205 PolarHBondContact O-N 3.13Å; V203-E206 PolarHBondContact O-N 2.82Å; V203-A207 WeakPolarHBondContact O-CB 3.44Å; V203-A207 PolarHBondContact O-N 3.02Å
204E94.8Very high95Very high130 Ų13099.2 Ų99.261%0.60750%0.499SS*.Hα-helixtrans-60.3-44173.3-75.7174.8177.200111.9Q200 V202 E208Q200-E204 WeakPolarHBondContact O-CG 3.28Å; Q200-E204 PolarHBondContact O-N 2.93Å; V202-E204 VanDerWaalsContact C-N 3.34Å; V202-E204 PolarHBondContact O-N 3.32Å; E204-E208 WeakPolarHBondContact O-CB 3.31Å; E204-E208 PolarHBondContact O-N 2.88Å
205K94.8Very high95Very high121 Ų12198.8 Ų98.853%0.52650%0.5SS..Hα-helixtrans-74.1-32.2179.2-72.2-73.2157.9-160.90113K201 V202 V203 E208 T209K201-K205 WeakPolarHBondContact O-CB 3.31Å; K201-K205 VanDerWaalsContact O-CG 3.28Å; K201-K205 WeakPolarHBondContact O-CG 2.98Å; K201-K205 PolarHBondContact O-N 3.21Å; V202-K205 CarbonylContact O-C 3.56Å; V202-K205 PolarHBondContact O-N 2.89Å; V202-K205 VanDerWaalsContact O-N 3.1Å; V203-K205 PolarHBondContact O-N 3.13Å; K205-E208 WeakPolarHBondContact CD-OE2 3.42Å; K205-E208 WeakPolarHBondContact CE-OE2 3.4Å; K205-E208 IonicContact NZ-OE1 2.8Å; K205-E208 IonicContact NZ-OE2 2.7Å; K205-E208 PolarHBondContact NZ-OE2 3.03Å; K205-T209 VanDerWaalsContact O-CB 3.24Å; K205-T209 WeakPolarHBondContact O-CB 3.28Å; K205-T209 PolarHBondContact O-N 3.33Å; K205-T209 PolarHBondContact O-OG1 3.23Å
206E93.1Very high94.9Very high110 Ų11098.7 Ų98.751%0.51450%0.5SS..Hα-helixtrans-66.5-47.2171.5-75.2175.7162.300110.2V202 V203 E208 T209 E210V202-E206 HydrophobicContact CG1-CG 4.18Å; V202-E206 WeakPolarHBondContact O-CB 3.44Å; V202-E206 WeakPolarHBondContact O-CG 3.47Å; V202-E206 PolarHBondContact O-N 3.21Å; V203-E206 PolarHBondContact O-N 2.82Å; E206-E208 VanDerWaalsContact C-N 3.35Å; E206-E208 PolarHBondContact O-N 2.91Å; E206-T209 CarbonylContact O-C 3.55Å; E206-T209 WeakPolarHBondContact O-CA 3.23Å; E206-T209 WeakPolarHBondContact O-CB 3.45Å; E206-T209 PolarHBondContact O-N 2.9Å; E206-T209 VanDerWaalsContact O-N 3.08Å; E206-E210 WeakPolarHBondContact O-CG 3.06Å; E206-E210 PolarHBondContact O-N 3.49Å
207A95.4Very high94.8Very high38 Ų38102.4 Ų102.431%0.31451%0.512SS..Hα-helixtrans-63.2-36.817600000113.1V203 R211V203-A207 WeakPolarHBondContact O-CB 3.44Å; V203-A207 PolarHBondContact O-N 3.02Å; A207-R211 VanDerWaalsContact O-CG 3.3Å; A207-R211 WeakPolarHBondContact O-CG 3.27Å; A207-R211 PolarHBondContact O-N 2.81Å; A207-R211 VanDerWaalsContact O-N 3.13Å
208E93.9Very high94.6Very high87 Ų87101.4 Ų101.441%0.40752%0.519SS..Hα-helixtrans-64.2-43.3170.6-172.2177.9-166.700111.3E204 K205 E206 R211 I212E204-E208 WeakPolarHBondContact O-CB 3.31Å; E204-E208 PolarHBondContact O-N 2.88Å; K205-E208 WeakPolarHBondContact CD-OE2 3.42Å; K205-E208 WeakPolarHBondContact CE-OE2 3.4Å; K205-E208 IonicContact NZ-OE1 2.8Å; K205-E208 IonicContact NZ-OE2 2.7Å; K205-E208 PolarHBondContact NZ-OE2 3.03Å; E206-E208 VanDerWaalsContact C-N 3.35Å; E206-E208 PolarHBondContact O-N 2.91Å; E208-R211 PolarHBondContact O-N 2.78Å; E208-I212 HydrophobicContact CG-CD1 4.12Å; E208-I212 WeakPolarHBondContact O-CG1 3.44Å; E208-I212 PolarHBondContact O-N 3.06Å
209T91.8Very high94.5Very high87 Ų87101.1 Ų101.153%0.53452%0.517SS..Hα-helixtrans-64.1-40.9177.6-60.80000111.9K205 E206 I212 K213K205-T209 VanDerWaalsContact O-CB 3.24Å; K205-T209 WeakPolarHBondContact O-CB 3.28Å; K205-T209 PolarHBondContact O-N 3.33Å; K205-T209 PolarHBondContact O-OG1 3.23Å; E206-T209 CarbonylContact O-C 3.55Å; E206-T209 WeakPolarHBondContact O-CA 3.23Å; E206-T209 WeakPolarHBondContact O-CB 3.45Å; E206-T209 PolarHBondContact O-N 2.9Å; E206-T209 VanDerWaalsContact O-N 3.08Å; T209-I212 PolarHBondContact O-N 2.82Å; T209-K213 WeakPolarHBondContact O-CB 3.41Å; T209-K213 PolarHBondContact O-N 3.39Å
210E94.9Very high94.6Very high139 Ų139104.1 Ų104.165%0.6552%0.524SS*.Hα-helixtrans-64.1-42175.2-75.6-170.3156.800111.9E206 K213 A214E206-E210 WeakPolarHBondContact O-CG 3.06Å; E206-E210 PolarHBondContact O-N 3.49Å; E210-K213 PolarHBondContact O-N 3.3Å; E210-A214 WeakPolarHBondContact O-CB 3.19Å; E210-A214 PolarHBondContact O-N 3.25Å
211R94.2Very high94.6Very high191 Ų191103.1 Ų103.172%0.72153%0.525SS*.Hα-helixtrans-61-48.5174-72.7170.8-176.1176.53.5111.5A207 E208 K213 A214 V215A207-R211 VanDerWaalsContact O-CG 3.3Å; A207-R211 WeakPolarHBondContact O-CG 3.27Å; A207-R211 PolarHBondContact O-N 2.81Å; A207-R211 VanDerWaalsContact O-N 3.13Å; E208-R211 PolarHBondContact O-N 2.78Å; R211-K213 VanDerWaalsContact C-N 3.33Å; R211-K213 PolarHBondContact O-N 2.62Å; R211-A214 PolarHBondContact O-N 2.95Å; R211-V215 WeakPolarHBondContact O-CG2 2.99Å; R211-V215 PolarHBondContact O-N 3.26Å
212I92.9Very high94.5Very high89 Ų89100.6 Ų100.646%0.45653%0.526SS..Hα-helixtrans-61.5-43.9177.5-68.5167.5000110.3E208 T209 A214 V215 I216E208-I212 HydrophobicContact CG-CD1 4.12Å; E208-I212 WeakPolarHBondContact O-CG1 3.44Å; E208-I212 PolarHBondContact O-N 3.06Å; T209-I212 PolarHBondContact O-N 2.82Å; I212-A214 PolarHBondContact O-N 2.93Å; I212-V215 PolarHBondContact O-N 3.1Å; I212-I216 HydrophobicContact CG2-CD1 3.66Å; I212-I216 HydrophobicContact CG2-CG1 4.35Å; I212-I216 VanDerWaalsContact O-CG1 3.31Å; I212-I216 WeakPolarHBondContact O-CG1 3.48Å; I212-I216 PolarHBondContact O-N 2.89Å
213K94.8Very high94.3Very high136 Ų136102.5 Ų102.559%0.59153%0.53SS*.Hα-helixtrans-60.8-42.6177-176.5-176.8175.6-170.10112.2T209 E210 R211 I216 E217T209-K213 WeakPolarHBondContact O-CB 3.41Å; T209-K213 PolarHBondContact O-N 3.39Å; E210-K213 PolarHBondContact O-N 3.3Å; R211-K213 VanDerWaalsContact C-N 3.33Å; R211-K213 PolarHBondContact O-N 2.62Å; K213-I216 PolarHBondContact O-N 3.34Å; K213-E217 VanDerWaalsContact O-CB 3.3Å; K213-E217 WeakPolarHBondContact O-CB 3.42Å; K213-E217 PolarHBondContact O-N 2.82Å
214A94.3Very high94.2Very high57 Ų57101.3 Ų101.347%0.47152%0.523SS..Hα-helixtrans-64.8-38.7176.900000112.4E210 R211 I212 E217 A218E210-A214 WeakPolarHBondContact O-CB 3.19Å; E210-A214 PolarHBondContact O-N 3.25Å; R211-A214 PolarHBondContact O-N 2.95Å; I212-A214 PolarHBondContact O-N 2.93Å; A214-E217 PolarHBondContact O-N 3.48Å; A214-A218 WeakPolarHBondContact O-CB 3.33Å; A214-A218 PolarHBondContact O-N 2.72Å
215V95.5Very high94.2Very high82 Ų8297.8 Ų97.850%0.49752%0.515SS..Hα-helixtrans-64.6-49.3173.2173.70000110.8R211 I212 E217 A218 E219R211-V215 WeakPolarHBondContact O-CG2 2.99Å; R211-V215 PolarHBondContact O-N 3.26Å; I212-V215 PolarHBondContact O-N 3.1Å; V215-E217 VanDerWaalsContact C-N 3.27Å; V215-E217 PolarHBondContact O-N 3.21Å; V215-A218 PolarHBondContact O-N 3.34Å; V215-E219 HydrophobicContact CG1-CG 4.43Å; V215-E219 WeakPolarHBondContact O-CG 3.19Å; V215-E219 PolarHBondContact O-N 3.35Å
216I93.8Very high94.2Very high97 Ų9799 Ų9950%0.49752%0.523SS..Hα-helixtrans-59.6-37.9177.1-68.9169.7000111.3I212 K213 K220I212-I216 HydrophobicContact CG2-CD1 3.66Å; I212-I216 HydrophobicContact CG2-CG1 4.35Å; I212-I216 VanDerWaalsContact O-CG1 3.31Å; I212-I216 WeakPolarHBondContact O-CG1 3.48Å; I212-I216 PolarHBondContact O-N 2.89Å; K213-I216 PolarHBondContact O-N 3.34Å; I216-K220 WeakPolarHBondContact O-CB 3.19Å; I216-K220 PolarHBondContact O-N 3.28Å
217E94.2Very high94.2Very high118 Ų11898.7 Ų98.755%0.55152%0.524SS*.Hα-helixtrans-68.9-41.3177-174.5157.8-157.100112K213 A214 V215 K220 V221K213-E217 VanDerWaalsContact O-CB 3.3Å; K213-E217 WeakPolarHBondContact O-CB 3.42Å; K213-E217 PolarHBondContact O-N 2.82Å; A214-E217 PolarHBondContact O-N 3.48Å; V215-E217 VanDerWaalsContact C-N 3.27Å; V215-E217 PolarHBondContact O-N 3.21Å; E217-K220 PolarHBondContact O-N 3.34Å; E217-V221 WeakPolarHBondContact O-CG2 3.29Å; E217-V221 PolarHBondContact O-N 3.28Å
218A93.6Very high94.1Very high63 Ų63103 Ų10352%0.52154%0.535SS..Hα-helixtrans-63.4-45.5173.400000112.3A214 V215 V221 A222A214-A218 WeakPolarHBondContact O-CB 3.33Å; A214-A218 PolarHBondContact O-N 2.72Å; V215-A218 PolarHBondContact O-N 3.34Å; A218-V221 PolarHBondContact O-N 3.14Å; A218-A222 PolarHBondContact O-N 3.42Å
219E93.9Very high94.1Very high109 Ų109105.7 Ų105.751%0.50955%0.546SS..Hα-helixtrans-60.9-44174.8-73.8-178.5173.300111.8V215 V221 A222 Q223V215-E219 HydrophobicContact CG1-CG 4.43Å; V215-E219 WeakPolarHBondContact O-CG 3.19Å; V215-E219 PolarHBondContact O-N 3.35Å; E219-V221 VanDerWaalsContact C-N 3.35Å; E219-V221 PolarHBondContact O-N 3.46Å; E219-A222 WeakPolarHBondContact O-CB 3.36Å; E219-A222 PolarHBondContact O-N 3.09Å; E219-Q223 WeakPolarHBondContact O-CG 3.11Å; E219-Q223 PolarHBondContact O-N 3.02Å
220K95.8Very high94.2Very high138 Ų138103.3 Ų103.360%0.654%0.539SS*.Hα-helixtrans-60.1-43.5175.4178.4-174.7175.4-172.20111.6I216 E217 V224I216-K220 WeakPolarHBondContact O-CB 3.19Å; I216-K220 PolarHBondContact O-N 3.28Å; E217-K220 PolarHBondContact O-N 3.34Å; K220-V224 WeakPolarHBondContact O-CB 3.46Å; K220-V224 VanDerWaalsContact O-CG2 3.26Å; K220-V224 WeakPolarHBondContact O-CG2 3.48Å; K220-V224 PolarHBondContact O-N 3.5Å
221V95.1Very high94Very high95 Ų95101.6 Ų101.658%0.57653%0.531SS*.Hα-helixtrans-64.6-40.8176.3170.20000110.8E217 A218 E219 V224 A225E217-V221 WeakPolarHBondContact O-CG2 3.29Å; E217-V221 PolarHBondContact O-N 3.28Å; A218-V221 PolarHBondContact O-N 3.14Å; E219-V221 VanDerWaalsContact C-N 3.35Å; E219-V221 PolarHBondContact O-N 3.46Å; V221-V224 PolarHBondContact O-N 3.16Å; V221-A225 WeakPolarHBondContact O-CB 3.22Å; V221-A225 PolarHBondContact O-N 3.27Å
222A94.3Very high94Very high60 Ų6098.9 Ų98.950%0.49652%0.524SS..Hα-helixtrans-62-48.2175.800000112.2A218 E219 V224 A225 E226A218-A222 PolarHBondContact O-N 3.42Å; E219-A222 WeakPolarHBondContact O-CB 3.36Å; E219-A222 PolarHBondContact O-N 3.09Å; A222-V224 PolarHBondContact O-N 2.88Å; A222-A225 WeakPolarHBondContact O-CB 3.32Å; A222-A225 PolarHBondContact O-N 3.4Å; A222-A225 VanDerWaalsContact O-N 3.17Å; A222-E226 PolarHBondContact O-N 3.39Å
223Q93.3Very high94Very high116 Ų11697 Ų9754%0.54252%0.517SS..Hα-helixtrans-61.7-41.8176.3-69.8175.723.100112.2E219 A225 E226 I227E219-Q223 WeakPolarHBondContact O-CG 3.11Å; E219-Q223 PolarHBondContact O-N 3.02Å; Q223-A225 VanDerWaalsContact C-N 3.32Å; Q223-A225 PolarHBondContact O-N 3.08Å; Q223-E226 PolarHBondContact O-N 2.88Å; Q223-I227 WeakPolarHBondContact O-CG1 3.25Å; Q223-I227 PolarHBondContact O-N 3.4Å
224V94.4Very high93.9Very high65 Ų6596.4 Ų96.439%0.39452%0.517SS..Hα-helixtrans-65.8-35.5175.7169.80000111.5K220 V221 A222 K228K220-V224 WeakPolarHBondContact O-CB 3.46Å; K220-V224 VanDerWaalsContact O-CG2 3.26Å; K220-V224 WeakPolarHBondContact O-CG2 3.48Å; K220-V224 PolarHBondContact O-N 3.5Å; V221-V224 PolarHBondContact O-N 3.16Å; A222-V224 PolarHBondContact O-N 2.88Å; V224-K228 HydrophobicContact CG1-CD 4.32Å; V224-K228 WeakPolarHBondContact O-CB 3.5Å; V224-K228 WeakPolarHBondContact O-CG 3.34Å; V224-K228 PolarHBondContact O-N 3.37Å
225A93.6Very high93.9Very high55 Ų5599 Ų9946%0.45552%0.52SS..Hα-helixtrans-67.3-41.4174.100000111.8V221 A222 Q223 K228 F229V221-A225 WeakPolarHBondContact O-CB 3.22Å; V221-A225 PolarHBondContact O-N 3.27Å; A222-A225 WeakPolarHBondContact O-CB 3.32Å; A222-A225 PolarHBondContact O-N 3.4Å; A222-A225 VanDerWaalsContact O-N 3.17Å; Q223-A225 VanDerWaalsContact C-N 3.32Å; Q223-A225 PolarHBondContact O-N 3.08Å; A225-K228 PolarHBondContact O-N 3.49Å; A225-F229 WeakPolarHBondContact O-CB 3.45Å; A225-F229 PolarHBondContact O-N 2.85Å
226E95.4Very high93.7Very high146 Ų146101.1 Ų101.168%0.68252%0.522SS*.Hα-helixtrans-61.3-46.8174.7-173.9178.5-171.400111.7A222 Q223 K228 F229 G230A222-E226 PolarHBondContact O-N 3.39Å; Q223-E226 PolarHBondContact O-N 2.88Å; E226-K228 PolarHBondContact O-N 2.93Å; E226-F229 PolarHBondContact O-N 3.2Å; E226-G230 PolarHBondContact O-N 3.14Å
227I92.9Very high93.7Very high105 Ų105103.6 Ų103.654%0.53853%0.53SS..Hα-helixtrans-60.1-46.1176-67.7165.8000111Q223 F229 G230 Q231Q223-I227 WeakPolarHBondContact O-CG1 3.25Å; Q223-I227 PolarHBondContact O-N 3.4Å; I227-F229 VanDerWaalsContact C-N 3.32Å; I227-F229 PolarHBondContact O-N 2.96Å; I227-G230 PolarHBondContact O-N 2.78Å; I227-Q231 WeakPolarHBondContact O-CG 3.09Å; I227-Q231 PolarHBondContact O-N 2.95Å
228K93.1Very high93.5Very high128 Ų128101.4 Ų101.456%0.55752%0.524SS*.Hα-helixtrans-63.4-36176.3-76.8179.1178.9-1780112.6V224 A225 E226 K232V224-K228 HydrophobicContact CG1-CD 4.32Å; V224-K228 WeakPolarHBondContact O-CB 3.5Å; V224-K228 WeakPolarHBondContact O-CG 3.34Å; V224-K228 PolarHBondContact O-N 3.37Å; A225-K228 PolarHBondContact O-N 3.49Å; E226-K228 PolarHBondContact O-N 2.93Å; K228-K232 WeakPolarHBondContact O-CG 3.5Å; K228-K232 PolarHBondContact O-N 2.9Å; K228-K232 VanDerWaalsContact O-N 3.1Å
229F94.4Very high93.5Very high143 Ų143102.9 Ų102.963%0.62752%0.52SS*.Hα-helixtrans-68.9-43.3175.3-173.4-100.8000111.1A225 E226 I227 Q231 K232 V233A225-F229 WeakPolarHBondContact O-CB 3.45Å; A225-F229 PolarHBondContact O-N 2.85Å; E226-F229 PolarHBondContact O-N 3.2Å; I227-F229 VanDerWaalsContact C-N 3.32Å; I227-F229 PolarHBondContact O-N 2.96Å; F229-Q231 VanDerWaalsContact C-N 3.33Å; F229-Q231 PolarHBondContact O-N 3.18Å; F229-K232 PolarHBondContact O-N 3.4Å; F229-V233 HydrophobicContact CD1-CG2 4.01Å; F229-V233 HydrophobicContact CE1-CG2 3.65Å; F229-V233 HydrophobicContact CE2-CG2 4.49Å; F229-V233 HydrophobicContact CZ-CG2 3.92Å; F229-V233 WeakPolarHBondContact O-CG2 3.38Å; F229-V233 PolarHBondContact O-N 2.89Å
230G93.6Very high93.4Very high37 Ų37104 Ų10438%0.38152%0.524SS..Hα-helixtrans-57.8-42.2172.900000112.9E226 I227 V233 M234E226-G230 PolarHBondContact O-N 3.14Å; I227-G230 PolarHBondContact O-N 2.78Å; G230-V233 PolarHBondContact O-N 3.03Å; G230-M234 WeakPolarHBondContact O-CB 3.3Å; G230-M234 PolarHBondContact O-N 3.01Å
231Q91.1Very high93.3Very high104 Ų104103.8 Ų103.849%0.48652%0.523SS..Hα-helixtrans-58.7-52.2172-74.7174.1-20.600111.6I227 F229 V233 M234 E235I227-Q231 WeakPolarHBondContact O-CG 3.09Å; I227-Q231 PolarHBondContact O-N 2.95Å; F229-Q231 VanDerWaalsContact C-N 3.33Å; F229-Q231 PolarHBondContact O-N 3.18Å; Q231-V233 VanDerWaalsContact C-N 3.33Å; Q231-V233 PolarHBondContact O-N 3.46Å; Q231-M234 WeakPolarHBondContact O-CA 3.22Å; Q231-M234 WeakPolarHBondContact O-CB 3.44Å; Q231-M234 PolarHBondContact O-N 3.35Å; Q231-E235 WeakPolarHBondContact O-CG 3.31Å; Q231-E235 PolarHBondContact O-N 2.93Å
232K93.8Very high93.1Very high134 Ų134103.4 Ų103.458%0.58352%0.516SS*.Hα-helixtrans-60.3-38177.4-73.1-178.3177-173.90113.7K228 F229 M234 E235 K236K228-K232 WeakPolarHBondContact O-CG 3.5Å; K228-K232 PolarHBondContact O-N 2.9Å; K228-K232 VanDerWaalsContact O-N 3.1Å; F229-K232 PolarHBondContact O-N 3.4Å; K232-M234 VanDerWaalsContact C-N 3.35Å; K232-E235 PolarHBondContact O-N 2.84Å; K232-K236 WeakPolarHBondContact O-CG 3.44Å; K232-K236 PolarHBondContact O-N 3.21Å
233V93.6Very high93Very high49 Ų49103.3 Ų103.330%0.29751%0.512SS..Hα-helixtrans-68-37.1175.4170.90000110.8F229 G230 Q231 K237F229-V233 HydrophobicContact CD1-CG2 4.01Å; F229-V233 HydrophobicContact CE1-CG2 3.65Å; F229-V233 HydrophobicContact CE2-CG2 4.49Å; F229-V233 HydrophobicContact CZ-CG2 3.92Å; F229-V233 WeakPolarHBondContact O-CG2 3.38Å; F229-V233 PolarHBondContact O-N 2.89Å; G230-V233 PolarHBondContact O-N 3.03Å; Q231-V233 VanDerWaalsContact C-N 3.33Å; Q231-V233 PolarHBondContact O-N 3.46Å; V233-K237 HydrophobicContact CG1-CD 4.08Å; V233-K237 WeakPolarHBondContact O-CB 3.42Å; V233-K237 VanDerWaalsContact O-CG 3.25Å; V233-K237 WeakPolarHBondContact O-CG 3.48Å; V233-K237 PolarHBondContact O-N 2.7Å
234M92.9Very high93Very high123 Ų123101.8 Ų101.861%0.60651%0.505SS*.Hα-helixtrans-65.4-45173.3-166.8-153.3-54.900111.4G230 Q231 K232 K237 T238G230-M234 WeakPolarHBondContact O-CB 3.3Å; G230-M234 PolarHBondContact O-N 3.01Å; Q231-M234 WeakPolarHBondContact O-CA 3.22Å; Q231-M234 WeakPolarHBondContact O-CB 3.44Å; Q231-M234 PolarHBondContact O-N 3.35Å; K232-M234 VanDerWaalsContact C-N 3.35Å; M234-K237 PolarHBondContact O-N 3.4Å; M234-T238 WeakPolarHBondContact O-CB 3.21Å; M234-T238 PolarHBondContact O-N 3.4Å; M234-T238 PolarHBondContact O-OG1 2.88Å
235E92.5Very high92.9Very high113 Ų113103.7 Ų103.753%0.52851%0.512SS..Hα-helixtrans-55.9-53.2174.7-72.1168173.700110.6Q231 K232 K237 T238 E239Q231-E235 WeakPolarHBondContact O-CG 3.31Å; Q231-E235 PolarHBondContact O-N 2.93Å; K232-E235 PolarHBondContact O-N 2.84Å; E235-K237 PolarHBondContact O-N 3.15Å; E235-T238 CarbonylContact O-C 3.6Å; E235-T238 WeakPolarHBondContact O-CA 3.39Å; E235-T238 WeakPolarHBondContact O-CB 3.24Å; E235-T238 PolarHBondContact O-N 3.06Å; E235-E239 PolarHBondContact O-N 3.38Å
236K93.4Very high92.8Very high125 Ų125106.9 Ų106.954%0.54352%0.518SS..Hα-helixtrans-64.6-34.4179.5-69.3-71.5159.6-147.20113.7K232 T238 E239 K240K232-K236 WeakPolarHBondContact O-CG 3.44Å; K232-K236 PolarHBondContact O-N 3.21Å; K236-T238 VanDerWaalsContact C-N 3.33Å; K236-E239 WeakPolarHBondContact CD-OE2 3.44Å; K236-E239 IonicContact NZ-OE1 2.72Å; K236-E239 PolarHBondContact NZ-OE1 3.21Å; K236-E239 IonicContact NZ-OE2 3.66Å; K236-E239 PolarHBondContact NZ-OE2 3.48Å; K236-K240 WeakPolarHBondContact O-CB 3.24Å; K236-K240 PolarHBondContact O-N 3Å
237K92Very high92.6Very high149 Ų149104.9 Ų104.965%0.64851%0.511SS*.Hα-helixtrans-67.1-34.9170.8-77174.6179.8178.70112.1V233 M234 E235 K241V233-K237 HydrophobicContact CG1-CD 4.08Å; V233-K237 WeakPolarHBondContact O-CB 3.42Å; V233-K237 VanDerWaalsContact O-CG 3.25Å; V233-K237 WeakPolarHBondContact O-CG 3.48Å; V233-K237 PolarHBondContact O-N 2.7Å; M234-K237 PolarHBondContact O-N 3.4Å; E235-K237 PolarHBondContact O-N 3.15Å; K237-K241 WeakPolarHBondContact O-CB 3.4Å; K237-K241 PolarHBondContact O-N 3.48Å
238T91.4Very high92.6Very high72 Ų72105.3 Ų105.344%0.44252%0.515SS..Hα-helixtrans-72-45.3178-54.90000110.6M234 E235 K236 K240 K241 I242M234-T238 WeakPolarHBondContact O-CB 3.21Å; M234-T238 PolarHBondContact O-N 3.4Å; M234-T238 PolarHBondContact O-OG1 2.88Å; E235-T238 CarbonylContact O-C 3.6Å; E235-T238 WeakPolarHBondContact O-CA 3.39Å; E235-T238 WeakPolarHBondContact O-CB 3.24Å; E235-T238 PolarHBondContact O-N 3.06Å; K236-T238 VanDerWaalsContact C-N 3.33Å; T238-K240 PolarHBondContact O-N 2.89Å; T238-K241 PolarHBondContact O-N 3.23Å; T238-I242 HydrophobicContact CG2-CD1 4.12Å; T238-I242 WeakPolarHBondContact O-CG1 3.37Å; T238-I242 PolarHBondContact O-N 3.39Å
239E92.3Very high92.5Very high94 Ų94101.1 Ų101.144%0.43950%0.504SS..Hα-helixtrans-53.4-52.8170.3-72.6176.5-163.100111.2E235 K236 K241 I242 S243E235-E239 PolarHBondContact O-N 3.38Å; K236-E239 WeakPolarHBondContact CD-OE2 3.44Å; K236-E239 IonicContact NZ-OE1 2.72Å; K236-E239 PolarHBondContact NZ-OE1 3.21Å; K236-E239 IonicContact NZ-OE2 3.66Å; K236-E239 PolarHBondContact NZ-OE2 3.48Å; E239-K241 VanDerWaalsContact C-N 3.27Å; E239-K241 PolarHBondContact O-N 3.47Å; E239-I242 WeakPolarHBondContact O-CB 3.37Å; E239-I242 PolarHBondContact O-N 3.34Å; E239-S243 PolarHBondContact O-N 2.89Å; E239-S243 PolarHBondContact O-OG 3.39Å
240K93.4Very high92.5Very high132 Ų13299.7 Ų99.757%0.57450%0.498SS*.Hα-helixtrans-55.5-43.3178-174.1178.1-171.4-96.60111.9K236 T238 I242 S243 E244K236-K240 WeakPolarHBondContact O-CB 3.24Å; K236-K240 PolarHBondContact O-N 3Å; T238-K240 PolarHBondContact O-N 2.89Å; K240-I242 VanDerWaalsContact C-N 3.35Å; K240-S243 PolarHBondContact O-N 2.77Å; K240-E244 IonicContact NZ-OE1 3.84Å; K240-E244 PolarHBondContact NZ-OE1 3.46Å; K240-E244 WeakPolarHBondContact O-CG 3.21Å; K240-E244 PolarHBondContact O-N 2.86Å
241K93.3Very high92.5Very high135 Ų135103.3 Ų103.359%0.58751%0.508SS*.Hα-helixtrans-69.8-31.2179.7-169168.2-175.2174.60112.8K237 T238 E239 I245K237-K241 WeakPolarHBondContact O-CB 3.4Å; K237-K241 PolarHBondContact O-N 3.48Å; T238-K241 PolarHBondContact O-N 3.23Å; E239-K241 VanDerWaalsContact C-N 3.27Å; E239-K241 PolarHBondContact O-N 3.47Å; K241-I245 HydrophobicContact CG-CD1 4.29Å; K241-I245 WeakPolarHBondContact O-CD1 3.32Å; K241-I245 WeakPolarHBondContact O-CG1 3.27Å; K241-I245 PolarHBondContact O-N 2.89Å; K241-I245 VanDerWaalsContact O-N 3.14Å
242I91.3Very high92.5Very high86 Ų86101.1 Ų101.144%0.44151%0.508SS..Hα-helixtrans-66-47.8170.6-68.9163.8000109.4T238 E239 K240 E244 I245 E246T238-I242 HydrophobicContact CG2-CD1 4.12Å; T238-I242 WeakPolarHBondContact O-CG1 3.37Å; T238-I242 PolarHBondContact O-N 3.39Å; E239-I242 WeakPolarHBondContact O-CB 3.37Å; E239-I242 PolarHBondContact O-N 3.34Å; K240-I242 VanDerWaalsContact C-N 3.35Å; I242-E244 PolarHBondContact O-N 2.93Å; I242-I245 CarbonylContact O-C 3.53Å; I242-I245 PolarHBondContact O-N 3.37Å; I242-I245 VanDerWaalsContact O-N 3.12Å; I242-E246 HydrophobicContact CG2-CG 4.31Å; I242-E246 WeakPolarHBondContact O-CG 3.49Å; I242-E246 PolarHBondContact O-N 2.89Å
243S91.3Very high92.4Very high58 Ų58103.7 Ų103.741%0.40651%0.514SS..Hα-helixtrans-60.1-42.6176.6-56.90000112.8E239 K240 I245 E246 D247E239-S243 PolarHBondContact O-N 2.89Å; E239-S243 PolarHBondContact O-OG 3.39Å; K240-S243 PolarHBondContact O-N 2.77Å; S243-I245 VanDerWaalsContact C-N 3.32Å; S243-I245 PolarHBondContact O-N 3.3Å; S243-E246 PolarHBondContact O-N 3.39Å; S243-E246 VanDerWaalsContact O-N 3.17Å; S243-D247 WeakPolarHBondContact O-CB 3.27Å; S243-D247 PolarHBondContact O-N 2.87Å
244E93.1Very high92.4Very high85 Ų85106.5 Ų106.540%0.39752%0.524SS..Hα-helixtrans-57.7-42.8173.5-74168.5175.900111.8K240 I242 D248K240-E244 IonicContact NZ-OE1 3.84Å; K240-E244 PolarHBondContact NZ-OE1 3.46Å; K240-E244 WeakPolarHBondContact O-CG 3.21Å; K240-E244 PolarHBondContact O-N 2.86Å; I242-E244 PolarHBondContact O-N 2.93Å; E244-D248 WeakPolarHBondContact O-CB 3.26Å; E244-D248 PolarHBondContact O-N 3.38Å
245I92.5Very high92.4Very high105 Ų105107.2 Ų107.254%0.53852%0.524SS..Hα-helixtrans-68.6-36.3176.4-69165.1000111.7K241 I242 S243 A249K241-I245 HydrophobicContact CG-CD1 4.29Å; K241-I245 WeakPolarHBondContact O-CD1 3.32Å; K241-I245 WeakPolarHBondContact O-CG1 3.27Å; K241-I245 PolarHBondContact O-N 2.89Å; K241-I245 VanDerWaalsContact O-N 3.14Å; I242-I245 CarbonylContact O-C 3.53Å; I242-I245 PolarHBondContact O-N 3.37Å; I242-I245 VanDerWaalsContact O-N 3.12Å; S243-I245 VanDerWaalsContact C-N 3.32Å; S243-I245 PolarHBondContact O-N 3.3Å; I245-A249 WeakPolarHBondContact O-CB 3.27Å; I245-A249 PolarHBondContact O-N 2.95Å
246E90.6Very high92.4Very high122 Ų122104.7 Ų104.757%0.5752%0.522SS*.Hα-helixtrans-68.8-41.6176.8-74.1179.9160.100111.9I242 S243 A249 F250I242-E246 HydrophobicContact CG2-CG 4.31Å; I242-E246 WeakPolarHBondContact O-CG 3.49Å; I242-E246 PolarHBondContact O-N 2.89Å; S243-E246 PolarHBondContact O-N 3.39Å; S243-E246 VanDerWaalsContact O-N 3.17Å; E246-A249 PolarHBondContact O-N 3.32Å; E246-F250 VanDerWaalsContact O-CB 3.28Å; E246-F250 WeakPolarHBondContact O-CB 3.4Å; E246-F250 PolarHBondContact O-N 2.94Å
247D92.5Very high92.5Very high103 Ų103105 Ų10555%0.55152%0.523SS*.Hα-helixtrans-63.5-48174.3-76.1-26.6000111.1S243 A249 F250 L251S243-D247 WeakPolarHBondContact O-CB 3.27Å; S243-D247 PolarHBondContact O-N 2.87Å; D247-A249 VanDerWaalsContact C-N 3.34Å; D247-A249 PolarHBondContact O-N 2.84Å; D247-F250 PolarHBondContact O-N 3.02Å; D247-L251 WeakPolarHBondContact O-CB 3.38Å; D247-L251 WeakPolarHBondContact O-CG 3.16Å; D247-L251 PolarHBondContact O-N 2.96Å
248D93.3Very high92.5Very high114 Ų114100.4 Ų100.461%0.6151%0.513SS*.Hα-helixtrans-59.7-43.2174.6-84.7-17.6000111.5E244 F250 L251 A252E244-D248 WeakPolarHBondContact O-CB 3.26Å; E244-D248 PolarHBondContact O-N 3.38Å; D248-F250 VanDerWaalsContact C-N 3.34Å; D248-F250 PolarHBondContact O-N 2.85Å; D248-L251 PolarHBondContact O-N 3.34Å; D248-A252 VanDerWaalsContact O-CB 3.28Å; D248-A252 WeakPolarHBondContact O-CB 3.4Å; D248-A252 PolarHBondContact O-N 2.87Å
249A90.6Very high92.5Very high40 Ų40101.2 Ų101.233%0.33151%0.514SS..Hα-helixtrans-66.5-34.8176.400000112.4I245 E246 D247 R253I245-A249 WeakPolarHBondContact O-CB 3.27Å; I245-A249 PolarHBondContact O-N 2.95Å; E246-A249 PolarHBondContact O-N 3.32Å; D247-A249 VanDerWaalsContact C-N 3.34Å; D247-A249 PolarHBondContact O-N 2.84Å; A249-R253 WeakPolarHBondContact O-CB 2.83Å; A249-R253 WeakPolarHBondContact O-CG 3.19Å; A249-R253 PolarHBondContact O-N 2.65Å
250F93.4Very high92.5Very high114 Ų11499.3 Ų99.350%0.552%0.515SS..Hα-helixtrans-69.9-45.1175.9-179-105.6000111.6E246 D247 D248 R253 Q254E246-F250 VanDerWaalsContact O-CB 3.28Å; E246-F250 WeakPolarHBondContact O-CB 3.4Å; E246-F250 PolarHBondContact O-N 2.94Å; D247-F250 PolarHBondContact O-N 3.02Å; D248-F250 VanDerWaalsContact C-N 3.34Å; D248-F250 PolarHBondContact O-N 2.85Å; F250-R253 PolarHBondContact O-N 3.42Å; F250-Q254 HydrophobicContact CD1-CG 4.28Å; F250-Q254 HydrophobicContact CE1-CG 3.98Å; F250-Q254 HydrophobicContact CE2-CG 4.29Å; F250-Q254 HydrophobicContact CZ-CG 3.99Å; F250-Q254 WeakPolarHBondContact O-CB 3.46Å; F250-Q254 WeakPolarHBondContact O-CG 3.46Å; F250-Q254 PolarHBondContact O-N 3.25Å
251L93.4Very high92.4Very high112 Ų11298.2 Ų98.259%0.58651%0.512SS*.Hα-helixtrans-59.8-45.1173.1-72.4174.3000111.4D247 D248 R253 Q254 K255D247-L251 WeakPolarHBondContact O-CB 3.38Å; D247-L251 WeakPolarHBondContact O-CG 3.16Å; D247-L251 PolarHBondContact O-N 2.96Å; D248-L251 PolarHBondContact O-N 3.34Å; L251-R253 PolarHBondContact O-N 2.83Å; L251-Q254 PolarHBondContact O-N 2.99Å; L251-K255 VanDerWaalsContact O-CB 3.31Å; L251-K255 WeakPolarHBondContact O-CB 3.33Å; L251-K255 PolarHBondContact O-N 2.89Å
252A92.6Very high92.4Very high59 Ų5998.4 Ų98.449%0.48851%0.513SS..Hα-helixtrans-61.2-41.9175.700000112.3D248 A256D248-A252 VanDerWaalsContact O-CB 3.28Å; D248-A252 WeakPolarHBondContact O-CB 3.4Å; D248-A252 PolarHBondContact O-N 2.87Å; A252-A256 VanDerWaalsContact O-CB 3.27Å; A252-A256 WeakPolarHBondContact O-CB 3.28Å; A252-A256 PolarHBondContact O-N 3.21Å
253R91.8Very high92.4Very high187 Ų187100.4 Ų100.471%0.70652%0.516SS*.Hα-helixtrans-64.9-46.3175.1-77170.8-176.8-179.54.6112.6A249 F250 L251 A256 K257A249-R253 WeakPolarHBondContact O-CB 2.83Å; A249-R253 WeakPolarHBondContact O-CG 3.19Å; A249-R253 PolarHBondContact O-N 2.65Å; F250-R253 PolarHBondContact O-N 3.42Å; L251-R253 PolarHBondContact O-N 2.83Å; R253-A256 PolarHBondContact O-N 3.36Å; R253-K257 WeakPolarHBondContact O-CB 3.48Å; R253-K257 PolarHBondContact O-N 3.43Å
254Q92.5Very high92.4Very high109 Ų109101.9 Ų101.951%0.50952%0.522SS..Hα-helixtrans-60.2-46.8177.1-75.1-11545.600111F250 L251 K257 A258F250-Q254 HydrophobicContact CD1-CG 4.28Å; F250-Q254 HydrophobicContact CE1-CG 3.98Å; F250-Q254 HydrophobicContact CE2-CG 4.29Å; F250-Q254 HydrophobicContact CZ-CG 3.99Å; F250-Q254 WeakPolarHBondContact O-CB 3.46Å; F250-Q254 WeakPolarHBondContact O-CG 3.46Å; F250-Q254 PolarHBondContact O-N 3.25Å; L251-Q254 PolarHBondContact O-N 2.99Å; Q254-K257 PolarHBondContact O-N 3.39Å; Q254-A258 WeakPolarHBondContact O-CB 3.36Å; Q254-A258 PolarHBondContact O-N 2.62Å
255K93.8Very high92.2Very high138 Ų138100.7 Ų100.760%0.653%0.527SS*.Hα-helixtrans-62.1-49.2177-175.6175.7178.2-178.40111.9L251 K257 A258 D259L251-K255 VanDerWaalsContact O-CB 3.31Å; L251-K255 WeakPolarHBondContact O-CB 3.33Å; L251-K255 PolarHBondContact O-N 2.89Å; K255-K257 PolarHBondContact O-N 2.93Å; K255-A258 PolarHBondContact O-N 2.98Å; K255-A258 VanDerWaalsContact O-N 3.15Å; K255-D259 WeakPolarHBondContact O-CB 3.38Å; K255-D259 VanDerWaalsContact O-CG 3.29Å; K255-D259 PolarHBondContact O-N 2.66Å
256A92.4Very high92.2Very high59 Ų5998.9 Ų98.949%0.48852%0.518SS..Hα-helixtrans-59.7-35.4177.500000112.6A252 R253 A260A252-A256 VanDerWaalsContact O-CB 3.27Å; A252-A256 WeakPolarHBondContact O-CB 3.28Å; A252-A256 PolarHBondContact O-N 3.21Å; R253-A256 PolarHBondContact O-N 3.36Å; A256-A260 VanDerWaalsContact O-CB 3.3Å; A256-A260 WeakPolarHBondContact O-CB 3.42Å; A256-A260 PolarHBondContact O-N 3.46Å
257K94.1Very high92.1Very high132 Ų13298.9 Ų98.957%0.57451%0.513SS*.Hα-helixtrans-67.6-47.3173.9-172.5-177.9173.1-166.10111.8R253 Q254 K255 A260 E261R253-K257 WeakPolarHBondContact O-CB 3.48Å; R253-K257 PolarHBondContact O-N 3.43Å; Q254-K257 PolarHBondContact O-N 3.39Å; K255-K257 PolarHBondContact O-N 2.93Å; K257-A260 PolarHBondContact O-N 3.32Å; K257-E261 WeakPolarHBondContact CE-OE1 3.11Å; K257-E261 IonicContact NZ-OE1 3.23Å; K257-E261 WeakPolarHBondContact O-CG 3.42Å; K257-E261 PolarHBondContact O-N 2.93Å
258A92.2Very high91.8Very high52 Ų5296.1 Ų96.143%0.4350%0.504SS..Hα-helixtrans-63.4-41.3177.400000112.2Q254 K255 A260 E261 F262Q254-A258 WeakPolarHBondContact O-CB 3.36Å; Q254-A258 PolarHBondContact O-N 2.62Å; K255-A258 PolarHBondContact O-N 2.98Å; K255-A258 VanDerWaalsContact O-N 3.15Å; A258-A260 VanDerWaalsContact C-N 3.34Å; A258-A260 PolarHBondContact O-N 3.38Å; A258-E261 PolarHBondContact O-N 3.5Å; A258-F262 WeakPolarHBondContact O-CB 3.49Å; A258-F262 PolarHBondContact O-N 2.91Å
259D93.1Very high91.4Very high89 Ų8993.1 Ų93.148%0.47650%0.495SS..Hα-helixtrans-63.6-38.6175.4-71.1-22.5000111.1K255 Y263K255-D259 WeakPolarHBondContact O-CB 3.38Å; K255-D259 VanDerWaalsContact O-CG 3.29Å; K255-D259 PolarHBondContact O-N 2.66Å; D259-Y263 VanDerWaalsContact O-CB 3.31Å; D259-Y263 WeakPolarHBondContact O-CB 3.33Å; D259-Y263 PolarHBondContact O-N 3.14Å
260A90.6Very high91.2Very high54 Ų5495 Ų9545%0.44650%0.497SS..Hα-helixtrans-69-42.8174.500000112.8A256 K257 A258 Y263 T264A256-A260 VanDerWaalsContact O-CB 3.3Å; A256-A260 WeakPolarHBondContact O-CB 3.42Å; A256-A260 PolarHBondContact O-N 3.46Å; K257-A260 PolarHBondContact O-N 3.32Å; A258-A260 VanDerWaalsContact C-N 3.34Å; A258-A260 PolarHBondContact O-N 3.38Å; A260-Y263 PolarHBondContact O-N 3.28Å; A260-T264 WeakPolarHBondContact O-CG2 3.31Å; A260-T264 PolarHBondContact O-N 3.22Å; A260-T264 PolarHBondContact O-OG1 3.45Å
261E92.2Very high90.7Very high109 Ų10991.4 Ų91.451%0.50949%0.489SS..Hα-helixtrans-61.7-44173.7-74.7176.3-175.200111.1K257 A258 T264 A265K257-E261 WeakPolarHBondContact CE-OE1 3.11Å; K257-E261 IonicContact NZ-OE1 3.23Å; K257-E261 WeakPolarHBondContact O-CG 3.42Å; K257-E261 PolarHBondContact O-N 2.93Å; A258-E261 PolarHBondContact O-N 3.5Å; E261-T264 WeakPolarHBondContact CA-OG1 3.44Å; E261-T264 PolarHBondContact O-N 3.03Å; E261-T264 PolarHBondContact O-OG1 2.97Å; E261-A265 VanDerWaalsContact O-CB 3.32Å; E261-A265 WeakPolarHBondContact O-CB 3.41Å; E261-A265 PolarHBondContact O-N 2.9Å
262F92.2Very high90Very high140 Ų14090.3 Ų90.361%0.61448%0.483SS*.Hα-helixtrans-61.9-45.9173.9179.3-100000112.3A258 A265 L266A258-F262 WeakPolarHBondContact O-CB 3.49Å; A258-F262 PolarHBondContact O-N 2.91Å; F262-A265 PolarHBondContact O-N 3.45Å; F262-L266 HydrophobicContact CE1-CD1 3.99Å; F262-L266 HydrophobicContact CZ-CD1 3.95Å; F262-L266 VanDerWaalsContact O-CB 3.3Å; F262-L266 WeakPolarHBondContact O-CB 3.25Å; F262-L266 PolarHBondContact O-N 3Å
263Y92.1Very high89.4Confident128 Ų12895.1 Ų95.150%0.50249%0.493SS..Hα-helixtrans-62-45178.2-173.9-93.9000112.1D259 A260 L266 R267D259-Y263 VanDerWaalsContact O-CB 3.31Å; D259-Y263 WeakPolarHBondContact O-CB 3.33Å; D259-Y263 PolarHBondContact O-N 3.14Å; A260-Y263 PolarHBondContact O-N 3.28Å; Y263-L266 PolarHBondContact O-N 2.87Å; Y263-R267 HydrophobicContact CD1-CG 4.02Å; Y263-R267 HydrophobicContact CE1-CG 3.63Å; Y263-R267 HydrophobicContact CE2-CG 4.49Å; Y263-R267 WeakPolarHBondContact O-CB 3.47Å; Y263-R267 WeakPolarHBondContact O-CG 3.5Å; Y263-R267 PolarHBondContact O-N 3.35Å; Y263-R267 PolarHBondContact OH-NE 3.13Å; Y263-R267 VanDerWaalsContact OH-NE 3.09Å; Y263-R267 PolarHBondContact OH-NH2 3.16Å; Y263-R267 VanDerWaalsContact OH-NH2 3.16Å
264T90.9Very high88.7Confident89 Ų8993.1 Ų93.155%0.54650%0.496SS..Hα-helixtrans-64.9-41.5177.5530000111.9A260 E261 A268A260-T264 WeakPolarHBondContact O-CG2 3.31Å; A260-T264 PolarHBondContact O-N 3.22Å; A260-T264 PolarHBondContact O-OG1 3.45Å; E261-T264 WeakPolarHBondContact CA-OG1 3.44Å; E261-T264 PolarHBondContact O-N 3.03Å; E261-T264 PolarHBondContact O-OG1 2.97Å; T264-A268 VanDerWaalsContact O-CB 3.3Å; T264-A268 WeakPolarHBondContact O-CB 3.49Å; T264-A268 PolarHBondContact O-N 2.82Å
265A89.7Confident87.7Confident59 Ų5992.3 Ų92.349%0.48849%0.49SS..Hα-helixtrans-63.4-42.2174.500000112.4E261 F262 A268 A269E261-A265 VanDerWaalsContact O-CB 3.32Å; E261-A265 WeakPolarHBondContact O-CB 3.41Å; E261-A265 PolarHBondContact O-N 2.9Å; F262-A265 PolarHBondContact O-N 3.45Å; A265-A268 PolarHBondContact O-N 2.95Å; A265-A269 WeakPolarHBondContact O-CB 3.43Å; A265-A269 PolarHBondContact O-N 3.45Å
266L91.7Very high86.4Confident67 Ų6791.5 Ų91.535%0.35149%0.492SS..Hα-helixtrans-65.1-46.1177.4-175.6140.3000111.6F262 Y263 A268 A269 E270F262-L266 HydrophobicContact CE1-CD1 3.99Å; F262-L266 HydrophobicContact CZ-CD1 3.95Å; F262-L266 VanDerWaalsContact O-CB 3.3Å; F262-L266 WeakPolarHBondContact O-CB 3.25Å; F262-L266 PolarHBondContact O-N 3Å; Y263-L266 PolarHBondContact O-N 2.87Å; L266-A268 VanDerWaalsContact C-N 3.33Å; L266-A268 PolarHBondContact O-N 3.04Å; L266-A269 PolarHBondContact O-N 2.99Å; L266-E270 HydrophobicContact CD2-CG 4.39Å; L266-E270 WeakPolarHBondContact O-CG 3.49Å; L266-E270 PolarHBondContact O-N 3.37Å
267R88.6Confident85.7Confident122 Ų12291.5 Ų91.546%0.4649%0.486SS..Hα-helixtrans-63-37.1173.9-71.1-52.1-160.6-174.84.7112.6Y263 E270 A271Y263-R267 HydrophobicContact CD1-CG 4.02Å; Y263-R267 HydrophobicContact CE1-CG 3.63Å; Y263-R267 HydrophobicContact CE2-CG 4.49Å; Y263-R267 WeakPolarHBondContact O-CB 3.47Å; Y263-R267 WeakPolarHBondContact O-CG 3.5Å; Y263-R267 PolarHBondContact O-N 3.35Å; Y263-R267 PolarHBondContact OH-NE 3.13Å; Y263-R267 VanDerWaalsContact OH-NE 3.09Å; Y263-R267 PolarHBondContact OH-NH2 3.16Å; Y263-R267 VanDerWaalsContact OH-NH2 3.16Å; R267-E270 WeakPolarHBondContact CD-OE2 3.35Å; R267-E270 IonicContact CZ-OE2 3.86Å; R267-E270 IonicContact NE-OE2 3.78Å; R267-E270 IonicContact NH1-OE1 3.84Å; R267-E270 IonicContact NH1-OE2 3.73Å; R267-E270 PolarHBondContact NH1-OE2 2.81Å; R267-A271 VanDerWaalsContact O-CB 3.29Å; R267-A271 WeakPolarHBondContact O-CB 3.39Å; R267-A271 PolarHBondContact O-N 2.93Å
268A87.1Confident84.6Confident46 Ų4689.2 Ų89.238%0.3849%0.485SS..Hα-helixtrans-65-40.4173.400000111.7T264 A265 L266 A271 N272T264-A268 VanDerWaalsContact O-CB 3.3Å; T264-A268 WeakPolarHBondContact O-CB 3.49Å; T264-A268 PolarHBondContact O-N 2.82Å; A265-A268 PolarHBondContact O-N 2.95Å; L266-A268 VanDerWaalsContact C-N 3.33Å; L266-A268 PolarHBondContact O-N 3.04Å; A268-A271 PolarHBondContact O-N 2.94Å; A268-N272 VanDerWaalsContact O-CB 3.31Å; A268-N272 WeakPolarHBondContact O-CB 3.37Å; A268-N272 PolarHBondContact O-N 2.94Å; A268-N272 PolarHBondContact O-ND2 2.81Å
269A84.3Confident83.8Confident50 Ų5092.9 Ų92.941%0.41349%0.493SS..Hα-helixtrans-66.2-42.1175.900000112.5A265 L266 N272 K273A265-A269 WeakPolarHBondContact O-CB 3.43Å; A265-A269 PolarHBondContact O-N 3.45Å; L266-A269 PolarHBondContact O-N 2.99Å; A269-N272 PolarHBondContact O-N 2.9Å; A269-K273 WeakPolarHBondContact O-CG 3.36Å; A269-K273 PolarHBondContact O-N 2.97Å
270E86.1Confident83Confident80 Ų8093 Ų9337%0.37449%0.487SS..Hα-helixtrans-61.1-47.8172.1-71.9178.9159.400111.9L266 R267 N272 K273 L274L266-E270 HydrophobicContact CD2-CG 4.39Å; L266-E270 WeakPolarHBondContact O-CG 3.49Å; L266-E270 PolarHBondContact O-N 3.37Å; R267-E270 WeakPolarHBondContact CD-OE2 3.35Å; R267-E270 IonicContact CZ-OE2 3.86Å; R267-E270 IonicContact NE-OE2 3.78Å; R267-E270 IonicContact NH1-OE1 3.84Å; R267-E270 IonicContact NH1-OE2 3.73Å; R267-E270 PolarHBondContact NH1-OE2 2.81Å; E270-N272 VanDerWaalsContact C-N 3.27Å; E270-N272 PolarHBondContact O-N 3.48Å; E270-K273 WeakPolarHBondContact O-CB 3.45Å; E270-K273 PolarHBondContact O-N 3.37Å; E270-K273 VanDerWaalsContact O-N 3.16Å; E270-L274 PolarHBondContact O-N 3.07Å; E270-L274 VanDerWaalsContact O-N 3.09Å
271A82.7Confident82.2Confident39 Ų3994.8 Ų94.832%0.32249%0.489SS..Hα-helixtrans-61.5-36.1176.200000112R267 A268 L274 K275R267-A271 VanDerWaalsContact O-CB 3.29Å; R267-A271 WeakPolarHBondContact O-CB 3.39Å; R267-A271 PolarHBondContact O-N 2.93Å; A268-A271 PolarHBondContact O-N 2.94Å; A271-L274 PolarHBondContact O-N 2.97Å; A271-K275 VanDerWaalsContact O-CG 3.26Å; A271-K275 WeakPolarHBondContact O-CG 3.4Å; A271-K275 PolarHBondContact O-N 3.18Å
272N79.6Confident81.5Confident89 Ų8994.8 Ų94.848%0.47649%0.489SS..Hα-helixtrans-71-33.8175.9-70.7-16.1000112.4A268 A269 E270 K275 L276A268-N272 VanDerWaalsContact O-CB 3.31Å; A268-N272 WeakPolarHBondContact O-CB 3.37Å; A268-N272 PolarHBondContact O-N 2.94Å; A268-N272 PolarHBondContact O-ND2 2.81Å; A269-N272 PolarHBondContact O-N 2.9Å; E270-N272 VanDerWaalsContact C-N 3.27Å; E270-N272 PolarHBondContact O-N 3.48Å; N272-K275 PolarHBondContact O-N 2.8Å; N272-K275 PolarHBondContact OD1-NZ 3.13Å; N272-L276 WeakPolarHBondContact O-CG 3.24Å; N272-L276 PolarHBondContact O-N 2.86Å
273K79.9Confident80.9Confident160 Ų16092 Ų9270%0.69648%0.48SS*.Hα-helixtrans-61.2-42.9169.6-73.6176.1-179.91780111.9A269 E270 K275 L276A269-K273 WeakPolarHBondContact O-CG 3.36Å; A269-K273 PolarHBondContact O-N 2.97Å; E270-K273 WeakPolarHBondContact O-CB 3.45Å; E270-K273 PolarHBondContact O-N 3.37Å; E270-K273 VanDerWaalsContact O-N 3.16Å; K273-K275 VanDerWaalsContact C-N 3.31Å; K273-K275 PolarHBondContact O-N 3.2Å; K273-L276 PolarHBondContact O-N 3.4Å
274L78.1Confident80.3Confident144 Ų14490.1 Ų90.175%0.75448%0.477SS*.Hα-helixtrans-69-26.9176.5-67.7173.7000113.3E270 A271 L276E270-L274 PolarHBondContact O-N 3.07Å; E270-L274 VanDerWaalsContact O-N 3.09Å; A271-L274 PolarHBondContact O-N 2.97Å; L274-L276 VanDerWaalsContact C-N 3.29Å; L274-L276 PolarHBondContact O-N 3Å
275K70.6Confident79.7Confident92 Ų9292.3 Ų92.340%0.448%0.479SS..THydrogen-bonded Turntrans-76.5-8.3173.7-71.6168.1-167.7168.40114.1A271 N272 K273 T277 Y280A271-K275 VanDerWaalsContact O-CG 3.26Å; A271-K275 WeakPolarHBondContact O-CG 3.4Å; A271-K275 PolarHBondContact O-N 3.18Å; N272-K275 PolarHBondContact O-N 2.8Å; N272-K275 PolarHBondContact OD1-NZ 3.13Å; K273-K275 VanDerWaalsContact C-N 3.31Å; K273-K275 PolarHBondContact O-N 3.2Å; K275-T277 PolarHBondContact O-N 3.3Å; K275-Y280 HydrophobicContact CB-CD1 3.91Å; K275-Y280 HydrophobicContact CB-CE1 3.9Å; K275-Y280 HydrophobicContact CD-CE1 4.21Å; K275-Y280 HydrophobicContact CG-CD1 4.34Å; K275-Y280 HydrophobicContact CG-CE1 3.97Å; K275-Y280 VanDerWaalsContact O-CD1 3.25Å; K275-Y280 WeakPolarHBondContact O-CD1 3.49Å
276L67.3Low79.2Confident121 Ų12196.6 Ų96.663%0.63448%0.483SS*.  trans-80.235.1177-73.6168000112.9N272 K273 L274 L281N272-L276 WeakPolarHBondContact O-CG 3.24Å; N272-L276 PolarHBondContact O-N 2.86Å; K273-L276 PolarHBondContact O-N 3.4Å; L274-L276 VanDerWaalsContact C-N 3.29Å; L274-L276 PolarHBondContact O-N 3Å; L276-L281 HydrophobicContact CD2-CD1 4.16Å; L276-L281 HydrophobicContact CD2-CD2 4.37Å
277T75.9Confident78.8Confident59 Ų59100 Ų10036%0.36250%0.495SS..  trans-81.1144.4167.764.30000110.3K275 E279 Y280 L281K275-T277 PolarHBondContact O-N 3.3Å; T277-E279 WeakPolarHBondContact CB-OE2 3.43Å; T277-E279 PolarHBondContact O-N 3.29Å; T277-Y280 PolarHBondContact O-N 3.11Å; T277-Y280 VanDerWaalsContact OG1-CB 3.31Å; T277-Y280 WeakPolarHBondContact OG1-CB 3.4Å; T277-Y280 PolarHBondContact OG1-N 3.39Å; T277-L281 PolarHBondContact O-N 3.39Å
278P71.6Confident78.3Confident84 Ų8497 Ų9755%0.54550%0.497SS..Hα-helixtrans-62.1-33.2-177.824.9-33.2000112.1Q282P278-Q282 WeakPolarHBondContact O-CB 3.34Å; P278-Q282 VanDerWaalsContact O-CG 3.32Å; P278-Q282 WeakPolarHBondContact O-CG 3.46Å; P278-Q282 PolarHBondContact O-N 3.23Å
279E75Confident77.8Confident129 Ų12999 Ų9960%0.60350%0.5SS*.Hα-helixtrans-68.1-40.1177.2-50.480.8-176.500111.6T277 Q282 L283T277-E279 WeakPolarHBondContact CB-OE2 3.43Å; T277-E279 PolarHBondContact O-N 3.29Å; E279-Q282 PolarHBondContact O-N 2.8Å; E279-L283 WeakPolarHBondContact O-CB 3.22Å; E279-L283 PolarHBondContact O-N 2.94Å
280Y76Confident77.3Confident92 Ų9299.7 Ų99.736%0.36151%0.506SS..Hα-helixtrans-71.6-38.7178.6-173-98.4000111.9K275 T277 Q282 L283 M284K275-Y280 HydrophobicContact CB-CD1 3.91Å; K275-Y280 HydrophobicContact CB-CE1 3.9Å; K275-Y280 HydrophobicContact CD-CE1 4.21Å; K275-Y280 HydrophobicContact CG-CD1 4.34Å; K275-Y280 HydrophobicContact CG-CE1 3.97Å; K275-Y280 VanDerWaalsContact O-CD1 3.25Å; K275-Y280 WeakPolarHBondContact O-CD1 3.49Å; T277-Y280 PolarHBondContact O-N 3.11Å; T277-Y280 VanDerWaalsContact OG1-CB 3.31Å; T277-Y280 WeakPolarHBondContact OG1-CB 3.4Å; T277-Y280 PolarHBondContact OG1-N 3.39Å; Y280-Q282 VanDerWaalsContact C-N 3.34Å; Y280-L283 PolarHBondContact O-N 3.43Å; Y280-M284 HydrophobicContact CD1-CG 3.9Å; Y280-M284 HydrophobicContact CE1-CG 3.5Å; Y280-M284 VanDerWaalsContact CE1-CG 3.5Å; Y280-M284 HydrophobicContact CE1-SD 4.23Å; Y280-M284 HydrophobicContact CE2-CG 4.38Å; Y280-M284 WeakPolarHBondContact O-CB 3.13Å; Y280-M284 WeakPolarHBondContact O-CG 3.44Å; Y280-M284 PolarHBondContact O-N 2.95Å
281L75.3Confident76.8Confident92 Ų92100.1 Ų100.148%0.48252%0.523SS..Hα-helixtrans-64-39.1173.1-69.9176.4000111.9L276 T277 K285L276-L281 HydrophobicContact CD2-CD1 4.16Å; L276-L281 HydrophobicContact CD2-CD2 4.37Å; T277-L281 PolarHBondContact O-N 3.39Å; L281-K285 VanDerWaalsContact O-CB 3.28Å; L281-K285 WeakPolarHBondContact O-CB 3.47Å; L281-K285 PolarHBondContact O-N 3.02Å
282Q76.7Confident76.1Confident108 Ų108105 Ų10551%0.50554%0.544SS..Hα-helixtrans-64.3-46.2171.2-76.1-176.515.200111.8P278 E279 Y280 M284 K285 Y286P278-Q282 WeakPolarHBondContact O-CB 3.34Å; P278-Q282 VanDerWaalsContact O-CG 3.32Å; P278-Q282 WeakPolarHBondContact O-CG 3.46Å; P278-Q282 PolarHBondContact O-N 3.23Å; E279-Q282 PolarHBondContact O-N 2.8Å; Y280-Q282 VanDerWaalsContact C-N 3.34Å; Q282-M284 VanDerWaalsContact C-N 3.34Å; Q282-M284 PolarHBondContact O-N 3.07Å; Q282-K285 WeakPolarHBondContact O-CB 3.43Å; Q282-K285 PolarHBondContact O-N 2.81Å; Q282-Y286 HydrophobicContact CB-CD2 4.35Å; Q282-Y286 HydrophobicContact CB-CE2 4.07Å; Q282-Y286 WeakPolarHBondContact O-CD2 3.19Å; Q282-Y286 PolarHBondContact O-N 2.84Å
283L80.1Confident75.4Confident83 Ų83104 Ų10444%0.43554%0.544SS..Hα-helixtrans-59.9-43.3177.1-170.8157.7000111.5E279 Y280 Y286 K287E279-L283 WeakPolarHBondContact O-CB 3.22Å; E279-L283 PolarHBondContact O-N 2.94Å; Y280-L283 PolarHBondContact O-N 3.43Å; L283-Y286 PolarHBondContact O-N 2.94Å; L283-K287 HydrophobicContact CD2-CD 3.85Å; L283-K287 HydrophobicContact CD2-CG 4.14Å; L283-K287 WeakPolarHBondContact O-CB 3.27Å; L283-K287 PolarHBondContact O-N 3.38Å
284M80.1Confident74.4Confident87 Ų87104.1 Ų104.143%0.42955%0.545SS..Hα-helixtrans-66.2-39.6175.4-74.5-64.7-63.800112.2Y280 Q282 K287 A288Y280-M284 HydrophobicContact CD1-CG 3.9Å; Y280-M284 HydrophobicContact CE1-CG 3.5Å; Y280-M284 VanDerWaalsContact CE1-CG 3.5Å; Y280-M284 HydrophobicContact CE1-SD 4.23Å; Y280-M284 HydrophobicContact CE2-CG 4.38Å; Y280-M284 WeakPolarHBondContact O-CB 3.13Å; Y280-M284 WeakPolarHBondContact O-CG 3.44Å; Y280-M284 PolarHBondContact O-N 2.95Å; Q282-M284 VanDerWaalsContact C-N 3.34Å; Q282-M284 PolarHBondContact O-N 3.07Å; M284-K287 PolarHBondContact O-N 2.98Å; M284-A288 WeakPolarHBondContact O-CB 3.16Å; M284-A288 PolarHBondContact O-N 3.5Å
285K77.1Confident73.4Confident136 Ų136103.7 Ų103.759%0.59154%0.541SS*.Hα-helixtrans-60.7-47.3172-179.6179.6177.4-178.60111.1L281 Q282 A288 I289L281-K285 VanDerWaalsContact O-CB 3.28Å; L281-K285 WeakPolarHBondContact O-CB 3.47Å; L281-K285 PolarHBondContact O-N 3.02Å; Q282-K285 WeakPolarHBondContact O-CB 3.43Å; Q282-K285 PolarHBondContact O-N 2.81Å; K285-A288 PolarHBondContact O-N 3.05Å; K285-I289 HydrophobicContact CG-CD1 3.85Å; K285-I289 WeakPolarHBondContact O-CB 3.29Å; K285-I289 VanDerWaalsContact O-CG1 3.25Å; K285-I289 WeakPolarHBondContact O-CG1 3.39Å; K285-I289 PolarHBondContact O-N 3.17Å
286Y79.3Confident72.8Confident148 Ų148108.1 Ų108.158%0.5856%0.557SS**Hα-helixtrans-66.4-37.5177.1-67.8-52.6000112.5Q282 L283 I289 A290Q282-Y286 HydrophobicContact CB-CD2 4.35Å; Q282-Y286 HydrophobicContact CB-CE2 4.07Å; Q282-Y286 WeakPolarHBondContact O-CD2 3.19Å; Q282-Y286 PolarHBondContact O-N 2.84Å; L283-Y286 PolarHBondContact O-N 2.94Å; Y286-I289 PolarHBondContact O-N 3.24Å; Y286-A290 WeakPolarHBondContact O-CB 3.48Å; Y286-A290 PolarHBondContact O-N 3.09Å
287K83.3Confident72Confident138 Ų138111.8 Ų111.860%0.657%0.568SS**Hα-helixtrans-62.4-43.7171.2-88.2-170.8172.5-1780112.3L283 M284 A290 A291L283-K287 HydrophobicContact CD2-CD 3.85Å; L283-K287 HydrophobicContact CD2-CG 4.14Å; L283-K287 WeakPolarHBondContact O-CB 3.27Å; L283-K287 PolarHBondContact O-N 3.38Å; M284-K287 PolarHBondContact O-N 2.98Å; K287-A290 PolarHBondContact O-N 2.82Å; K287-A291 WeakPolarHBondContact O-CB 3.34Å; K287-A291 PolarHBondContact O-N 2.84Å
288A79.3Confident71Confident59 Ų59111.2 Ų111.249%0.48857%0.574SS.*Hα-helixtrans-65.6-40.5177.200000111.8M284 K285 N292M284-A288 WeakPolarHBondContact O-CB 3.16Å; M284-A288 PolarHBondContact O-N 3.5Å; K285-A288 PolarHBondContact O-N 3.05Å; A288-N292 PolarHBondContact O-N 3.4Å; A288-N292 VanDerWaalsContact O-N 3.17Å
289I75.6Confident70.1Confident88 Ų88115.6 Ų115.645%0.45159%0.593SS.*Hα-helixtrans-63.2-48.8173.2-69.7166.3000110.5K285 Y286 A291 N292 S293K285-I289 HydrophobicContact CG-CD1 3.85Å; K285-I289 WeakPolarHBondContact O-CB 3.29Å; K285-I289 VanDerWaalsContact O-CG1 3.25Å; K285-I289 WeakPolarHBondContact O-CG1 3.39Å; K285-I289 PolarHBondContact O-N 3.17Å; Y286-I289 PolarHBondContact O-N 3.24Å; I289-A291 VanDerWaalsContact C-N 3.31Å; I289-A291 PolarHBondContact O-N 3.46Å; I289-N292 CarbonylContact O-C 3.2Å; I289-N292 PolarHBondContact O-N 3.21Å; I289-S293 WeakPolarHBondContact O-CB 3.42Å; I289-S293 PolarHBondContact O-N 3.08Å; I289-S293 PolarHBondContact O-OG 3.02Å
290A73.8Confident69.1Low66 Ų66117 Ų11755%0.54561%0.605SS.*Hα-helixtrans-63.4-34.6-179.900000113Y286 K287 N292 S293Y286-A290 WeakPolarHBondContact O-CB 3.48Å; Y286-A290 PolarHBondContact O-N 3.09Å; K287-A290 PolarHBondContact O-N 2.82Å; A290-N292 VanDerWaalsContact C-N 3.33Å; A290-S293 WeakPolarHBondContact CA-OG 3.22Å; A290-S293 PolarHBondContact O-OG 3.39Å
291A75.6Confident68.2Low88 Ų88119.2 Ų119.273%0.72762%0.621SS**Hα-helixtrans-70.6-27.2173.800000113.1K287 I289K287-A291 WeakPolarHBondContact O-CB 3.34Å; K287-A291 PolarHBondContact O-N 2.84Å; I289-A291 VanDerWaalsContact C-N 3.31Å; I289-A291 PolarHBondContact O-N 3.46Å
292N67.8Low67.1Low142 Ų142120.6 Ų120.676%0.75964%0.636SS**Hα-helixtrans-94.4-17.7177.8-101.5-25.2000114.2A288 I289 A290 K294A288-N292 PolarHBondContact O-N 3.4Å; A288-N292 VanDerWaalsContact O-N 3.17Å; I289-N292 CarbonylContact O-C 3.2Å; I289-N292 PolarHBondContact O-N 3.21Å; A290-N292 VanDerWaalsContact C-N 3.33Å; N292-K294 PolarHBondContact O-N 2.82Å; N292-K294 VanDerWaalsContact O-N 3.08Å
293S65.5Low65.8Low69 Ų69124.2 Ų124.248%0.48365%0.653SS.*  trans-77.894.7-177.659.90000111.9I289 A290I289-S293 WeakPolarHBondContact O-CB 3.42Å; I289-S293 PolarHBondContact O-N 3.08Å; I289-S293 PolarHBondContact O-OG 3.02Å; A290-S293 WeakPolarHBondContact CA-OG 3.22Å; A290-S293 PolarHBondContact O-OG 3.39Å
294K58.3Low64.2Low162 Ų162126.8 Ų126.870%0.70466%0.664SS**  trans-87.2120.4165.6-67.5179.2-180176.20109.6N292 Y296N292-K294 PolarHBondContact O-N 2.82Å; N292-K294 VanDerWaalsContact O-N 3.08Å; K294-Y296 HydrophobicContact CB-CD2 4.47Å; K294-Y296 HydrophobicContact CB-CE2 3.7Å
295I57.8Low62.5Low134 Ų134131.1 Ų131.169%0.68768%0.681SS**  trans-91.9130.2178.2-54.2175.2000108.8F297I295-F297 HydrophobicContact CG2-CD2 4.07Å; I295-F297 HydrophobicContact CG2-CE2 3.53Å; I295-F297 HydrophobicContact CG2-CZ 3.88Å
296Y57.8Low61.2Low185 Ų185130.4 Ų130.473%0.72569%0.688SS**  trans-120.2138.4175.9-61.4-92.1000109.2K294K294-Y296 HydrophobicContact CB-CD2 4.47Å; K294-Y296 HydrophobicContact CB-CE2 3.7Å
297F50.7Low59.3Low198 Ų198129.2 Ų129.287%0.86869%0.691SS**  trans-122.8132.8178.2-71.4-82.9000110.4I295I295-F297 HydrophobicContact CG2-CD2 4.07Å; I295-F297 HydrophobicContact CG2-CE2 3.53Å; I295-F297 HydrophobicContact CG2-CZ 3.88Å
298G54.7Low57.3Low47 Ų47127.4 Ų127.449%0.48570%0.696SS.*  trans177.4155.2178.100000112.4D300 I301G298-D300 VanDerWaalsContact C-N 3.34Å; G298-D300 PolarHBondContact O-N 3.41Å; G298-I301 WeakPolarHBondContact O-CG1 3.41Å
299N51.4Low55.1Low176 Ų176128.1 Ų128.194%0.94171%0.709SS**SBendtrans-79.6-0.8-166.9-92.612000116.7
300D55.8Low53.2Low160 Ų160129 Ų12986%0.85672%0.723SS**  trans-132.9111.9167.3-86.7-57.2000108.7G298G298-D300 VanDerWaalsContact C-N 3.34Å; G298-D300 PolarHBondContact O-N 3.41Å
301I55.5Low51.4Low138 Ų138132.7 Ų132.771%0.70874%0.739SS**  trans-111.2112.7-177.1-58.9177.3000108.1G298G298-I301 WeakPolarHBondContact O-CG1 3.41Å
302P52.9Low49.3Very low120 Ų120132.4 Ų132.478%0.77974%0.744SS**  trans-61.7136.3175.4-22.133.6000111.3
303Q49.2Very low47.7Very low185 Ų185131.5 Ų131.586%0.86475%0.749SS**  trans-72.9149176.5-80.1-159.1-400112.7
304M47.1Very low46.3Very low136 Ų136133 Ų13367%0.6776%0.76SS**  trans68.6123.1166.8-10817869.700116.8
305F44Very low45.2Very low179 Ų179133.6 Ų133.679%0.78577%0.768SS**  -142.9113.494.7-120.2-83000111.4
306V49.3Very low44.3Very low121 Ų121136.4 Ų136.473%0.73378%0.776SS**  trans-120.9134.5153.2-172.20000105.3
307D40.8Very low43.1Very low122 Ų122131.9 Ų131.965%0.65278%0.776SS**  trans100.9144.1161.3-15238.9000121.1
308S41.2Very low42.2Very low101 Ų101128.6 Ų128.671%0.70678%0.778SS**  trans24.4136.9158.660.50000124
309G33Very low41.2Very low73 Ų73131.1 Ų131.175%0.75379%0.794SS**  trans152.691.7155.400000121.5
310S34.8Very low40.3Very low106 Ų106127 Ų12774%0.74178%0.784SS**  trans30.7129.3136.663.30000126.8
311T36Very low39.2Very low145 Ų145126.4 Ų126.489%0.8978%0.781SS**  71.7138.3129.156.80000126.1
312G31.7Very low38.1Very low81 Ų81126 Ų12684%0.83578%0.78SS**  trans109.3145.4157.500000115.5
313S34.4Very low37.3Very low124 Ų124125.9 Ų125.987%0.86778%0.777SS**  cis-158.8176.7-7.8-169.10000111
314S35.7Very low36.5Very low100 Ų100124.7 Ų124.770%0.69978%0.775SS**  trans-82.3161.8-167.159.90000118.5
315I35.4Very low35.8Very low174 Ų174122.6 Ų122.689%0.89277%0.774SS**  trans-134.6144.8149.7-65.3-173.9000112
316K38Very low35.3Very low194 Ų194120.1 Ų120.184%0.84377%0.769SS**  trans-124.9170.5178.7-87.6-173.8171.7-176.80109.8
317A33.2Very low34.7Very low89 Ų89122.4 Ų122.474%0.73677%0.771SS**  cis176.9158.2-27.800000107.3
318S31.8Very low34.5Very low129 Ų129122.8 Ų122.890%0.90278%0.778SS**  trans-157.6146.8166.258.70000114.9
319A34.8Very low34.3Very low100 Ų100125.4 Ų125.483%0.82678%0.782SS**  trans-158.7148.2176.100000111
320A31.6Very low34.7Very low89 Ų89128.4 Ų128.474%0.73678%0.781SS**  trans-174.9135.5160.300000106.9
321L32.1Very low34.9Very low148 Ų148130.4 Ų130.478%0.77578%0.783SS**  63.3135.250.5-76.391.6000113.4
322D33.9Very low35.2Very low131 Ų131134.6 Ų134.670%0.70180%0.8SS**  cis-165.9160.2-4.7-126.8-1.2000112.4
323V35.6Very low35.4Very low117 Ų117137.3 Ų137.371%0.70980%0.798SS**  trans49.3139.5143.9179.80000124.4
324I32.8Very low35.4Very low159 Ų159138 Ų13882%0.81579%0.794SS**  trans153.4119.5143-78.7156.7000106.3
325S31.3Very low35.4Very low93 Ų93140.1 Ų140.165%0.6580%0.799SS**  cis88.1119.340.9-149.30000115.5
326D34.7Very low35.4Very low127 Ų127138.1 Ų138.168%0.67979%0.794SS**  trans80105.5153.8-6821.3000124.2
327Q36.4Very low35.2Very low169 Ų169134.6 Ų134.679%0.7979%0.791SS**  70.9160.7120.3-64.6-167.9200123.1
328V35.5Very low35.4Very low129 Ų129137.7 Ų137.778%0.78280%0.795SS**  trans95.1126.6165.31790000115.6
329I37.9Very low35.6Very low156 Ų156138.3 Ų138.380%0.879%0.787SS**  cis-151.8165.4-10.5-114.6174.2000109.8
330D41.3Very low35.7Very low137 Ų137141.2 Ų141.273%0.73378%0.784SS**  trans-69.7166.7176.8-105.1-45.7000117.4
331L39.6Very low36Very low148 Ų148145.6 Ų145.678%0.77579%0.788SS**  trans62.4114.4149.2-66.9159.4000121.2
332D41.3Very low36.4Very low233 Ų233145.4 Ų145.4100%1.24679%0.789SS**  -159.4089.5-103.6-16.1000110.7

Retrieved 332 of 332 residues in 99.8 ms (Link to these results)

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