A0A077ZEY2_TRITR Loading...

Solute carrier family 25 2

AlphaFold DB , UniProt , Accession A0A077ZEY2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 286 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
1M72.5Confident89.9Confident222 Ų22254.8 Ų54.8100%1.09436%0.362SS*.  0-51.90-66.5-173178.400113.6A3 G4 A5M1-A3 PolarHBondContact O-N 2.86Å; M1-G4 PolarHBondContact O-N 3.14Å; M1-G4 VanDerWaalsContact O-N 3.16Å; M1-A5 PolarHBondContact O-N 3.34Å; M1-A5 VanDerWaalsContact O-N 3.16Å
2A85.6Confident90.3Very high80 Ų8057 Ų5766%0.66136%0.361SS*.Hα-helixtrans-55-44-178.100000114G4 A5 L6A2-G4 VanDerWaalsContact C-N 3.34Å; A2-G4 PolarHBondContact O-N 3.02Å; A2-A5 PolarHBondContact O-N 2.94Å; A2-L6 WeakPolarHBondContact O-CB 3.2Å; A2-L6 PolarHBondContact O-N 3.16Å
3A88.8Confident90.7Very high9 Ų956.2 Ų56.27%0.07436%0.356CS..Hα-helixtrans-58.6-42177.800000113.1M1 A7 Y264 L267 V268 L271M1-A3 PolarHBondContact O-N 2.86Å; A3-A7 WeakPolarHBondContact O-CB 3.22Å; A3-A7 PolarHBondContact O-N 3.08Å; A3-Y264 HydrophobicContact CB-CD2 4.1Å; A3-Y264 HydrophobicContact CB-CE2 4.17Å; A3-L267 HydrophobicContact CB-CB 3.88Å; A3-L267 HydrophobicContact CB-CD1 4.29Å; A3-V268 HydrophobicContact CB-CG2 4.3Å; A3-L271 HydrophobicContact CB-CD1 4.12Å
4G88.7Confident91.1Very high35 Ų3556.6 Ų56.636%0.36136%0.357SS..Hα-helixtrans-68.5-40.117800000113M1 A2 A7 G8M1-G4 PolarHBondContact O-N 3.14Å; M1-G4 VanDerWaalsContact O-N 3.16Å; A2-G4 VanDerWaalsContact C-N 3.34Å; A2-G4 PolarHBondContact O-N 3.02Å; G4-A7 PolarHBondContact O-N 2.71Å; G4-G8 PolarHBondContact O-N 3.2Å
5A88.6Confident91.5Very high63 Ų6353.5 Ų53.552%0.52134%0.337SS..Hα-helixtrans-63.7-44.5175.800000111.6M1 A2 G8 A9M1-A5 PolarHBondContact O-N 3.34Å; M1-A5 VanDerWaalsContact O-N 3.16Å; A2-A5 PolarHBondContact O-N 2.94Å; A5-G8 PolarHBondContact O-N 3.49Å; A5-A9 PolarHBondContact O-N 3.05Å
6L92.2Very high91.8Very high87 Ų8750.7 Ų50.746%0.45532%0.32SS..Hα-helixtrans-66.5-44.3177.2-17657.3000111.6A2 G8 A9 V10 L267A2-L6 WeakPolarHBondContact O-CB 3.2Å; A2-L6 PolarHBondContact O-N 3.16Å; L6-G8 VanDerWaalsContact C-N 3.31Å; L6-G8 PolarHBondContact O-N 2.7Å; L6-A9 WeakPolarHBondContact O-CB 3.19Å; L6-A9 PolarHBondContact O-N 2.93Å; L6-A9 VanDerWaalsContact O-N 3.09Å; L6-V10 HydrophobicContact CD1-CG2 4.27Å; L6-V10 HydrophobicContact CG-CG2 4.47Å; L6-V10 WeakPolarHBondContact O-CG2 3.29Å; L6-V10 PolarHBondContact O-N 3.38Å; L6-L267 HydrophobicContact CB-CD1 3.82Å; L6-L267 HydrophobicContact CD2-CD1 3.63Å; L6-L267 HydrophobicContact CD2-CD2 3.8Å; L6-L267 HydrophobicContact CD2-CG 4.38Å; L6-L267 HydrophobicContact CG-CD1 3.81Å
7A94.1Very high92.1Very high0 Ų048.6 Ų48.60%031%0.307CS..Hα-helixtrans-56.3-44.617400000112.3A3 G4 A9 V10 A11 S260 T263A3-A7 WeakPolarHBondContact O-CB 3.22Å; A3-A7 PolarHBondContact O-N 3.08Å; G4-A7 PolarHBondContact O-N 2.71Å; A7-A9 PolarHBondContact O-N 3.22Å; A7-V10 PolarHBondContact O-N 3.27Å; A7-A11 VanDerWaalsContact O-CB 3.31Å; A7-A11 WeakPolarHBondContact O-CB 2.93Å; A7-A11 PolarHBondContact O-N 3.42Å; A7-S260 WeakPolarHBondContact CB-O 3.33Å; A7-T263 HydrophobicContact CB-CG2 4.07Å
8G92.7Very high92.3Very high23 Ų2347.4 Ų47.424%0.23730%0.298CS..Hα-helixtrans-64.7-36.217500000113.6G4 A5 L6 K12G4-G8 PolarHBondContact O-N 3.2Å; A5-G8 PolarHBondContact O-N 3.49Å; L6-G8 VanDerWaalsContact C-N 3.31Å; L6-G8 PolarHBondContact O-N 2.7Å; G8-K12 WeakPolarHBondContact O-CB 3.47Å; G8-K12 VanDerWaalsContact O-CG 3.28Å; G8-K12 WeakPolarHBondContact O-CG 3.21Å; G8-K12 PolarHBondContact O-N 3.1Å
9A93.6Very high92.5Very high26 Ų2646.5 Ų46.522%0.21529%0.291CS..Hα-helixtrans-68.9-42.9176.200000112.2A5 L6 A7 K12 T13 M61A5-A9 PolarHBondContact O-N 3.05Å; L6-A9 WeakPolarHBondContact O-CB 3.19Å; L6-A9 PolarHBondContact O-N 2.93Å; L6-A9 VanDerWaalsContact O-N 3.09Å; A7-A9 PolarHBondContact O-N 3.22Å; A9-K12 PolarHBondContact O-N 3.31Å; A9-T13 WeakPolarHBondContact O-CB 3.47Å; A9-T13 PolarHBondContact O-N 3.42Å; A9-T13 PolarHBondContact O-OG1 2.92Å; A9-M61 HydrophobicContact CB-SD 3.91Å
10V95.4Very high92.7Very high52 Ų5244.7 Ų44.732%0.31528%0.278SS..Hα-helixtrans-64.2-45.1175.6173.80000110.6L6 A7 K12 T13 T14 V259 T263L6-V10 HydrophobicContact CD1-CG2 4.27Å; L6-V10 HydrophobicContact CG-CG2 4.47Å; L6-V10 WeakPolarHBondContact O-CG2 3.29Å; L6-V10 PolarHBondContact O-N 3.38Å; A7-V10 PolarHBondContact O-N 3.27Å; V10-K12 PolarHBondContact O-N 3.49Å; V10-T13 PolarHBondContact O-N 3.14Å; V10-T14 WeakPolarHBondContact O-CB 3.32Å; V10-T14 PolarHBondContact O-N 3.09Å; V10-T14 PolarHBondContact O-OG1 3.41Å; V10-V259 HydrophobicContact CG1-CG1 3.85Å; V10-T263 HydrophobicContact CB-CG2 4.12Å; V10-T263 HydrophobicContact CG1-CG2 4.33Å; V10-T263 HydrophobicContact CG2-CG2 4.08Å
11A96.3Very high92.8Very high6 Ų642.6 Ų42.65%0.0527%0.265CS..Hα-helixtrans-58.7-49.6176.100000112.1A7 T13 T14 I15 A256 V259A7-A11 VanDerWaalsContact O-CB 3.31Å; A7-A11 WeakPolarHBondContact O-CB 2.93Å; A7-A11 PolarHBondContact O-N 3.42Å; A11-T13 VanDerWaalsContact C-N 3.34Å; A11-T13 PolarHBondContact O-N 2.88Å; A11-T14 WeakPolarHBondContact O-CB 3.28Å; A11-T14 PolarHBondContact O-N 3.39Å; A11-I15 WeakPolarHBondContact O-CG1 3.44Å; A11-I15 PolarHBondContact O-N 2.95Å; A11-I15 VanDerWaalsContact O-N 3.13Å; A11-A256 HydrophobicContact CB-CB 4.43Å; A11-A256 VanDerWaalsContact CB-O 3.32Å; A11-A256 WeakPolarHBondContact CB-O 3.45Å; A11-V259 HydrophobicContact CB-CB 4.39Å; A11-V259 HydrophobicContact CB-CG1 4.23Å
12K94.6Very high94Very high81 Ų8132.6 Ų32.635%0.35222%0.216SC..Hα-helixtrans-60.8-41.2176.9-77172.7-177.3171.20112.5G8 A9 V10 T14 I15 A16 T60 M61G8-K12 WeakPolarHBondContact O-CB 3.47Å; G8-K12 VanDerWaalsContact O-CG 3.28Å; G8-K12 WeakPolarHBondContact O-CG 3.21Å; G8-K12 PolarHBondContact O-N 3.1Å; A9-K12 PolarHBondContact O-N 3.31Å; V10-K12 PolarHBondContact O-N 3.49Å; K12-T14 VanDerWaalsContact C-N 3.35Å; K12-I15 PolarHBondContact O-N 2.77Å; K12-A16 PolarHBondContact O-N 2.92Å; K12-A16 VanDerWaalsContact O-N 3.09Å; K12-T60 HydrophobicContact CD-CG2 4.23Å; K12-M61 HydrophobicContact CB-CE 3.55Å; K12-M61 HydrophobicContact CD-CE 3.91Å; K12-M61 HydrophobicContact CG-CE 4.39Å
13T95.9Very high94.5Very high47 Ų4729 Ų2929%0.28819%0.185SC..Hα-helixtrans-64.8-42.2177-640000110.8A9 V10 A11 I15 A16 Y54 N57A9-T13 WeakPolarHBondContact O-CB 3.47Å; A9-T13 PolarHBondContact O-N 3.42Å; A9-T13 PolarHBondContact O-OG1 2.92Å; V10-T13 PolarHBondContact O-N 3.14Å; A11-T13 VanDerWaalsContact C-N 3.34Å; A11-T13 PolarHBondContact O-N 2.88Å; T13-I15 VanDerWaalsContact C-N 3.34Å; T13-I15 PolarHBondContact O-N 3.16Å; T13-A16 VanDerWaalsContact O-CB 3.28Å; T13-A16 WeakPolarHBondContact O-CB 3.36Å; T13-A16 PolarHBondContact O-N 3.17Å; T13-A16 VanDerWaalsContact O-N 3.16Å; T13-Y54 HydrophobicContact CG2-CD1 4.28Å; T13-Y54 HydrophobicContact CG2-CE1 4.08Å; T13-Y54 VanDerWaalsContact O-CE1 3.25Å; T13-Y54 WeakPolarHBondContact O-CE1 3.44Å; T13-N57 PolarHBondContact OG1-ND2 3.2Å; T13-N57 VanDerWaalsContact OG1-ND2 3.12Å
14T96.4Very high94.9Very high61 Ų6130 Ų3037%0.37419%0.189SC..Hα-helixtrans-60.5-42.1179.2-57.10000112.1V10 A11 K12 I255 V259V10-T14 WeakPolarHBondContact O-CB 3.32Å; V10-T14 PolarHBondContact O-N 3.09Å; V10-T14 PolarHBondContact O-OG1 3.41Å; A11-T14 WeakPolarHBondContact O-CB 3.28Å; A11-T14 PolarHBondContact O-N 3.39Å; K12-T14 VanDerWaalsContact C-N 3.35Å; T14-I255 HydrophobicContact CG2-CG2 4.28Å; T14-V259 HydrophobicContact CG2-CG2 3.99Å
15I96.5Very high95.3Very high10 Ų1029 Ų295%0.05118%0.175CC..THydrogen-bonded Turntrans-87.4-0.4179.266.1155.4000114.3A11 K12 T13 P17 L18 D19 K252 I255 A256A11-I15 WeakPolarHBondContact O-CG1 3.44Å; A11-I15 PolarHBondContact O-N 2.95Å; A11-I15 VanDerWaalsContact O-N 3.13Å; K12-I15 PolarHBondContact O-N 2.77Å; T13-I15 VanDerWaalsContact C-N 3.34Å; T13-I15 PolarHBondContact O-N 3.16Å; I15-P17 VanDerWaalsContact C-CD 3.5Å; I15-L18 WeakPolarHBondContact O-CB 3.18Å; I15-L18 PolarHBondContact O-N 3.02Å; I15-D19 PolarHBondContact O-N 3.28Å; I15-K252 HydrophobicContact CB-CB 4.26Å; I15-K252 HydrophobicContact CD1-CB 4.23Å; I15-K252 HydrophobicContact CD1-CG 4.27Å; I15-K252 HydrophobicContact CG2-CB 4.3Å; I15-I255 HydrophobicContact CG2-CB 4.12Å; I15-I255 HydrophobicContact CG2-CG2 3.81Å; I15-A256 HydrophobicContact CD1-CB 4.08Å; I15-A256 HydrophobicContact CG1-CB 4.47Å; I15-A256 HydrophobicContact CG2-CB 3.98Å
16A96.5Very high95.8Very high9 Ų926 Ų267%0.07415%0.15CC..Hα-helixtrans-57.3-39.2-175.100000114.1K12 T13 L18 D19 R20 Y54 N57K12-A16 PolarHBondContact O-N 2.92Å; K12-A16 VanDerWaalsContact O-N 3.09Å; T13-A16 VanDerWaalsContact O-CB 3.28Å; T13-A16 WeakPolarHBondContact O-CB 3.36Å; T13-A16 PolarHBondContact O-N 3.17Å; T13-A16 VanDerWaalsContact O-N 3.16Å; A16-L18 VanDerWaalsContact C-N 3.3Å; A16-L18 PolarHBondContact O-N 3.28Å; A16-D19 PolarHBondContact O-N 2.67Å; A16-R20 WeakPolarHBondContact O-CB 3.41Å; A16-R20 PolarHBondContact O-N 3.41Å; A16-Y54 HydrophobicContact CB-CD1 3.98Å; A16-Y54 HydrophobicContact CB-CE1 4.47Å; A16-N57 HydrophobicContact CB-CB 3.82Å
17P96.6Very high96Very high15 Ų1522.6 Ų22.610%0.09713%0.133CC..Hα-helixtrans-60.5-36.9173.5-26.837.5000113.5I15 T21 L41 L53 Y54I15-P17 VanDerWaalsContact C-CD 3.5Å; P17-T21 WeakPolarHBondContact O-CB 3.4Å; P17-T21 PolarHBondContact O-N 2.98Å; P17-T21 PolarHBondContact O-OG1 3.27Å; P17-L41 HydrophobicContact CB-CD2 3.82Å; P17-L53 HydrophobicContact CB-CB 4.11Å; P17-L53 HydrophobicContact CG-CB 4.1Å; P17-Y54 HydrophobicContact CG-CD1 4.46Å; P17-Y54 HydrophobicContact CG-CD2 4.48Å; P17-Y54 HydrophobicContact CG-CE1 4.03Å; P17-Y54 HydrophobicContact CG-CE2 4.01Å
18L96.6Very high96Very high28 Ų2824.5 Ų24.515%0.14715%0.146CC..Hα-helixtrans-71.3-42.9177.9-58.3-178000111.1I15 A16 T21 K22 L41 M248 I251 K252 I255I15-L18 WeakPolarHBondContact O-CB 3.18Å; I15-L18 PolarHBondContact O-N 3.02Å; A16-L18 VanDerWaalsContact C-N 3.3Å; A16-L18 PolarHBondContact O-N 3.28Å; L18-T21 PolarHBondContact O-N 2.99Å; L18-K22 WeakPolarHBondContact O-CB 3.26Å; L18-K22 PolarHBondContact O-N 3.29Å; L18-L41 HydrophobicContact CD2-CD1 4.12Å; L18-M248 HydrophobicContact CB-CG 4.41Å; L18-M248 HydrophobicContact CB-SD 3.87Å; L18-M248 HydrophobicContact CD2-SD 3.95Å; L18-M248 HydrophobicContact CG-SD 4.33Å; L18-I251 HydrophobicContact CD1-CG2 4.19Å; L18-K252 HydrophobicContact CB-CB 4.32Å; L18-K252 HydrophobicContact CD1-CB 4.06Å; L18-I255 HydrophobicContact CD1-CD1 4.02Å
19D95.5Very high95.9Very high30 Ų3027.8 Ų27.816%0.1617%0.166CC..Hα-helixtrans-59.7-45.3173.3-91-10.2000111.3I15 A16 T21 K22 I23 K252I15-D19 PolarHBondContact O-N 3.28Å; A16-D19 PolarHBondContact O-N 2.67Å; D19-T21 VanDerWaalsContact C-N 3.34Å; D19-T21 PolarHBondContact O-N 3.49Å; D19-K22 WeakPolarHBondContact O-CB 3.24Å; D19-K22 PolarHBondContact O-N 2.71Å; D19-I23 WeakPolarHBondContact O-CG1 3.5Å; D19-I23 PolarHBondContact O-N 2.98Å; D19-K252 VanDerWaalsContact OD1-CD 3.31Å; D19-K252 WeakPolarHBondContact OD1-CD 3.31Å; D19-K252 VanDerWaalsContact OD1-CE 3.29Å; D19-K252 WeakPolarHBondContact OD1-CE 3.3Å; D19-K252 IonicContact OD1-NZ 3.4Å; D19-K252 PolarHBondContact OD1-NZ 2.69Å
20R96.1Very high95.9Very high10 Ų1029.6 Ų29.64%0.03817%0.174CC..Hα-helixtrans-61-45.1176.8-177.2177.2-179.3-138.6-3.3111.2A16 I23 N24 T44 T52 L53 S121A16-R20 WeakPolarHBondContact O-CB 3.41Å; A16-R20 PolarHBondContact O-N 3.41Å; R20-I23 PolarHBondContact O-N 3.45Å; R20-N24 PolarHBondContact O-N 2.94Å; R20-N24 VanDerWaalsContact O-N 3.08Å; R20-N24 PolarHBondContact O-ND2 3.47Å; R20-T44 VanDerWaalsContact NH1-CG2 3.27Å; R20-T52 VanDerWaalsContact NH1-CG2 3.25Å; R20-T52 PolarHBondContact NH1-O 2.94Å; R20-L53 WeakPolarHBondContact CD-O 3.5Å; R20-S121 WeakPolarHBondContact CG-O 3.31Å; R20-S121 PolarHBondContact NE-O 2.65Å
21T96.6Very high95.8Very high0 Ų033.7 Ų33.70%018%0.184CC..Hα-helixtrans-60.3-47.8177.8-59.30000110.7P17 L18 D19 I23 N24 F25 A37 F40 L41 M248P17-T21 WeakPolarHBondContact O-CB 3.4Å; P17-T21 PolarHBondContact O-N 2.98Å; P17-T21 PolarHBondContact O-OG1 3.27Å; L18-T21 PolarHBondContact O-N 2.99Å; D19-T21 VanDerWaalsContact C-N 3.34Å; D19-T21 PolarHBondContact O-N 3.49Å; T21-I23 PolarHBondContact O-N 3.27Å; T21-N24 PolarHBondContact O-N 2.86Å; T21-F25 HydrophobicContact CG2-CD2 3.97Å; T21-F25 HydrophobicContact CG2-CE2 3.94Å; T21-F25 WeakPolarHBondContact O-CD2 3.21Å; T21-F25 PolarHBondContact O-N 2.85Å; T21-F25 VanDerWaalsContact O-N 3.12Å; T21-A37 HydrophobicContact CG2-CB 3.77Å; T21-F40 HydrophobicContact CG2-CB 4.47Å; T21-F40 HydrophobicContact CG2-CD1 3.71Å; T21-F40 HydrophobicContact CG2-CE1 4.4Å; T21-F40 HydrophobicContact CG2-CG 4.37Å; T21-F40 WeakPolarHBondContact OG1-CD1 3.28Å; T21-L41 WeakPolarHBondContact OG1-CD2 3.46Å; T21-L41 WeakPolarHBondContact OG1-CG 3.36Å; T21-M248 HydrophobicContact CG2-CE 4.21Å
22K96.9Very high95.8Very high13 Ų1334.7 Ų34.76%0.05719%0.186CC..Hα-helixtrans-52.7-54.3176.3-173.3-168.2171-162.20111.3L18 D19 N24 F25 Q26 Y205 D208 M248 N249L18-K22 WeakPolarHBondContact O-CB 3.26Å; L18-K22 PolarHBondContact O-N 3.29Å; D19-K22 WeakPolarHBondContact O-CB 3.24Å; D19-K22 PolarHBondContact O-N 2.71Å; K22-N24 VanDerWaalsContact C-N 3.31Å; K22-N24 PolarHBondContact O-N 3.25Å; K22-F25 PolarHBondContact O-N 2.99Å; K22-F25 VanDerWaalsContact O-N 3.16Å; K22-Q26 HydrophobicContact CG-CG 4.26Å; K22-Q26 WeakPolarHBondContact O-CG 3.36Å; K22-Q26 PolarHBondContact O-N 3.08Å; K22-Y205 WeakPolarHBondContact CE-OH 3.31Å; K22-D208 IonicContact NZ-OD2 2.63Å; K22-D208 PolarHBondContact NZ-OD2 3.17Å; K22-M248 HydrophobicContact CB-CB 4.24Å; K22-M248 HydrophobicContact CB-CG 3.94Å; K22-M248 HydrophobicContact CG-CB 4.24Å; K22-M248 HydrophobicContact CG-CG 4.45Å; K22-N249 WeakPolarHBondContact CD-OD1 3.25Å; K22-N249 VanDerWaalsContact CE-OD1 3.26Å; K22-N249 WeakPolarHBondContact CE-OD1 3.25Å; K22-N249 PolarHBondContact NZ-OD1 3.21Å
23I96.6Very high95.9Very high5 Ų533.4 Ų33.43%0.02619%0.186CC..Hα-helixtrans-62.1-40.2-175.8-62.2168.4000110.8D19 R20 T21 F25 Q26 V27 V122D19-I23 WeakPolarHBondContact O-CG1 3.5Å; D19-I23 PolarHBondContact O-N 2.98Å; R20-I23 PolarHBondContact O-N 3.45Å; T21-I23 PolarHBondContact O-N 3.27Å; I23-F25 VanDerWaalsContact C-N 3.33Å; I23-F25 PolarHBondContact O-N 2.89Å; I23-Q26 PolarHBondContact O-N 3.1Å; I23-V27 HydrophobicContact CG2-CG2 4.32Å; I23-V27 WeakPolarHBondContact O-CB 3.12Å; I23-V27 VanDerWaalsContact O-CG2 3.29Å; I23-V27 WeakPolarHBondContact O-CG2 3.4Å; I23-V27 PolarHBondContact O-N 2.62Å; I23-V27 VanDerWaalsContact O-N 3.15Å; I23-V122 HydrophobicContact CB-CG1 4.5Å; I23-V122 HydrophobicContact CG2-CG1 3.57Å
24N97.1Very high95.8Very high29 Ų2934.8 Ų34.816%0.15519%0.191CC..Hα-helixtrans-59.8-42.6176.6-85.4-89.9000112R20 T21 K22 S28 F40 S121R20-N24 PolarHBondContact O-N 2.94Å; R20-N24 VanDerWaalsContact O-N 3.08Å; R20-N24 PolarHBondContact O-ND2 3.47Å; T21-N24 PolarHBondContact O-N 2.86Å; K22-N24 VanDerWaalsContact C-N 3.31Å; K22-N24 PolarHBondContact O-N 3.25Å; N24-S28 WeakPolarHBondContact O-CB 3.33Å; N24-S28 PolarHBondContact O-N 2.91Å; N24-F40 HydrophobicContact CB-CE1 4.35Å; N24-F40 HydrophobicContact CB-CE2 3.98Å; N24-F40 HydrophobicContact CB-CZ 3.74Å; N24-F40 VanDerWaalsContact CG-CZ 3.47Å; N24-S121 PolarHBondContact ND2-O 3.38Å
25F97.4Very high95.9Very high13 Ų1333.5 Ų33.56%0.05719%0.19CC..Hα-helixtrans-69.5-43.4175.3-82.3-82.5000112.6T21 K22 I23 V27 S28 T30 Y32 R36 A37 F40 K244T21-F25 HydrophobicContact CG2-CD2 3.97Å; T21-F25 HydrophobicContact CG2-CE2 3.94Å; T21-F25 WeakPolarHBondContact O-CD2 3.21Å; T21-F25 PolarHBondContact O-N 2.85Å; T21-F25 VanDerWaalsContact O-N 3.12Å; K22-F25 PolarHBondContact O-N 2.99Å; K22-F25 VanDerWaalsContact O-N 3.16Å; I23-F25 VanDerWaalsContact C-N 3.33Å; I23-F25 PolarHBondContact O-N 2.89Å; F25-V27 PolarHBondContact O-N 3.22Å; F25-V27 VanDerWaalsContact O-N 3.15Å; F25-S28 PolarHBondContact O-N 3.49Å; F25-T30 HydrophobicContact CE1-CG2 4.02Å; F25-Y32 HydrophobicContact CB-CD2 3.91Å; F25-Y32 HydrophobicContact CD1-CD2 4.03Å; F25-Y32 HydrophobicContact CD1-CG 4.48Å; F25-Y32 AromaticContact CD2-CD2 3.98Å; F25-Y32 HydrophobicContact CD2-CD2 3.98Å; F25-Y32 AromaticContact CG-CD2 3.7Å; F25-Y32 HydrophobicContact CG-CD2 3.7Å; F25-Y32 HydrophobicContact CG-CG 4.48Å; F25-R36 HydrophobicContact CE1-CB 4.14Å; F25-R36 HydrophobicContact CZ-CB 3.85Å; F25-A37 HydrophobicContact CE2-CB 4.35Å; F25-F40 HydrophobicContact CE2-CB 3.91Å; F25-F40 HydrophobicContact CE2-CG 4.24Å; F25-F40 HydrophobicContact CZ-CB 4.32Å; F25-K244 HydrophobicContact CB-CD 4.43Å; F25-K244 WeakPolarHBondContact O-CD 3.45Å
26Q97.4Very high95.9Very high0 Ų037.6 Ų37.60%021%0.205CC..Hα-helixtrans-57-32.5179.9-71.8-176.9-6400113K22 I23 Y205 D208 I209 R212 R213 K244K22-Q26 HydrophobicContact CG-CG 4.26Å; K22-Q26 WeakPolarHBondContact O-CG 3.36Å; K22-Q26 PolarHBondContact O-N 3.08Å; I23-Q26 PolarHBondContact O-N 3.1Å; Q26-Y205 PolarHBondContact NE2-OH 3.17Å; Q26-Y205 VanDerWaalsContact NE2-OH 3.13Å; Q26-D208 PolarHBondContact NE2-OD2 3.22Å; Q26-I209 HydrophobicContact CB-CD1 3.75Å; Q26-I209 HydrophobicContact CG-CD1 3.54Å; Q26-R212 HydrophobicContact CB-CB 4.3Å; Q26-R212 HydrophobicContact CB-CG 4.39Å; Q26-R213 PolarHBondContact O-NE 3.37Å; Q26-R213 PolarHBondContact O-NH2 2.99Å; Q26-K244 WeakPolarHBondContact CG-O 3.39Å
27V96.7Very high95.9Very high16 Ų1637.3 Ų37.310%0.09720%0.202CC..Hα-helixtrans-91.2-30.3-176.3172.40000112.4I23 F25 V122 R212 T216 V218I23-V27 HydrophobicContact CG2-CG2 4.32Å; I23-V27 WeakPolarHBondContact O-CB 3.12Å; I23-V27 VanDerWaalsContact O-CG2 3.29Å; I23-V27 WeakPolarHBondContact O-CG2 3.4Å; I23-V27 PolarHBondContact O-N 2.62Å; I23-V27 VanDerWaalsContact O-N 3.15Å; F25-V27 PolarHBondContact O-N 3.22Å; F25-V27 VanDerWaalsContact O-N 3.15Å; V27-V122 HydrophobicContact CB-CG1 4.36Å; V27-V122 HydrophobicContact CG2-CG1 4.28Å; V27-R212 HydrophobicContact CG2-CB 3.83Å; V27-T216 HydrophobicContact CG1-CG2 4.38Å; V27-T216 WeakPolarHBondContact CG1-OG1 3.37Å; V27-T216 HydrophobicContact CG2-CG2 3.81Å; V27-T216 WeakPolarHBondContact CG2-OG1 3.27Å; V27-V218 HydrophobicContact CG1-CB 4.15Å; V27-V218 HydrophobicContact CG1-CG1 3.28Å; V27-V218 HydrophobicContact CG1-CG2 3.77Å
28S93.9Very high95.9Very high40 Ų4042.6 Ų42.628%0.2822%0.224SC..SBendtrans-78.4151.8176.4-176.40000111.8N24 F25 T30 K244N24-S28 WeakPolarHBondContact O-CB 3.33Å; N24-S28 PolarHBondContact O-N 2.91Å; F25-S28 PolarHBondContact O-N 3.49Å; S28-T30 PolarHBondContact O-N 3.03Å; S28-T30 WeakPolarHBondContact OG-CB 3.19Å; S28-T30 PolarHBondContact OG-N 3.44Å; S28-T30 VanDerWaalsContact OG-N 3.08Å; S28-T30 PolarHBondContact OG-OG1 2.84Å; S28-K244 PolarHBondContact O-NZ 3.4Å
29S91.2Very high96Very high92 Ų9246.8 Ų46.864%0.64324%0.237SC*.SBendtrans-70.8-13.7166.354.50000112.8R31 K244S29-R31 PolarHBondContact O-N 2.8Å; S29-K244 PolarHBondContact O-NZ 3.3Å
30T93.5Very high96Very high64 Ų6447.5 Ų47.539%0.39324%0.239SC..SBendtrans-57.7129.7-179-52.50000111.8F25 S28 Y32 K244F25-T30 HydrophobicContact CE1-CG2 4.02Å; S28-T30 PolarHBondContact O-N 3.03Å; S28-T30 WeakPolarHBondContact OG-CB 3.19Å; S28-T30 PolarHBondContact OG-N 3.44Å; S28-T30 VanDerWaalsContact OG-N 3.08Å; S28-T30 PolarHBondContact OG-OG1 2.84Å; T30-Y32 PolarHBondContact O-N 3.01Å; T30-K244 PolarHBondContact O-NZ 3.28Å; T30-K244 VanDerWaalsContact O-NZ 3.11Å
31R94Very high96Very high138 Ų13848.4 Ų48.452%0.52125%0.245SC..PPolyproline II helixtrans-62.9127.7174178.7-178.2-172-169.42110.4S29 R36 H240S29-R31 PolarHBondContact O-N 2.8Å; R31-R36 WeakPolarHBondContact O-CD 3.46Å; R31-R36 PolarHBondContact O-NH1 2.93Å; R31-H240 PolarHBondContact NE-CD2 2.76Å; R31-H240 PolarHBondContact NE-NE2 2.98Å; R31-H240 VanDerWaalsContact NE-NE2 3.17Å; R31-H240 PolarHBondContact NH2-CE1 3.08Å; R31-H240 PolarHBondContact NH2-NE2 3.39Å
32Y96.2Very high96.1Very high27 Ų2755.3 Ų55.311%0.10627%0.271CS..PPolyproline II helixtrans-81.3134.8178.4171.2-90.8000111.5F25 T30 L34 A37 S247 M248F25-Y32 HydrophobicContact CB-CD2 3.91Å; F25-Y32 HydrophobicContact CD1-CD2 4.03Å; F25-Y32 HydrophobicContact CD1-CG 4.48Å; F25-Y32 AromaticContact CD2-CD2 3.98Å; F25-Y32 HydrophobicContact CD2-CD2 3.98Å; F25-Y32 AromaticContact CG-CD2 3.7Å; F25-Y32 HydrophobicContact CG-CD2 3.7Å; F25-Y32 HydrophobicContact CG-CG 4.48Å; T30-Y32 PolarHBondContact O-N 3.01Å; Y32-L34 WeakPolarHBondContact OH-CD2 3.5Å; Y32-A37 HydrophobicContact CE2-CB 3.98Å; Y32-S247 VanDerWaalsContact CE1-OG 3.25Å; Y32-S247 WeakPolarHBondContact CE1-OG 3.28Å; Y32-S247 PolarHBondContact OH-OG 3.16Å; Y32-S247 VanDerWaalsContact OH-OG 3.1Å; Y32-M248 HydrophobicContact CE2-CE 4.18Å; Y32-M248 PolarHBondContact OH-N 2.88Å
33T96.3Very high96.1Very high55 Ų5557.1 Ų57.134%0.33728%0.281SS..  trans-144.7158.1163.267.10000108.2G35 R36 A37T33-G35 VanDerWaalsContact C-N 3.3Å; T33-G35 PolarHBondContact O-N 3.08Å; T33-R36 PolarHBondContact O-N 3.4Å; T33-R36 VanDerWaalsContact O-N 3.11Å; T33-R36 WeakPolarHBondContact OG1-CB 3.15Å; T33-R36 WeakPolarHBondContact OG1-CG 3.38Å; T33-R36 PolarHBondContact OG1-N 3.12Å; T33-R36 VanDerWaalsContact OG1-N 3.16Å; T33-A37 PolarHBondContact O-N 2.91Å
34L95.1Very high96Very high76 Ų7657.4 Ų57.440%0.39828%0.283SS..Hα-helixtrans-58.2-43.3176.7-69.2176.6000111.8Y32 R36 A37 F38 I251Y32-L34 WeakPolarHBondContact OH-CD2 3.5Å; L34-R36 VanDerWaalsContact C-N 3.3Å; L34-R36 PolarHBondContact O-N 3.35Å; L34-A37 WeakPolarHBondContact O-CB 3.19Å; L34-A37 PolarHBondContact O-N 2.97Å; L34-A37 VanDerWaalsContact O-N 3.1Å; L34-F38 WeakPolarHBondContact O-CD2 3.41Å; L34-F38 PolarHBondContact O-N 2.84Å; L34-I251 HydrophobicContact CD1-CD1 4.39Å; L34-I251 HydrophobicContact CD2-CD1 3.41Å; L34-I251 VanDerWaalsContact CD2-CD1 3.41Å
35G96.7Very high95.9Very high34 Ų3462.2 Ų62.235%0.35130%0.3SS..Hα-helixtrans-60-36.8175.600000113.4T33 R39T33-G35 VanDerWaalsContact C-N 3.3Å; T33-G35 PolarHBondContact O-N 3.08Å; G35-R39 WeakPolarHBondContact O-CG 3.47Å; G35-R39 PolarHBondContact O-N 3.37Å; G35-R39 PolarHBondContact O-NH1 3.44Å
36R96.9Very high95.9Very high96 Ų9665.8 Ų65.836%0.36233%0.327SS..Hα-helixtrans-72.3-34.1174.1-75.5178.4178.8-174.9-1.5112.6F25 R31 T33 L34 R39 F40F25-R36 HydrophobicContact CE1-CB 4.14Å; F25-R36 HydrophobicContact CZ-CB 3.85Å; R31-R36 WeakPolarHBondContact O-CD 3.46Å; R31-R36 PolarHBondContact O-NH1 2.93Å; T33-R36 PolarHBondContact O-N 3.4Å; T33-R36 VanDerWaalsContact O-N 3.11Å; T33-R36 WeakPolarHBondContact OG1-CB 3.15Å; T33-R36 WeakPolarHBondContact OG1-CG 3.38Å; T33-R36 PolarHBondContact OG1-N 3.12Å; T33-R36 VanDerWaalsContact OG1-N 3.16Å; L34-R36 VanDerWaalsContact C-N 3.3Å; L34-R36 PolarHBondContact O-N 3.35Å; R36-R39 PolarHBondContact O-N 3.06Å; R36-F40 WeakPolarHBondContact O-CB 3.4Å; R36-F40 PolarHBondContact O-N 3.31Å
37A97Very high95.8Very high2 Ų275.6 Ų75.62%0.01736%0.363CS..Hα-helixtrans-64-45174.500000111.4T21 F25 Y32 T33 L34 F40 L41 M248T21-A37 HydrophobicContact CG2-CB 3.77Å; F25-A37 HydrophobicContact CE2-CB 4.35Å; Y32-A37 HydrophobicContact CE2-CB 3.98Å; T33-A37 PolarHBondContact O-N 2.91Å; L34-A37 WeakPolarHBondContact O-CB 3.19Å; L34-A37 PolarHBondContact O-N 2.97Å; L34-A37 VanDerWaalsContact O-N 3.1Å; A37-F40 WeakPolarHBondContact O-CB 3.46Å; A37-F40 PolarHBondContact O-N 3.04Å; A37-L41 PolarHBondContact O-N 3.35Å; A37-M248 HydrophobicContact CB-CE 3.64Å
38F96.8Very high95.5Very high127 Ų12777.8 Ų77.856%0.55737%0.373SS*.Hα-helixtrans-64.4-40.3173.8-73.3-64.3000112.6L34 L41 R42L34-F38 WeakPolarHBondContact O-CD2 3.41Å; L34-F38 PolarHBondContact O-N 2.84Å; F38-L41 HydrophobicContact CD1-CD1 4.33Å; F38-L41 PolarHBondContact O-N 2.91Å; F38-R42 WeakPolarHBondContact O-CB 3.45Å; F38-R42 PolarHBondContact O-N 3.2Å
39R97.6Very high95.4Very high115 Ų11577.4 Ų77.443%0.43438%0.375SS..Hα-helixtrans-61.5-43172.4-76-167.6-62.6-90.316.1112.2G35 R36 L41 R42 D43G35-R39 WeakPolarHBondContact O-CG 3.47Å; G35-R39 PolarHBondContact O-N 3.37Å; G35-R39 PolarHBondContact O-NH1 3.44Å; R36-R39 PolarHBondContact O-N 3.06Å; R39-L41 VanDerWaalsContact C-N 3.33Å; R39-L41 PolarHBondContact O-N 3.24Å; R39-R42 PolarHBondContact O-N 2.91Å; R39-D43 VanDerWaalsContact O-CB 3.26Å; R39-D43 WeakPolarHBondContact O-CB 3.19Å; R39-D43 PolarHBondContact O-N 3.44Å
40F96.4Very high95.5Very high46 Ų4677.8 Ų77.820%0.20237%0.365CS..Hα-helixtrans-57.9-45.1174.9174.5-89.9000111.8T21 N24 F25 R36 A37 T44T21-F40 HydrophobicContact CG2-CB 4.47Å; T21-F40 HydrophobicContact CG2-CD1 3.71Å; T21-F40 HydrophobicContact CG2-CE1 4.4Å; T21-F40 HydrophobicContact CG2-CG 4.37Å; T21-F40 WeakPolarHBondContact OG1-CD1 3.28Å; N24-F40 HydrophobicContact CB-CE1 4.35Å; N24-F40 HydrophobicContact CB-CE2 3.98Å; N24-F40 HydrophobicContact CB-CZ 3.74Å; N24-F40 VanDerWaalsContact CG-CZ 3.47Å; F25-F40 HydrophobicContact CE2-CB 3.91Å; F25-F40 HydrophobicContact CE2-CG 4.24Å; F25-F40 HydrophobicContact CZ-CB 4.32Å; R36-F40 WeakPolarHBondContact O-CB 3.4Å; R36-F40 PolarHBondContact O-N 3.31Å; A37-F40 WeakPolarHBondContact O-CB 3.46Å; A37-F40 PolarHBondContact O-N 3.04Å; F40-T44 WeakPolarHBondContact O-CB 3.25Å; F40-T44 PolarHBondContact O-N 3.47Å; F40-T44 PolarHBondContact O-OG1 3.45Å
41L96.6Very high95.5Very high28 Ų2881.3 Ų81.315%0.14738%0.379CS..Hα-helixtrans-59.8-51.2175.3-74.5168.3000111.6P17 L18 T21 A37 F38 R39 T44 Y45 L53P17-L41 HydrophobicContact CB-CD2 3.82Å; L18-L41 HydrophobicContact CD2-CD1 4.12Å; T21-L41 WeakPolarHBondContact OG1-CD2 3.46Å; T21-L41 WeakPolarHBondContact OG1-CG 3.36Å; A37-L41 PolarHBondContact O-N 3.35Å; F38-L41 HydrophobicContact CD1-CD1 4.33Å; F38-L41 PolarHBondContact O-N 2.91Å; R39-L41 VanDerWaalsContact C-N 3.33Å; R39-L41 PolarHBondContact O-N 3.24Å; L41-T44 PolarHBondContact O-N 3.47Å; L41-Y45 WeakPolarHBondContact O-CB 3.43Å; L41-Y45 PolarHBondContact O-N 3.27Å; L41-L53 HydrophobicContact CD2-CD2 3.87Å
42R97.7Very high95.4Very high145 Ų14574.7 Ų74.755%0.54735%0.354SS..Hα-helixtrans-60.5-50.7179.7-177.6-165.266.1176.52.2111.7F38 R39 T44 Y45 S46F38-R42 WeakPolarHBondContact O-CB 3.45Å; F38-R42 PolarHBondContact O-N 3.2Å; R39-R42 PolarHBondContact O-N 2.91Å; R42-T44 VanDerWaalsContact C-N 3.29Å; R42-T44 PolarHBondContact O-N 3.39Å; R42-Y45 WeakPolarHBondContact O-CB 3.48Å; R42-Y45 PolarHBondContact O-N 2.87Å; R42-Y45 VanDerWaalsContact O-N 3.17Å; R42-S46 PolarHBondContact O-N 2.93Å; R42-S46 PolarHBondContact O-OG 3.19Å
43D96.7Very high95.4Very high51 Ų5174.2 Ų74.227%0.27335%0.353SS..Hα-helixtrans-66.5-35.2-176.9-60.9-9.2000110.6R39 R47R39-D43 VanDerWaalsContact O-CB 3.26Å; R39-D43 WeakPolarHBondContact O-CB 3.19Å; R39-D43 PolarHBondContact O-N 3.44Å; D43-R47 VanDerWaalsContact O-CB 3.22Å; D43-R47 WeakPolarHBondContact O-CB 3.36Å; D43-R47 WeakPolarHBondContact O-CG 3.47Å; D43-R47 PolarHBondContact O-N 3.31Å
44T95Very high95.3Very high11 Ų1174.6 Ų74.67%0.06735%0.349CS..Hα-helixtrans-66.1-43173-59.90000111.6R20 F40 L41 R42 E48 T52 L53R20-T44 VanDerWaalsContact NH1-CG2 3.27Å; F40-T44 WeakPolarHBondContact O-CB 3.25Å; F40-T44 PolarHBondContact O-N 3.47Å; F40-T44 PolarHBondContact O-OG1 3.45Å; L41-T44 PolarHBondContact O-N 3.47Å; R42-T44 VanDerWaalsContact C-N 3.29Å; R42-T44 PolarHBondContact O-N 3.39Å; T44-E48 PolarHBondContact O-N 2.83Å; T44-T52 HydrophobicContact CG2-CG2 4.06Å; T44-L53 HydrophobicContact CG2-CD2 3.76Å
45Y96Very high95.2Very high131 Ų13172.1 Ų72.151%0.51433%0.334SS..Hα-helixtrans-60.8-48.7175.4173.7-94.2000111.2L41 R42 G49 F50 L53L41-Y45 WeakPolarHBondContact O-CB 3.43Å; L41-Y45 PolarHBondContact O-N 3.27Å; R42-Y45 WeakPolarHBondContact O-CB 3.48Å; R42-Y45 PolarHBondContact O-N 2.87Å; R42-Y45 VanDerWaalsContact O-N 3.17Å; Y45-G49 WeakPolarHBondContact O-CA 3.42Å; Y45-G49 PolarHBondContact O-N 3.45Å; Y45-F50 HydrophobicContact CD2-CB 3.99Å; Y45-F50 HydrophobicContact CD2-CD2 4.08Å; Y45-F50 HydrophobicContact CE2-CB 3.79Å; Y45-F50 AromaticContact CE2-CD2 3.96Å; Y45-F50 HydrophobicContact CE2-CD2 3.96Å; Y45-F50 HydrophobicContact CE2-CG 4.35Å; Y45-L53 HydrophobicContact CD2-CD1 4.39Å
46S96.9Very high94.9Very high88 Ų8870.6 Ų70.662%0.61532%0.319SS*.Hα-helixtrans-68.2-35-179-59.80000113.5R42R42-S46 PolarHBondContact O-N 2.93Å; R42-S46 PolarHBondContact O-OG 3.19Å
47R94.5Very high94.7Very high205 Ų20567 Ų6777%0.77431%0.307SS*.Hα-helixtrans-88.7-38.6-176.5-68.1175.1-176.7-173.41.2114.1D43D43-R47 VanDerWaalsContact O-CB 3.22Å; D43-R47 WeakPolarHBondContact O-CB 3.36Å; D43-R47 WeakPolarHBondContact O-CG 3.47Å; D43-R47 PolarHBondContact O-N 3.31Å
48E90.4Very high94.1Very high63 Ų6370.4 Ų70.429%0.29433%0.331SS..Hα-helixtrans-121.2-2-168.9-60-176-158.500113.3T44 T52T44-E48 PolarHBondContact O-N 2.83Å; E48-T52 HydrophobicContact CB-CG2 3.63Å; E48-T52 HydrophobicContact CG-CG2 4.38Å; E48-T52 PolarHBondContact O-OG1 2.99Å; E48-T52 WeakPolarHBondContact OE2-CG2 3.26Å
49G92.4Very high93.6Very high32 Ų3264.4 Ų64.433%0.3330%0.304SS..  trans81.7163.9-18000000114.5Y45 M51 T52Y45-G49 WeakPolarHBondContact O-CA 3.42Å; Y45-G49 PolarHBondContact O-N 3.45Å; G49-M51 PolarHBondContact O-N 3.1Å; G49-T52 VanDerWaalsContact O-CB 3.32Å; G49-T52 WeakPolarHBondContact O-CB 3.22Å; G49-T52 PolarHBondContact O-N 3.1Å; G49-T52 VanDerWaalsContact O-N 3.14Å
50F93.1Very high93.2Very high99 Ų9959.5 Ų59.543%0.43429%0.287SS..G310 helixtrans-53-49.2-175-179.6-106.2000114.4Y45 T52 L53 Y54Y45-F50 HydrophobicContact CD2-CB 3.99Å; Y45-F50 HydrophobicContact CD2-CD2 4.08Å; Y45-F50 HydrophobicContact CE2-CB 3.79Å; Y45-F50 AromaticContact CE2-CD2 3.96Å; Y45-F50 HydrophobicContact CE2-CD2 3.96Å; Y45-F50 HydrophobicContact CE2-CG 4.35Å; F50-T52 PolarHBondContact O-N 3.39Å; F50-L53 HydrophobicContact CD2-CD1 4.28Å; F50-L53 VanDerWaalsContact O-CB 3.31Å; F50-L53 WeakPolarHBondContact O-CB 3.26Å; F50-L53 WeakPolarHBondContact O-CG 2.96Å; F50-L53 PolarHBondContact O-N 2.83Å; F50-Y54 HydrophobicContact CD1-CE2 4.36Å; F50-Y54 HydrophobicContact CE1-CD2 4.38Å; F50-Y54 AromaticContact CE1-CE2 3.68Å; F50-Y54 HydrophobicContact CE1-CE2 3.68Å; F50-Y54 AromaticContact CE2-CE2 3.94Å; F50-Y54 HydrophobicContact CE2-CE2 3.94Å; F50-Y54 AromaticContact CZ-CE2 3.45Å; F50-Y54 HydrophobicContact CZ-CE2 3.45Å; F50-Y54 VanDerWaalsContact CZ-CE2 3.45Å; F50-Y54 AromaticContact CZ-CZ 3.93Å
51M92.4Very high92.9Very high138 Ų13859.6 Ų59.668%0.6829%0.289SS*.G310 helixtrans-61.1-22.1-175.9-66.2-58.5166.900113G49 L53 Y54G49-M51 PolarHBondContact O-N 3.1Å; M51-L53 VanDerWaalsContact C-N 3.3Å; M51-L53 PolarHBondContact O-N 3.46Å; M51-Y54 PolarHBondContact O-N 2.71Å
52T93.5Very high92.5Very high0 Ų060.7 Ų60.70%030%0.302CS..G310 helixtrans-66.5-34.5177.6-58.10000110.9R20 T44 E48 G49 F50 Y54 R55 K125R20-T52 VanDerWaalsContact NH1-CG2 3.25Å; R20-T52 PolarHBondContact NH1-O 2.94Å; T44-T52 HydrophobicContact CG2-CG2 4.06Å; E48-T52 HydrophobicContact CB-CG2 3.63Å; E48-T52 HydrophobicContact CG-CG2 4.38Å; E48-T52 PolarHBondContact O-OG1 2.99Å; E48-T52 WeakPolarHBondContact OE2-CG2 3.26Å; G49-T52 VanDerWaalsContact O-CB 3.32Å; G49-T52 WeakPolarHBondContact O-CB 3.22Å; G49-T52 PolarHBondContact O-N 3.1Å; G49-T52 VanDerWaalsContact O-N 3.14Å; F50-T52 PolarHBondContact O-N 3.39Å; T52-Y54 PolarHBondContact O-N 3.09Å; T52-R55 HydrophobicContact CG2-CG 4.26Å; T52-R55 WeakPolarHBondContact O-CB 3.36Å; T52-R55 VanDerWaalsContact O-CG 3.24Å; T52-R55 WeakPolarHBondContact O-CG 3.19Å; T52-R55 PolarHBondContact O-N 2.89Å; T52-K125 VanDerWaalsContact OG1-CE 3.29Å; T52-K125 WeakPolarHBondContact OG1-CE 3.35Å; T52-K125 PolarHBondContact OG1-NZ 2.71Å; T52-K125 VanDerWaalsContact OG1-NZ 3.08Å
53L95Very high92Very high17 Ų1756.7 Ų56.79%0.08929%0.287CS..G310 helixtrans-53.9-27.4176.8-63176.7000113.3P17 R20 L41 T44 Y45 F50 M51P17-L53 HydrophobicContact CB-CB 4.11Å; P17-L53 HydrophobicContact CG-CB 4.1Å; R20-L53 WeakPolarHBondContact CD-O 3.5Å; L41-L53 HydrophobicContact CD2-CD2 3.87Å; T44-L53 HydrophobicContact CG2-CD2 3.76Å; Y45-L53 HydrophobicContact CD2-CD1 4.39Å; F50-L53 HydrophobicContact CD2-CD1 4.28Å; F50-L53 VanDerWaalsContact O-CB 3.31Å; F50-L53 WeakPolarHBondContact O-CB 3.26Å; F50-L53 WeakPolarHBondContact O-CG 2.96Å; F50-L53 PolarHBondContact O-N 2.83Å; M51-L53 VanDerWaalsContact C-N 3.3Å; M51-L53 PolarHBondContact O-N 3.46Å
54Y95.2Very high91.6Very high63 Ų6356.7 Ų56.725%0.24729%0.289CS..G310 helixtrans-93.611.1-179.1-64.2-96.6000114T13 A16 P17 F50 M51 T52 G56 N57T13-Y54 HydrophobicContact CG2-CD1 4.28Å; T13-Y54 HydrophobicContact CG2-CE1 4.08Å; T13-Y54 VanDerWaalsContact O-CE1 3.25Å; T13-Y54 WeakPolarHBondContact O-CE1 3.44Å; A16-Y54 HydrophobicContact CB-CD1 3.98Å; A16-Y54 HydrophobicContact CB-CE1 4.47Å; P17-Y54 HydrophobicContact CG-CD1 4.46Å; P17-Y54 HydrophobicContact CG-CD2 4.48Å; P17-Y54 HydrophobicContact CG-CE1 4.03Å; P17-Y54 HydrophobicContact CG-CE2 4.01Å; F50-Y54 HydrophobicContact CD1-CE2 4.36Å; F50-Y54 HydrophobicContact CE1-CD2 4.38Å; F50-Y54 AromaticContact CE1-CE2 3.68Å; F50-Y54 HydrophobicContact CE1-CE2 3.68Å; F50-Y54 AromaticContact CE2-CE2 3.94Å; F50-Y54 HydrophobicContact CE2-CE2 3.94Å; F50-Y54 AromaticContact CZ-CE2 3.45Å; F50-Y54 HydrophobicContact CZ-CE2 3.45Å; F50-Y54 VanDerWaalsContact CZ-CE2 3.45Å; F50-Y54 AromaticContact CZ-CZ 3.93Å; M51-Y54 PolarHBondContact O-N 2.71Å; T52-Y54 PolarHBondContact O-N 3.09Å; Y54-G56 PolarHBondContact O-N 2.81Å; Y54-N57 WeakPolarHBondContact O-CB 3.27Å; Y54-N57 PolarHBondContact O-N 2.68Å
55R92.6Very high91.3Very high23 Ų2362.5 Ų62.59%0.08732%0.318CS..THydrogen-bonded Turntrans-61.6124.9176.4-75.6178.567.774.4-4.3111.8T52 L120 S121 S123 Y128T52-R55 HydrophobicContact CG2-CG 4.26Å; T52-R55 WeakPolarHBondContact O-CB 3.36Å; T52-R55 VanDerWaalsContact O-CG 3.24Å; T52-R55 WeakPolarHBondContact O-CG 3.19Å; T52-R55 PolarHBondContact O-N 2.89Å; R55-L120 VanDerWaalsContact NH2-CD1 3.25Å; R55-S121 PolarHBondContact O-OG 3.43Å; R55-S121 VanDerWaalsContact O-OG 3.06Å; R55-S123 PolarHBondContact NE-O 3.3Å; R55-S123 PolarHBondContact NH2-O 3.26Å; R55-Y128 PolarHBondContact NH2-O 2.78Å
56G90.9Very high91.1Very high2 Ų258.5 Ų58.52%0.02131%0.308CS..THydrogen-bonded Turntrans91.6-11.4-170.500000114.2Y54 A59 T60Y54-G56 PolarHBondContact O-N 2.81Å; G56-A59 PolarHBondContact O-N 3Å; G56-T60 PolarHBondContact O-N 3.09Å; G56-T60 PolarHBondContact O-OG1 3.18Å
57N92.2Very high90.9Very high21 Ų2156.7 Ų56.711%0.11229%0.289CS..Hα-helixtrans-66.1-41.3173.5-168.949.3000111.3T13 A16 Y54 A59 T60 M61T13-N57 PolarHBondContact OG1-ND2 3.2Å; T13-N57 VanDerWaalsContact OG1-ND2 3.12Å; A16-N57 HydrophobicContact CB-CB 3.82Å; Y54-N57 WeakPolarHBondContact O-CB 3.27Å; Y54-N57 PolarHBondContact O-N 2.68Å; N57-A59 VanDerWaalsContact C-N 3.28Å; N57-A59 PolarHBondContact O-N 3.34Å; N57-T60 CarbonylContact O-C 3.56Å; N57-T60 WeakPolarHBondContact O-CA 3.36Å; N57-T60 VanDerWaalsContact O-CB 3.22Å; N57-T60 WeakPolarHBondContact O-CB 3.27Å; N57-T60 PolarHBondContact O-N 3.38Å; N57-M61 WeakPolarHBondContact O-CG 3.46Å; N57-M61 PolarHBondContact O-N 3.32Å
58S84.8Confident90.8Very high74 Ų7448.6 Ų48.652%0.51727%0.266SS..Hα-helixtrans-55.7-43.3174.855.50000112T60 M61 A62S58-T60 VanDerWaalsContact C-N 3.31Å; S58-T60 PolarHBondContact O-N 2.95Å; S58-M61 PolarHBondContact O-N 3.16Å; S58-A62 VanDerWaalsContact O-CB 3.26Å; S58-A62 WeakPolarHBondContact O-CB 3.28Å; S58-A62 PolarHBondContact O-N 3.24Å
59A86.1Confident91Very high1 Ų148.3 Ų48.31%0.00828%0.275CS..Hα-helixtrans-64.2-36.1173.900000112.4G56 N57 R63 K117 L131G56-A59 PolarHBondContact O-N 3Å; N57-A59 VanDerWaalsContact C-N 3.28Å; N57-A59 PolarHBondContact O-N 3.34Å; A59-R63 WeakPolarHBondContact O-CB 3.42Å; A59-R63 PolarHBondContact O-N 3.16Å; A59-K117 HydrophobicContact CB-CB 3.67Å; A59-K117 HydrophobicContact CB-CG 4.18Å; A59-L131 HydrophobicContact CB-CD1 3.71Å; A59-L131 HydrophobicContact CB-CD2 3.74Å; A59-L131 HydrophobicContact CB-CG 4.34Å
60T89.1Confident91.2Very high12 Ų1249 Ų497%0.07427%0.27CS..Hα-helixtrans-63.9-42.6175-52.30000111.5K12 G56 N57 S58 V64 K117K12-T60 HydrophobicContact CD-CG2 4.23Å; G56-T60 PolarHBondContact O-N 3.09Å; G56-T60 PolarHBondContact O-OG1 3.18Å; N57-T60 CarbonylContact O-C 3.56Å; N57-T60 WeakPolarHBondContact O-CA 3.36Å; N57-T60 VanDerWaalsContact O-CB 3.22Å; N57-T60 WeakPolarHBondContact O-CB 3.27Å; N57-T60 PolarHBondContact O-N 3.38Å; S58-T60 VanDerWaalsContact C-N 3.31Å; S58-T60 PolarHBondContact O-N 2.95Å; T60-V64 WeakPolarHBondContact O-CG2 3.36Å; T60-K117 VanDerWaalsContact OG1-CD 3.29Å; T60-K117 WeakPolarHBondContact OG1-CD 3.14Å; T60-K117 WeakPolarHBondContact OG1-CE 3.41Å; T60-K117 PolarHBondContact OG1-NZ 3.1Å
61M90.9Very high91.4Very high47 Ų4747.3 Ų47.323%0.23226%0.264CS..Hα-helixtrans-72.2-45179.3-65.4-56.4101.500111.4A9 K12 N57 S58 R63 V64A9-M61 HydrophobicContact CB-SD 3.91Å; K12-M61 HydrophobicContact CB-CE 3.55Å; K12-M61 HydrophobicContact CD-CE 3.91Å; K12-M61 HydrophobicContact CG-CE 4.39Å; N57-M61 WeakPolarHBondContact O-CG 3.46Å; N57-M61 PolarHBondContact O-N 3.32Å; S58-M61 PolarHBondContact O-N 3.16Å; M61-R63 PolarHBondContact O-N 3.11Å; M61-R63 VanDerWaalsContact O-N 3.09Å; M61-V64 WeakPolarHBondContact O-CB 3.37Å; M61-V64 PolarHBondContact O-N 2.9Å
62A86.3Confident91.6Very high52 Ų5248.6 Ų48.643%0.4326%0.262SS..Hα-helixtrans-58.3-24.9176.700000112.9S58 P66S58-A62 VanDerWaalsContact O-CB 3.26Å; S58-A62 WeakPolarHBondContact O-CB 3.28Å; S58-A62 PolarHBondContact O-N 3.24Å; A62-P66 WeakPolarHBondContact O-CD 3.38Å; A62-P66 VanDerWaalsContact O-CG 3.27Å; A62-P66 WeakPolarHBondContact O-CG 3.18Å
63R87.5Confident91.8Very high60 Ų6052.2 Ų52.223%0.22629%0.287CS..THydrogen-bonded Turntrans-80.8-22.9177.4-165.9-172.370.3130.516.1113.8A59 M61 I65 F67 L113 D114A59-R63 WeakPolarHBondContact O-CB 3.42Å; A59-R63 PolarHBondContact O-N 3.16Å; M61-R63 PolarHBondContact O-N 3.11Å; M61-R63 VanDerWaalsContact O-N 3.09Å; R63-I65 PolarHBondContact O-N 3.35Å; R63-F67 HydrophobicContact CG-CB 4.44Å; R63-F67 WeakPolarHBondContact O-CB 3.4Å; R63-F67 PolarHBondContact O-N 2.91Å; R63-L113 HydrophobicContact CB-CD1 4.36Å; R63-L113 HydrophobicContact CG-CB 4.45Å; R63-L113 HydrophobicContact CG-CD1 4.34Å; R63-D114 WeakPolarHBondContact CD-OD1 3.29Å; R63-D114 IonicContact CZ-OD1 3.63Å; R63-D114 IonicContact NE-OD1 3.63Å; R63-D114 PolarHBondContact NE-OD1 2.73Å; R63-D114 IonicContact NH1-OD1 3.94Å; R63-D114 PolarHBondContact NH1-OD1 3.17Å; R63-D114 IonicContact NH1-OD2 3.45Å; R63-D114 PolarHBondContact NH1-OD2 3.27Å
64V88.1Confident91.9Very high51 Ų5151.8 Ų51.831%0.30929%0.286SS..Hα-helixtrans-61.5-49.4-171.8176.70000111.5T60 M61 A68T60-V64 WeakPolarHBondContact O-CG2 3.36Å; M61-V64 WeakPolarHBondContact O-CB 3.37Å; M61-V64 PolarHBondContact O-N 2.9Å; V64-A68 WeakPolarHBondContact O-CB 3.47Å; V64-A68 PolarHBondContact O-N 3.34Å; V64-A68 VanDerWaalsContact O-N 3.16Å
65I89.1Confident92Very high134 Ų13451.6 Ų51.669%0.68729%0.287SS*.Hα-helixtrans-69.7-52.4-177-62.4169.7000111.3R63 F67 A68 A69R63-I65 PolarHBondContact O-N 3.35Å; I65-F67 VanDerWaalsContact C-N 3.32Å; I65-F67 PolarHBondContact O-N 3.11Å; I65-A68 PolarHBondContact O-N 3.27Å; I65-A69 WeakPolarHBondContact O-CB 3.21Å; I65-A69 PolarHBondContact O-N 3Å
66P91.3Very high92.2Very high47 Ų4755.2 Ų55.231%0.30531%0.305SS..Hα-helixtrans-60.5-40.4179.2-25.235.9000112.9A62 A69 I70 T110A62-P66 WeakPolarHBondContact O-CD 3.38Å; A62-P66 VanDerWaalsContact O-CG 3.27Å; A62-P66 WeakPolarHBondContact O-CG 3.18Å; P66-A69 PolarHBondContact O-N 3.39Å; P66-I70 HydrophobicContact CB-CD1 4.49Å; P66-I70 WeakPolarHBondContact O-CB 2.94Å; P66-I70 WeakPolarHBondContact O-CD1 3.22Å; P66-I70 WeakPolarHBondContact O-CG1 3.34Å; P66-I70 PolarHBondContact O-N 2.88Å; P66-T110 HydrophobicContact CB-CG2 4.33Å
67F93.2Very high92.6Very high50 Ų5060.1 Ų60.122%0.21933%0.327CS..Hα-helixtrans-61.3-48.6178-179.6-92.3000111.3R63 I65 Q71 A106 T110R63-F67 HydrophobicContact CG-CB 4.44Å; R63-F67 WeakPolarHBondContact O-CB 3.4Å; R63-F67 PolarHBondContact O-N 2.91Å; I65-F67 VanDerWaalsContact C-N 3.32Å; I65-F67 PolarHBondContact O-N 3.11Å; F67-Q71 WeakPolarHBondContact O-CB 3.43Å; F67-Q71 PolarHBondContact O-N 3.16Å; F67-A106 HydrophobicContact CD2-CB 3.97Å; F67-A106 HydrophobicContact CE2-CB 3.82Å; F67-A106 HydrophobicContact CZ-CB 4.36Å; F67-T110 HydrophobicContact CB-CG2 4.15Å; F67-T110 HydrophobicContact CD2-CG2 4.47Å
68A93.1Very high92.8Very high35 Ų3562.5 Ų62.529%0.28933%0.334SS..Hα-helixtrans-61.9-49.7177.900000111.2V64 I65 I70 Q71 Y72V64-A68 WeakPolarHBondContact O-CB 3.47Å; V64-A68 PolarHBondContact O-N 3.34Å; V64-A68 VanDerWaalsContact O-N 3.16Å; I65-A68 PolarHBondContact O-N 3.27Å; A68-I70 PolarHBondContact O-N 3.34Å; A68-Q71 PolarHBondContact O-N 3.31Å; A68-Y72 HydrophobicContact CB-CD2 4.35Å; A68-Y72 HydrophobicContact CB-CE2 4.26Å; A68-Y72 WeakPolarHBondContact O-CD2 3.47Å; A68-Y72 PolarHBondContact O-N 3.47Å
69A95.2Very high93.4Very high57 Ų5761.5 Ų61.547%0.47132%0.321SS..Hα-helixtrans-57.7-48.6-179.200000112.2I65 P66 Y72 C73I65-A69 WeakPolarHBondContact O-CB 3.21Å; I65-A69 PolarHBondContact O-N 3Å; P66-A69 PolarHBondContact O-N 3.39Å; A69-Y72 PolarHBondContact O-N 3.12Å; A69-C73 VanDerWaalsContact O-CB 3.28Å; A69-C73 WeakPolarHBondContact O-CB 3.34Å; A69-C73 PolarHBondContact O-N 2.71Å
70I96.4Very high93.9Very high47 Ų4768.4 Ų68.424%0.24135%0.353CS..Hα-helixtrans-67.1-40.9179.3-63.1163000110.4P66 A68 C73 A74 T105 A106 F109 T110P66-I70 HydrophobicContact CB-CD1 4.49Å; P66-I70 WeakPolarHBondContact O-CB 2.94Å; P66-I70 WeakPolarHBondContact O-CD1 3.22Å; P66-I70 WeakPolarHBondContact O-CG1 3.34Å; P66-I70 PolarHBondContact O-N 2.88Å; A68-I70 PolarHBondContact O-N 3.34Å; I70-C73 PolarHBondContact O-N 3.4Å; I70-A74 WeakPolarHBondContact O-CB 3.45Å; I70-A74 PolarHBondContact O-N 3.42Å; I70-T105 HydrophobicContact CG2-CG2 4.35Å; I70-A106 HydrophobicContact CB-CB 4.34Å; I70-A106 HydrophobicContact CG2-CB 4.09Å; I70-F109 HydrophobicContact CD1-CB 3.77Å; I70-F109 HydrophobicContact CD1-CG 4.48Å; I70-F109 HydrophobicContact CG2-CB 4.36Å; I70-F109 HydrophobicContact CG2-CD2 4.23Å; I70-T110 HydrophobicContact CD1-CG2 4.05Å
71Q96.9Very high94.3Very high62 Ų6272.9 Ų72.929%0.2938%0.375SS..Hα-helixtrans-63.6-44.8179.1-169-178.5-86.300111.6F67 A68 H75 A102 A106F67-Q71 WeakPolarHBondContact O-CB 3.43Å; F67-Q71 PolarHBondContact O-N 3.16Å; A68-Q71 PolarHBondContact O-N 3.31Å; Q71-H75 WeakPolarHBondContact O-CB 3.5Å; Q71-H75 PolarHBondContact O-N 2.73Å; Q71-A102 HydrophobicContact CG-CB 4.34Å; Q71-A106 HydrophobicContact CB-CB 3.7Å; Q71-A106 HydrophobicContact CG-CB 4.3Å
72Y95.9Very high94.5Very high165 Ų16572.9 Ų72.965%0.64738%0.376SS*.Hα-helixtrans-66.9-44.9177.8-75.6-65.6000112A68 A69 H75 E76A68-Y72 HydrophobicContact CB-CD2 4.35Å; A68-Y72 HydrophobicContact CB-CE2 4.26Å; A68-Y72 WeakPolarHBondContact O-CD2 3.47Å; A68-Y72 PolarHBondContact O-N 3.47Å; A69-Y72 PolarHBondContact O-N 3.12Å; Y72-H75 PolarHBondContact O-N 3.27Å; Y72-E76 PolarHBondContact O-N 3.41Å; Y72-E76 VanDerWaalsContact O-N 3.09Å
73C97.8Very high94.9Very high77 Ų7777.3 Ų77.352%0.5239%0.385SS..Hα-helixtrans-59.8-51.2175.9-179.70000111.3A69 I70 H75 E76 Q77A69-C73 VanDerWaalsContact O-CB 3.28Å; A69-C73 WeakPolarHBondContact O-CB 3.34Å; A69-C73 PolarHBondContact O-N 2.71Å; I70-C73 PolarHBondContact O-N 3.4Å; C73-H75 VanDerWaalsContact C-N 3.29Å; C73-H75 PolarHBondContact O-N 2.69Å; C73-E76 PolarHBondContact O-N 3.29Å; C73-Q77 WeakPolarHBondContact O-CG 3.43Å; C73-Q77 PolarHBondContact O-N 3.13Å; C73-Q77 VanDerWaalsContact O-N 3.07Å
74A97.6Very high95.2Very high8 Ų875.4 Ų75.47%0.06638%0.38CS..Hα-helixtrans-61.4-37.9177.900000111.8I70 E76 Q77 W78 A102 T105I70-A74 WeakPolarHBondContact O-CB 3.45Å; I70-A74 PolarHBondContact O-N 3.42Å; A74-E76 VanDerWaalsContact C-N 3.34Å; A74-E76 PolarHBondContact O-N 3.26Å; A74-Q77 PolarHBondContact O-N 3.15Å; A74-W78 WeakPolarHBondContact O-CB 3.29Å; A74-W78 PolarHBondContact O-N 3.04Å; A74-A102 HydrophobicContact CB-CB 4.19Å; A74-T105 HydrophobicContact CB-CG2 3.81Å
75H97.8Very high95.3Very high58 Ų5875.4 Ų75.427%0.26938%0.378SS..Hα-helixtrans-61.1-42.6176.9-174.559.6000112.1Q71 Y72 C73 K79 A102Q71-H75 WeakPolarHBondContact O-CB 3.5Å; Q71-H75 PolarHBondContact O-N 2.73Å; Y72-H75 PolarHBondContact O-N 3.27Å; C73-H75 VanDerWaalsContact C-N 3.29Å; C73-H75 PolarHBondContact O-N 2.69Å; H75-K79 WeakPolarHBondContact O-CB 3.43Å; H75-K79 WeakPolarHBondContact O-CG 3.36Å; H75-K79 PolarHBondContact O-N 2.78Å; H75-A102 HydrophobicContact CB-CB 3.71Å
76E97Very high95.2Very high100 Ų10072.5 Ų72.547%0.46738%0.375SS..Hα-helixtrans-64.4-45.1175.6-161.957.3-125.600111.7Y72 C73 A74 W78 K79 H80Y72-E76 PolarHBondContact O-N 3.41Å; Y72-E76 VanDerWaalsContact O-N 3.09Å; C73-E76 PolarHBondContact O-N 3.29Å; A74-E76 VanDerWaalsContact C-N 3.34Å; A74-E76 PolarHBondContact O-N 3.26Å; E76-W78 PolarHBondContact O-N 3.49Å; E76-K79 PolarHBondContact O-N 2.86Å; E76-K79 IonicContact OE1-NZ 3.17Å; E76-K79 PolarHBondContact OE1-NZ 3.09Å; E76-K79 VanDerWaalsContact OE2-CE 3.26Å; E76-K79 WeakPolarHBondContact OE2-CE 3.39Å; E76-K79 IonicContact OE2-NZ 2.77Å; E76-K79 PolarHBondContact OE2-NZ 2.98Å; E76-H80 WeakPolarHBondContact O-CB 3.38Å; E76-H80 PolarHBondContact O-N 3.06Å
77Q97.8Very high94.9Very high105 Ų10575.6 Ų75.649%0.49139%0.393SS..Hα-helixtrans-61.4-45.2177.6-63.6-55.4-42.200112.2C73 A74 H80 I81C73-Q77 WeakPolarHBondContact O-CG 3.43Å; C73-Q77 PolarHBondContact O-N 3.13Å; C73-Q77 VanDerWaalsContact O-N 3.07Å; A74-Q77 PolarHBondContact O-N 3.15Å; Q77-H80 PolarHBondContact O-N 3.36Å; Q77-I81 WeakPolarHBondContact O-CB 3.19Å; Q77-I81 VanDerWaalsContact O-CG1 3.25Å; Q77-I81 WeakPolarHBondContact O-CG1 3.49Å; Q77-I81 PolarHBondContact O-N 3.49Å
78W97.7Very high94.4Very high70 Ų7076.8 Ų76.827%0.26542%0.419SS..Hα-helixtrans-67.1-37178-74.2119.3000112.5A74 E76 H80 I81 L82 A98 F101 T105A74-W78 WeakPolarHBondContact O-CB 3.29Å; A74-W78 PolarHBondContact O-N 3.04Å; E76-W78 PolarHBondContact O-N 3.49Å; W78-H80 VanDerWaalsContact C-N 3.34Å; W78-I81 HydrophobicContact CE3-CD1 4.27Å; W78-I81 HydrophobicContact CZ3-CD1 4.47Å; W78-L82 VanDerWaalsContact O-CB 3.25Å; W78-L82 WeakPolarHBondContact O-CB 3.29Å; W78-L82 VanDerWaalsContact O-CG 3.27Å; W78-L82 WeakPolarHBondContact O-CG 3.19Å; W78-L82 PolarHBondContact O-N 3.23Å; W78-A98 HydrophobicContact CB-CB 3.96Å; W78-F101 HydrophobicContact CD2-CB 3.68Å; W78-F101 HydrophobicContact CD2-CD2 4.23Å; W78-F101 HydrophobicContact CD2-CG 4.28Å; W78-F101 VanDerWaalsContact CE2-CB 3.5Å; W78-F101 HydrophobicContact CE3-CB 4.32Å; W78-F101 HydrophobicContact CE3-CD2 4.02Å; W78-F101 HydrophobicContact CE3-CG 4.46Å; W78-F101 HydrophobicContact CG-CB 3.84Å; W78-F101 HydrophobicContact CH2-CD2 4.45Å; W78-F101 HydrophobicContact CH2-CG 4.46Å; W78-F101 HydrophobicContact CZ2-CB 4.01Å; W78-F101 HydrophobicContact CZ2-CG 4.28Å; W78-F101 HydrophobicContact CZ3-CD2 4.14Å; W78-T105 PolarHBondContact NE1-OG1 3.4Å
79K97.1Very high94.1Very high54 Ų5478.5 Ų78.524%0.23543%0.429CS..Hα-helixtrans-61.4-43.9172.5-79.7-169.9-67.1142.40111.5H75 E76 K83 V84 A98H75-K79 WeakPolarHBondContact O-CB 3.43Å; H75-K79 WeakPolarHBondContact O-CG 3.36Å; H75-K79 PolarHBondContact O-N 2.78Å; E76-K79 PolarHBondContact O-N 2.86Å; E76-K79 IonicContact OE1-NZ 3.17Å; E76-K79 PolarHBondContact OE1-NZ 3.09Å; E76-K79 VanDerWaalsContact OE2-CE 3.26Å; E76-K79 WeakPolarHBondContact OE2-CE 3.39Å; E76-K79 IonicContact OE2-NZ 2.77Å; E76-K79 PolarHBondContact OE2-NZ 2.98Å; K79-K83 PolarHBondContact O-N 3.43Å; K79-V84 HydrophobicContact CB-CB 4Å; K79-V84 HydrophobicContact CB-CG2 4.15Å; K79-V84 HydrophobicContact CD-CG1 4.33Å; K79-V84 HydrophobicContact CG-CB 4Å; K79-V84 HydrophobicContact CG-CG1 4.16Å; K79-V84 HydrophobicContact CG-CG2 4.03Å; K79-V84 PolarHBondContact O-N 2.96Å; K79-A98 HydrophobicContact CG-CB 4Å
80H96Very high93.7Very high146 Ų14679.7 Ų79.768%0.67643%0.434SS*.Hα-helixtrans-63-50.7177.5-177.1-93.3000111.5E76 Q77 W78 L82 K83E76-H80 WeakPolarHBondContact O-CB 3.38Å; E76-H80 PolarHBondContact O-N 3.06Å; Q77-H80 PolarHBondContact O-N 3.36Å; W78-H80 VanDerWaalsContact C-N 3.34Å; H80-L82 VanDerWaalsContact C-N 3.33Å; H80-L82 PolarHBondContact O-N 3.15Å; H80-K83 PolarHBondContact O-N 3.3Å; H80-K83 VanDerWaalsContact O-N 3.1Å
81I96.7Very high93.5Very high105 Ų10578.4 Ų78.454%0.53843%0.428SS..Hα-helixtrans-58.8-43.5178.3-68.9165.5000111.5Q77 W78 K83Q77-I81 WeakPolarHBondContact O-CB 3.19Å; Q77-I81 VanDerWaalsContact O-CG1 3.25Å; Q77-I81 WeakPolarHBondContact O-CG1 3.49Å; Q77-I81 PolarHBondContact O-N 3.49Å; W78-I81 HydrophobicContact CE3-CD1 4.27Å; W78-I81 HydrophobicContact CZ3-CD1 4.47Å; I81-K83 VanDerWaalsContact C-N 3.25Å; I81-K83 PolarHBondContact O-N 2.91Å
82L96Very high93.4Very high48 Ų4879.5 Ų79.525%0.25144%0.441SS..THydrogen-bonded Turntrans-82.80.7-178.6-65.3169.6000113.3W78 H80 V84 R94 I97 A98W78-L82 VanDerWaalsContact O-CB 3.25Å; W78-L82 WeakPolarHBondContact O-CB 3.29Å; W78-L82 VanDerWaalsContact O-CG 3.27Å; W78-L82 WeakPolarHBondContact O-CG 3.19Å; W78-L82 PolarHBondContact O-N 3.23Å; H80-L82 VanDerWaalsContact C-N 3.33Å; H80-L82 PolarHBondContact O-N 3.15Å; L82-V84 HydrophobicContact CB-CG2 4.06Å; L82-V84 PolarHBondContact O-N 3.35Å; L82-R94 WeakPolarHBondContact O-CD 3.35Å; L82-I97 HydrophobicContact CD1-CB 4.17Å; L82-I97 HydrophobicContact CD1-CG2 3.69Å; L82-A98 HydrophobicContact CD1-CB 4.04Å
83K94.8Very high93.3Very high145 Ų14576.5 Ų76.563%0.6344%0.439SS*.THydrogen-bonded Turntrans48.848.5-175.9-58.5-178.3180-178.40111.3K79 H80 I81 D85 A86 R94K79-K83 PolarHBondContact O-N 3.43Å; H80-K83 PolarHBondContact O-N 3.3Å; H80-K83 VanDerWaalsContact O-N 3.1Å; I81-K83 VanDerWaalsContact C-N 3.25Å; I81-K83 PolarHBondContact O-N 2.91Å; K83-D85 PolarHBondContact O-N 3.24Å; K83-A86 HydrophobicContact CB-CB 3.92Å; K83-R94 PolarHBondContact O-NH1 3.36Å; K83-R94 VanDerWaalsContact O-NH1 3.13Å
84V93.2Very high93.2Very high19 Ų1978.3 Ų78.312%0.11544%0.435CS..THydrogen-bonded Turntrans-63.3122.6177.4171.60000108.4K79 L82 A86 R94 R95 A98K79-V84 HydrophobicContact CB-CB 4Å; K79-V84 HydrophobicContact CB-CG2 4.15Å; K79-V84 HydrophobicContact CD-CG1 4.33Å; K79-V84 HydrophobicContact CG-CB 4Å; K79-V84 HydrophobicContact CG-CG1 4.16Å; K79-V84 HydrophobicContact CG-CG2 4.03Å; K79-V84 PolarHBondContact O-N 2.96Å; L82-V84 HydrophobicContact CB-CG2 4.06Å; L82-V84 PolarHBondContact O-N 3.35Å; V84-A86 PolarHBondContact O-N 2.91Å; V84-R94 HydrophobicContact CG2-CB 3.69Å; V84-R95 HydrophobicContact CG1-CG 3.49Å; V84-R95 VanDerWaalsContact CG1-CG 3.49Å; V84-A98 HydrophobicContact CG2-CB 4.29Å
85D91Very high93.1Very high51 Ų5182.8 Ų82.827%0.27345%0.45SS..THydrogen-bonded Turntrans57.216.3177-51.1-34.1000115.1K83 T87 G88 S89 T91 R95K83-D85 PolarHBondContact O-N 3.24Å; D85-T87 PolarHBondContact O-N 2.94Å; D85-G88 PolarHBondContact O-N 3.34Å; D85-S89 WeakPolarHBondContact CA-O 3.49Å; D85-T91 PolarHBondContact N-OG1 3.48Å; D85-T91 PolarHBondContact OD1-N 3.44Å; D85-T91 PolarHBondContact OD1-OG1 3.05Å; D85-R95 IonicContact OD1-CZ 2.77Å; D85-R95 IonicContact OD1-NE 3.91Å; D85-R95 PolarHBondContact OD1-NE 3.32Å; D85-R95 IonicContact OD1-NH2 3.04Å; D85-R95 PolarHBondContact OD1-NH2 3.09Å; D85-R95 IonicContact OD2-CZ 2.71Å; D85-R95 VanDerWaalsContact OD2-CZ 3.24Å; D85-R95 IonicContact OD2-NE 3.32Å; D85-R95 PolarHBondContact OD2-NE 3.07Å; D85-R95 IonicContact OD2-NH2 2.72Å; D85-R95 PolarHBondContact OD2-NH2 3.49Å
86A87Confident93Very high74 Ų7488 Ų8861%0.61247%0.469SS*.THydrogen-bonded Turntrans-64.1-23.9-174.800000114K83 V84K83-A86 HydrophobicContact CB-CB 3.92Å; V84-A86 PolarHBondContact O-N 2.91Å
87T84.7Confident93Very high112 Ų11286.1 Ų86.169%0.68746%0.461SS*.THydrogen-bonded Turntrans-96.210.817860.10000112.8D85 S89D85-T87 PolarHBondContact O-N 2.94Å; T87-S89 PolarHBondContact O-N 2.91Å; T87-S89 VanDerWaalsContact O-N 3.16Å; T87-S89 PolarHBondContact OG1-OG 2.87Å
88G82.9Confident92.9Very high74 Ų7481.1 Ų81.176%0.76344%0.438SS*.SBendtrans75.4-10.8-172.400000114.4D85D85-G88 PolarHBondContact O-N 3.34Å
89S86.3Confident92.9Very high71 Ų7179.3 Ų79.350%0.49744%0.441SS..SBendtrans-80.1139.6175-49.80000111.6D85 T87 T91D85-S89 WeakPolarHBondContact CA-O 3.49Å; T87-S89 PolarHBondContact O-N 2.91Å; T87-S89 VanDerWaalsContact O-N 3.16Å; T87-S89 PolarHBondContact OG1-OG 2.87Å; S89-T91 PolarHBondContact O-N 3.37Å
90S87.5Confident92.8Very high82 Ų8279.2 Ų79.257%0.57345%0.447SS*.  trans-67.4122.4175.3-172.60000111.2P92 R95S90-P92 VanDerWaalsContact C-CD 3.43Å; S90-P92 WeakPolarHBondContact O-CD 3.28Å; S90-R95 PolarHBondContact OG-NH1 3.43Å; S90-R95 PolarHBondContact OG-NH2 2.8Å
91T92.7Very high92.8Very high20 Ų2076.6 Ų76.612%0.12343%0.434CS..  trans-115.768.4-176.655.40000112.1D85 S89 V93 R94 R95D85-T91 PolarHBondContact N-OG1 3.48Å; D85-T91 PolarHBondContact OD1-N 3.44Å; D85-T91 PolarHBondContact OD1-OG1 3.05Å; S89-T91 PolarHBondContact O-N 3.37Å; T91-V93 VanDerWaalsContact C-N 3.34Å; T91-V93 PolarHBondContact O-N 3.09Å; T91-R94 PolarHBondContact O-N 2.93Å; T91-R95 PolarHBondContact O-N 2.69Å
92P93.2Very high92.9Very high86 Ų8671.7 Ų71.756%0.55841%0.409SS*.Hα-helixtrans-58.7-39.8-170.722.5-33.8000113.8S90 R94 R95 Y96S90-P92 VanDerWaalsContact C-CD 3.43Å; S90-P92 WeakPolarHBondContact O-CD 3.28Å; P92-R94 PolarHBondContact O-N 2.79Å; P92-R95 PolarHBondContact O-N 3.44Å; P92-Y96 PolarHBondContact O-N 2.97Å
93V94.9Very high92.8Very high102 Ų10270.3 Ų70.362%0.61841%0.407SS*.Hα-helixtrans-64-41.3177.2178.80000111.1T91 Y96 I97T91-V93 VanDerWaalsContact C-N 3.34Å; T91-V93 PolarHBondContact O-N 3.09Å; V93-Y96 PolarHBondContact O-N 3.32Å; V93-I97 HydrophobicContact CG1-CD1 3.96Å; V93-I97 VanDerWaalsContact O-CG1 3.3Å; V93-I97 WeakPolarHBondContact O-CG1 3.29Å; V93-I97 PolarHBondContact O-N 3.15Å
94R96.1Very high92.8Very high114 Ų11466.6 Ų66.643%0.4340%0.396SS..Hα-helixtrans-69-38.7178.8-57.9-175.3-178.2171.21.9111.5L82 K83 V84 T91 P92 Y96 I97 A98L82-R94 WeakPolarHBondContact O-CD 3.35Å; K83-R94 PolarHBondContact O-NH1 3.36Å; K83-R94 VanDerWaalsContact O-NH1 3.13Å; V84-R94 HydrophobicContact CG2-CB 3.69Å; T91-R94 PolarHBondContact O-N 2.93Å; P92-R94 PolarHBondContact O-N 2.79Å; R94-Y96 VanDerWaalsContact C-N 3.34Å; R94-Y96 PolarHBondContact O-N 3.49Å; R94-I97 PolarHBondContact O-N 3.39Å; R94-A98 WeakPolarHBondContact O-CB 3.07Å; R94-A98 PolarHBondContact O-N 3.5Å
95R95.2Very high92.9Very high102 Ų10267.3 Ų67.339%0.38540%0.4SS..Hα-helixtrans-59-44.7171.7-68.5-176.8-158.2145.913.4111.8V84 D85 S90 T91 P92 A98 G99V84-R95 HydrophobicContact CG1-CG 3.49Å; V84-R95 VanDerWaalsContact CG1-CG 3.49Å; D85-R95 IonicContact OD1-CZ 2.77Å; D85-R95 IonicContact OD1-NE 3.91Å; D85-R95 PolarHBondContact OD1-NE 3.32Å; D85-R95 IonicContact OD1-NH2 3.04Å; D85-R95 PolarHBondContact OD1-NH2 3.09Å; D85-R95 IonicContact OD2-CZ 2.71Å; D85-R95 VanDerWaalsContact OD2-CZ 3.24Å; D85-R95 IonicContact OD2-NE 3.32Å; D85-R95 PolarHBondContact OD2-NE 3.07Å; D85-R95 IonicContact OD2-NH2 2.72Å; D85-R95 PolarHBondContact OD2-NH2 3.49Å; S90-R95 PolarHBondContact OG-NH1 3.43Å; S90-R95 PolarHBondContact OG-NH2 2.8Å; T91-R95 PolarHBondContact O-N 2.69Å; P92-R95 PolarHBondContact O-N 3.44Å; R95-A98 PolarHBondContact O-N 3.39Å; R95-G99 PolarHBondContact O-N 2.89Å
96Y94.8Very high93.2Very high168 Ų16864.9 Ų64.966%0.65939%0.387SS*.Hα-helixtrans-61.4-45.5177.4175.7-96000112P92 V93 R94 G99 S100P92-Y96 PolarHBondContact O-N 2.97Å; V93-Y96 PolarHBondContact O-N 3.32Å; R94-Y96 VanDerWaalsContact C-N 3.34Å; R94-Y96 PolarHBondContact O-N 3.49Å; Y96-G99 PolarHBondContact O-N 3.24Å; Y96-S100 WeakPolarHBondContact O-CB 3.42Å; Y96-S100 PolarHBondContact O-N 3.32Å; Y96-S100 PolarHBondContact O-OG 2.9Å
97I96.9Very high93.5Very high60 Ų6062.9 Ų62.931%0.30837%0.368SS..Hα-helixtrans-63.6-45.7176.7-66.3168.8000110.7L82 V93 R94 G99 S100 F101L82-I97 HydrophobicContact CD1-CB 4.17Å; L82-I97 HydrophobicContact CD1-CG2 3.69Å; V93-I97 HydrophobicContact CG1-CD1 3.96Å; V93-I97 VanDerWaalsContact O-CG1 3.3Å; V93-I97 WeakPolarHBondContact O-CG1 3.29Å; V93-I97 PolarHBondContact O-N 3.15Å; R94-I97 PolarHBondContact O-N 3.39Å; I97-G99 PolarHBondContact O-N 2.86Å; I97-S100 PolarHBondContact O-N 2.86Å; I97-F101 HydrophobicContact CG2-CD2 3.53Å; I97-F101 HydrophobicContact CG2-CE2 3.38Å; I97-F101 HydrophobicContact CG2-CZ 4.39Å; I97-F101 PolarHBondContact O-N 3.4Å
98A97Very high93.9Very high0 Ų059.6 Ų59.60%035%0.35CS..Hα-helixtrans-60.4-43.4178.100000112.2W78 K79 L82 V84 R94 R95 A102W78-A98 HydrophobicContact CB-CB 3.96Å; K79-A98 HydrophobicContact CG-CB 4Å; L82-A98 HydrophobicContact CD1-CB 4.04Å; V84-A98 HydrophobicContact CG2-CB 4.29Å; R94-A98 WeakPolarHBondContact O-CB 3.07Å; R94-A98 PolarHBondContact O-N 3.5Å; R95-A98 PolarHBondContact O-N 3.39Å; A98-A102 VanDerWaalsContact O-CB 3.25Å; A98-A102 WeakPolarHBondContact O-CB 3.35Å; A98-A102 PolarHBondContact O-N 2.85Å
99G96.4Very high94.4Very high33 Ų3362.8 Ų62.834%0.3434%0.342SS..Hα-helixtrans-64.1-41.8174.400000112.8R95 Y96 I97 A102 G103R95-G99 PolarHBondContact O-N 2.89Å; Y96-G99 PolarHBondContact O-N 3.24Å; I97-G99 PolarHBondContact O-N 2.86Å; G99-A102 PolarHBondContact O-N 2.98Å; G99-G103 PolarHBondContact O-N 3.5Å
100S95.6Very high94.8Very high51 Ų5159.5 Ų59.536%0.35732%0.319SS..Hα-helixtrans-63.4-48.8178.4-60.70000111.6Y96 I97 A102 G103 V104Y96-S100 WeakPolarHBondContact O-CB 3.42Å; Y96-S100 PolarHBondContact O-N 3.32Å; Y96-S100 PolarHBondContact O-OG 2.9Å; I97-S100 PolarHBondContact O-N 2.86Å; S100-A102 PolarHBondContact O-N 3.25Å; S100-G103 PolarHBondContact O-N 3.37Å; S100-V104 WeakPolarHBondContact O-CG2 3.3Å; S100-V104 PolarHBondContact O-N 2.97Å
101F96.8Very high95.1Very high92 Ų9255.6 Ų55.640%0.40429%0.292SS..Hα-helixtrans-66.2-37176.8-74.9-45.9000112.4W78 I97 G103 V104 T105W78-F101 HydrophobicContact CD2-CB 3.68Å; W78-F101 HydrophobicContact CD2-CD2 4.23Å; W78-F101 HydrophobicContact CD2-CG 4.28Å; W78-F101 VanDerWaalsContact CE2-CB 3.5Å; W78-F101 HydrophobicContact CE3-CB 4.32Å; W78-F101 HydrophobicContact CE3-CD2 4.02Å; W78-F101 HydrophobicContact CE3-CG 4.46Å; W78-F101 HydrophobicContact CG-CB 3.84Å; W78-F101 HydrophobicContact CH2-CD2 4.45Å; W78-F101 HydrophobicContact CH2-CG 4.46Å; W78-F101 HydrophobicContact CZ2-CB 4.01Å; W78-F101 HydrophobicContact CZ2-CG 4.28Å; W78-F101 HydrophobicContact CZ3-CD2 4.14Å; I97-F101 HydrophobicContact CG2-CD2 3.53Å; I97-F101 HydrophobicContact CG2-CE2 3.38Å; I97-F101 HydrophobicContact CG2-CZ 4.39Å; I97-F101 PolarHBondContact O-N 3.4Å; F101-G103 VanDerWaalsContact C-N 3.31Å; F101-G103 PolarHBondContact O-N 3.27Å; F101-V104 PolarHBondContact O-N 2.98Å; F101-T105 WeakPolarHBondContact O-CB 3.14Å; F101-T105 PolarHBondContact O-N 2.81Å; F101-T105 PolarHBondContact O-OG1 3.01Å
102A97.4Very high95.2Very high1 Ų155.4 Ų55.41%0.00829%0.291CS..Hα-helixtrans-58.6-43.5172.900000112.3Q71 A74 H75 A98 G99 S100 T105 A106Q71-A102 HydrophobicContact CG-CB 4.34Å; A74-A102 HydrophobicContact CB-CB 4.19Å; H75-A102 HydrophobicContact CB-CB 3.71Å; A98-A102 VanDerWaalsContact O-CB 3.25Å; A98-A102 WeakPolarHBondContact O-CB 3.35Å; A98-A102 PolarHBondContact O-N 2.85Å; G99-A102 PolarHBondContact O-N 2.98Å; S100-A102 PolarHBondContact O-N 3.25Å; A102-T105 PolarHBondContact O-N 3.46Å; A102-A106 WeakPolarHBondContact O-CB 3.41Å; A102-A106 PolarHBondContact O-N 2.88Å
103G94.5Very high95.2Very high20 Ų2053 Ų5321%0.20627%0.273CS..Hα-helixtrans-63.2-41.9175.100000112.8G99 S100 F101 T107G99-G103 PolarHBondContact O-N 3.5Å; S100-G103 PolarHBondContact O-N 3.37Å; F101-G103 VanDerWaalsContact C-N 3.31Å; F101-G103 PolarHBondContact O-N 3.27Å; G103-T107 VanDerWaalsContact O-CB 3.27Å; G103-T107 WeakPolarHBondContact O-CB 3.42Å; G103-T107 PolarHBondContact O-N 3.5Å; G103-T107 PolarHBondContact O-OG1 3.15Å
104V94.8Very high95.1Very high67 Ų6748.7 Ų48.741%0.40625%0.247SC..Hα-helixtrans-64.1-48.1175172.50000110.8S100 F101 T107 S108S100-V104 WeakPolarHBondContact O-CG2 3.3Å; S100-V104 PolarHBondContact O-N 2.97Å; F101-V104 PolarHBondContact O-N 2.98Å; V104-T107 PolarHBondContact O-N 3.43Å; V104-S108 WeakPolarHBondContact O-CB 3.34Å; V104-S108 PolarHBondContact O-N 2.76Å; V104-S108 PolarHBondContact O-OG 3.41Å
105T96.3Very high95.1Very high33 Ų3343.3 Ų43.320%0.20223%0.227CC..Hα-helixtrans-57-53.4177-59.20000110.7I70 A74 W78 F101 A102 T107 S108 F109I70-T105 HydrophobicContact CG2-CG2 4.35Å; A74-T105 HydrophobicContact CB-CG2 3.81Å; W78-T105 PolarHBondContact NE1-OG1 3.4Å; F101-T105 WeakPolarHBondContact O-CB 3.14Å; F101-T105 PolarHBondContact O-N 2.81Å; F101-T105 PolarHBondContact O-OG1 3.01Å; A102-T105 PolarHBondContact O-N 3.46Å; T105-T107 VanDerWaalsContact C-N 3.31Å; T105-T107 PolarHBondContact O-N 2.86Å; T105-S108 PolarHBondContact O-N 2.68Å; T105-S108 VanDerWaalsContact O-N 3.16Å; T105-F109 HydrophobicContact CG2-CD2 3.8Å; T105-F109 HydrophobicContact CG2-CE2 3.78Å; T105-F109 VanDerWaalsContact O-CD2 3.31Å; T105-F109 WeakPolarHBondContact O-CD2 3.44Å; T105-F109 PolarHBondContact O-N 3.19Å
106A95.6Very high95.1Very high0 Ų038.4 Ų38.40%021%0.208CC..Hα-helixtrans-60.1-41179.300000112.6F67 I70 Q71 A102 T110F67-A106 HydrophobicContact CD2-CB 3.97Å; F67-A106 HydrophobicContact CE2-CB 3.82Å; F67-A106 HydrophobicContact CZ-CB 4.36Å; I70-A106 HydrophobicContact CB-CB 4.34Å; I70-A106 HydrophobicContact CG2-CB 4.09Å; Q71-A106 HydrophobicContact CB-CB 3.7Å; Q71-A106 HydrophobicContact CG-CB 4.3Å; A102-A106 WeakPolarHBondContact O-CB 3.41Å; A102-A106 PolarHBondContact O-N 2.88Å; A106-T110 WeakPolarHBondContact O-CB 3.21Å; A106-T110 WeakPolarHBondContact O-CG2 3.34Å; A106-T110 PolarHBondContact O-N 3.31Å; A106-T110 PolarHBondContact O-OG1 3.47Å
107T93.2Very high95Very high33 Ų3331.8 Ų31.820%0.20218%0.183CC..Hα-helixtrans-62.8-46.7175.5-59.50000110.7G103 V104 T105 F109 T110 Y111G103-T107 VanDerWaalsContact O-CB 3.27Å; G103-T107 WeakPolarHBondContact O-CB 3.42Å; G103-T107 PolarHBondContact O-N 3.5Å; G103-T107 PolarHBondContact O-OG1 3.15Å; V104-T107 PolarHBondContact O-N 3.43Å; T105-T107 VanDerWaalsContact C-N 3.31Å; T105-T107 PolarHBondContact O-N 2.86Å; T107-F109 PolarHBondContact O-N 3.24Å; T107-T110 CarbonylContact O-C 3.57Å; T107-T110 PolarHBondContact O-N 3.22Å; T107-Y111 HydrophobicContact CG2-CD2 4.49Å; T107-Y111 WeakPolarHBondContact O-CA 3.33Å; T107-Y111 VanDerWaalsContact O-CB 3.22Å; T107-Y111 WeakPolarHBondContact O-CB 3.4Å; T107-Y111 PolarHBondContact O-N 3.16Å
108S94.3Very high95Very high43 Ų4329 Ų2930%0.30117%0.168SC..Hα-helixtrans-58.3-50.2178.8-65.10000112V104 T105 T110 Y111 Y148V104-S108 WeakPolarHBondContact O-CB 3.34Å; V104-S108 PolarHBondContact O-N 2.76Å; V104-S108 PolarHBondContact O-OG 3.41Å; T105-S108 PolarHBondContact O-N 2.68Å; T105-S108 VanDerWaalsContact O-N 3.16Å; S108-T110 VanDerWaalsContact C-N 3.34Å; S108-T110 PolarHBondContact O-N 3.42Å; S108-Y111 PolarHBondContact O-N 3.01Å; S108-Y148 VanDerWaalsContact O-CE1 3.31Å; S108-Y148 WeakPolarHBondContact O-CE1 3.45Å
109F94.1Very high94.9Very high140 Ų14029.2 Ų29.261%0.61417%0.169SC*.Hα-helixtrans-67-32.7-179.9-81.9-84000113.5I70 T105 T107I70-F109 HydrophobicContact CD1-CB 3.77Å; I70-F109 HydrophobicContact CD1-CG 4.48Å; I70-F109 HydrophobicContact CG2-CB 4.36Å; I70-F109 HydrophobicContact CG2-CD2 4.23Å; T105-F109 HydrophobicContact CG2-CD2 3.8Å; T105-F109 HydrophobicContact CG2-CE2 3.78Å; T105-F109 VanDerWaalsContact O-CD2 3.31Å; T105-F109 WeakPolarHBondContact O-CD2 3.44Å; T105-F109 PolarHBondContact O-N 3.19Å; T107-F109 PolarHBondContact O-N 3.24Å
110T93.7Very high94.9Very high2 Ų227.9 Ų27.91%0.01216%0.155CC..Hα-helixtrans-94.5-3.1-179.862.20000113.8P66 F67 I70 A106 T107 S108 P112 L113 D114P66-T110 HydrophobicContact CB-CG2 4.33Å; F67-T110 HydrophobicContact CB-CG2 4.15Å; F67-T110 HydrophobicContact CD2-CG2 4.47Å; I70-T110 HydrophobicContact CD1-CG2 4.05Å; A106-T110 WeakPolarHBondContact O-CB 3.21Å; A106-T110 WeakPolarHBondContact O-CG2 3.34Å; A106-T110 PolarHBondContact O-N 3.31Å; A106-T110 PolarHBondContact O-OG1 3.47Å; T107-T110 CarbonylContact O-C 3.57Å; T107-T110 PolarHBondContact O-N 3.22Å; S108-T110 VanDerWaalsContact C-N 3.34Å; S108-T110 PolarHBondContact O-N 3.42Å; T110-P112 VanDerWaalsContact C-CD 3.47Å; T110-L113 WeakPolarHBondContact O-CB 3.47Å; T110-L113 PolarHBondContact O-N 3.32Å; T110-D114 PolarHBondContact O-N 3.02Å
111Y94.3Very high94.9Very high0 Ų025.6 Ų25.60%014%0.139CC..Hα-helixtrans-58.6-39.1-178.4-165.3-88.1000113.5T107 S108 L113 D114 L115 L147 Y148 R149 G150 V151 T154 Q215T107-Y111 HydrophobicContact CG2-CD2 4.49Å; T107-Y111 WeakPolarHBondContact O-CA 3.33Å; T107-Y111 VanDerWaalsContact O-CB 3.22Å; T107-Y111 WeakPolarHBondContact O-CB 3.4Å; T107-Y111 PolarHBondContact O-N 3.16Å; S108-Y111 PolarHBondContact O-N 3.01Å; Y111-L113 PolarHBondContact O-N 2.97Å; Y111-D114 WeakPolarHBondContact O-CA 2.96Å; Y111-D114 WeakPolarHBondContact O-CB 3.47Å; Y111-D114 PolarHBondContact O-N 3.2Å; Y111-L115 HydrophobicContact CE1-CB 4.43Å; Y111-L115 PolarHBondContact O-N 2.91Å; Y111-L147 WeakPolarHBondContact CD1-O 3.5Å; Y111-Y148 HydrophobicContact CD1-CD1 4.18Å; Y111-Y148 VanDerWaalsContact CE1-C 3.47Å; Y111-R149 WeakPolarHBondContact CE1-O 3.36Å; Y111-R149 PolarHBondContact OH-O 2.87Å; Y111-G150 VanDerWaalsContact OH-CA 3.3Å; Y111-G150 WeakPolarHBondContact OH-CA 3.2Å; Y111-G150 PolarHBondContact OH-O 3.41Å; Y111-G150 VanDerWaalsContact OH-O 3.07Å; Y111-V151 HydrophobicContact CD1-CB 4.33Å; Y111-V151 HydrophobicContact CD2-CB 4.22Å; Y111-V151 HydrophobicContact CD2-CG2 4Å; Y111-V151 HydrophobicContact CE1-CB 4.08Å; Y111-V151 HydrophobicContact CE2-CB 3.96Å; Y111-V151 HydrophobicContact CE2-CG2 4.13Å; Y111-V151 HydrophobicContact CG-CB 4.41Å; Y111-V151 HydrophobicContact CG-CG2 4.31Å; Y111-V151 PolarHBondContact OH-N 3.41Å; Y111-T154 HydrophobicContact CE2-CG2 4.35Å; Y111-Q215 WeakPolarHBondContact OH-CG 3.33Å; Y111-Q215 PolarHBondContact OH-NE2 2.94Å
112P94.4Very high94.8Very high17 Ų1723 Ų2311%0.1113%0.13CC..Hα-helixtrans-55.3-35.5174-28.737.9000113.3T110 L115 A116 F135 L147 Y148T110-P112 VanDerWaalsContact C-CD 3.47Å; P112-L115 PolarHBondContact O-N 3.27Å; P112-A116 VanDerWaalsContact O-CB 3.27Å; P112-A116 WeakPolarHBondContact O-CB 3.46Å; P112-A116 PolarHBondContact O-N 3.35Å; P112-F135 HydrophobicContact CB-CE1 3.62Å; P112-F135 HydrophobicContact CB-CZ 4.3Å; P112-F135 WeakPolarHBondContact O-CE1 3.18Å; P112-F135 WeakPolarHBondContact O-CZ 3.35Å; P112-L147 HydrophobicContact CB-CB 4.03Å; P112-L147 HydrophobicContact CB-CD1 4.33Å; P112-L147 HydrophobicContact CG-CB 4.22Å; P112-Y148 HydrophobicContact CG-CE1 4.36Å; P112-Y148 HydrophobicContact CG-CE2 4.13Å
113L93.2Very high94.7Very high34 Ų3423 Ų2318%0.17813%0.13CC..Hα-helixtrans-69.1-36.9174.2-69.5165.2000112.2R63 T110 Y111 A116 K117 L131 F135R63-L113 HydrophobicContact CB-CD1 4.36Å; R63-L113 HydrophobicContact CG-CB 4.45Å; R63-L113 HydrophobicContact CG-CD1 4.34Å; T110-L113 WeakPolarHBondContact O-CB 3.47Å; T110-L113 PolarHBondContact O-N 3.32Å; Y111-L113 PolarHBondContact O-N 2.97Å; L113-A116 PolarHBondContact O-N 2.92Å; L113-K117 WeakPolarHBondContact O-CB 3.32Å; L113-K117 PolarHBondContact O-N 3.45Å; L113-L131 HydrophobicContact CD2-CD2 3.97Å; L113-F135 HydrophobicContact CD2-CE2 3.77Å; L113-F135 HydrophobicContact CD2-CZ 3.68Å; L113-F135 HydrophobicContact CG-CZ 4.09Å
114D93.5Very high94.5Very high13 Ų1330.3 Ų30.37%0.0715%0.151CC..Hα-helixtrans-63.1-42.7175.5-884.5000111.5R63 T110 Y111 A118 R211R63-D114 WeakPolarHBondContact CD-OD1 3.29Å; R63-D114 IonicContact CZ-OD1 3.63Å; R63-D114 IonicContact NE-OD1 3.63Å; R63-D114 PolarHBondContact NE-OD1 2.73Å; R63-D114 IonicContact NH1-OD1 3.94Å; R63-D114 PolarHBondContact NH1-OD1 3.17Å; R63-D114 IonicContact NH1-OD2 3.45Å; R63-D114 PolarHBondContact NH1-OD2 3.27Å; T110-D114 PolarHBondContact O-N 3.02Å; Y111-D114 WeakPolarHBondContact O-CA 2.96Å; Y111-D114 WeakPolarHBondContact O-CB 3.47Å; Y111-D114 PolarHBondContact O-N 3.2Å; D114-A118 PolarHBondContact O-N 3.32Å; D114-A118 VanDerWaalsContact O-N 3.1Å; D114-R211 IonicContact OD2-NH2 2.75Å; D114-R211 PolarHBondContact OD2-NH2 3.01Å
115L95.5Very high94.2Very high0 Ų031.7 Ų31.70%015%0.152CC..Hα-helixtrans-66.9-47.7175.6178.3141.3000111.4Y111 P112 K117 A118 R119 T138 A146 L147 R149 Q215Y111-L115 HydrophobicContact CE1-CB 4.43Å; Y111-L115 PolarHBondContact O-N 2.91Å; P112-L115 PolarHBondContact O-N 3.27Å; L115-K117 VanDerWaalsContact C-N 3.3Å; L115-K117 PolarHBondContact O-N 2.79Å; L115-A118 PolarHBondContact O-N 3.03Å; L115-A118 VanDerWaalsContact O-N 3.1Å; L115-R119 HydrophobicContact CD2-CG 4.44Å; L115-R119 PolarHBondContact O-N 3.4Å; L115-T138 HydrophobicContact CD2-CG2 4.34Å; L115-A146 WeakPolarHBondContact CD1-O 3.49Å; L115-L147 HydrophobicContact CD2-CD2 4.17Å; L115-R149 HydrophobicContact CD1-CB 3.79Å; L115-Q215 HydrophobicContact CG-CB 4.47Å
116A94.5Very high93.9Very high0 Ų035.4 Ų35.40%018%0.179CC..Hα-helixtrans-63.4-38-179.200000111.6P112 L113 L120 L131 V134 F135P112-A116 VanDerWaalsContact O-CB 3.27Å; P112-A116 WeakPolarHBondContact O-CB 3.46Å; P112-A116 PolarHBondContact O-N 3.35Å; L113-A116 PolarHBondContact O-N 2.92Å; A116-L120 VanDerWaalsContact O-CB 3.27Å; A116-L120 WeakPolarHBondContact O-CB 3.37Å; A116-L120 PolarHBondContact O-N 3.38Å; A116-L131 HydrophobicContact CB-CD1 3.48Å; A116-L131 VanDerWaalsContact CB-CD1 3.48Å; A116-L131 HydrophobicContact CB-CG 4.47Å; A116-V134 HydrophobicContact CB-CB 4.31Å; A116-V134 HydrophobicContact CB-CG1 4.04Å; A116-F135 HydrophobicContact CB-CD1 4.36Å; A116-F135 HydrophobicContact CB-CD2 4.11Å; A116-F135 HydrophobicContact CB-CE1 3.92Å; A116-F135 HydrophobicContact CB-CE2 3.67Å; A116-F135 HydrophobicContact CB-CG 4.44Å; A116-F135 HydrophobicContact CB-CZ 3.57Å
117K93.9Very high93.7Very high29 Ų2940.4 Ų40.413%0.12620%0.203CC..Hα-helixtrans-55.4-53.3168.8171.9-176.5168.5167.40111.2A59 T60 L113 L115 R119 L120 S121A59-K117 HydrophobicContact CB-CB 3.67Å; A59-K117 HydrophobicContact CB-CG 4.18Å; T60-K117 VanDerWaalsContact OG1-CD 3.29Å; T60-K117 WeakPolarHBondContact OG1-CD 3.14Å; T60-K117 WeakPolarHBondContact OG1-CE 3.41Å; T60-K117 PolarHBondContact OG1-NZ 3.1Å; L113-K117 WeakPolarHBondContact O-CB 3.32Å; L113-K117 PolarHBondContact O-N 3.45Å; L115-K117 VanDerWaalsContact C-N 3.3Å; L115-K117 PolarHBondContact O-N 2.79Å; K117-R119 VanDerWaalsContact C-N 3.35Å; K117-R119 PolarHBondContact O-N 3.37Å; K117-L120 PolarHBondContact O-N 2.77Å; K117-S121 PolarHBondContact O-N 3.34Å; K117-S121 PolarHBondContact O-OG 3.39Å
118A95.8Very high93.7Very high0 Ų039.6 Ų39.60%020%0.196CC..Hα-helixtrans-59.9-45.7-175.800000111.4D114 L115 S121 V122 Q215 T216D114-A118 PolarHBondContact O-N 3.32Å; D114-A118 VanDerWaalsContact O-N 3.1Å; L115-A118 PolarHBondContact O-N 3.03Å; L115-A118 VanDerWaalsContact O-N 3.1Å; A118-S121 PolarHBondContact O-N 3.39Å; A118-V122 PolarHBondContact O-N 2.92Å; A118-Q215 HydrophobicContact CB-CB 3.98Å; A118-T216 HydrophobicContact CB-CG2 4.1Å
119R96.1Very high93.6Very high6 Ų645.8 Ų45.82%0.02322%0.217CC..Hα-helixtrans-61.6-43.1174.5-73.6-179.5-179.7-149-10.4112.4L115 K117 S121 V122 S123 V134 T138 E142 Q215L115-R119 HydrophobicContact CD2-CG 4.44Å; L115-R119 PolarHBondContact O-N 3.4Å; K117-R119 VanDerWaalsContact C-N 3.35Å; K117-R119 PolarHBondContact O-N 3.37Å; R119-S121 VanDerWaalsContact C-N 3.33Å; R119-S121 PolarHBondContact O-N 2.99Å; R119-V122 WeakPolarHBondContact O-CG2 3.38Å; R119-V122 PolarHBondContact O-N 3.13Å; R119-S123 WeakPolarHBondContact O-CB 3.3Å; R119-S123 PolarHBondContact O-N 2.95Å; R119-S123 VanDerWaalsContact O-N 3.08Å; R119-S123 PolarHBondContact O-OG 3.18Å; R119-V134 HydrophobicContact CB-CG1 3.68Å; R119-V134 HydrophobicContact CG-CG1 4.35Å; R119-T138 PolarHBondContact NH1-OG1 3.47Å; R119-E142 IonicContact CZ-OE1 3.28Å; R119-E142 VanDerWaalsContact CZ-OE1 3.28Å; R119-E142 IonicContact CZ-OE2 3.59Å; R119-E142 IonicContact NH1-OE1 2.68Å; R119-E142 PolarHBondContact NH1-OE1 3.17Å; R119-E142 IonicContact NH1-OE2 3.57Å; R119-E142 VanDerWaalsContact NH2-CD 3.3Å; R119-E142 IonicContact NH2-OE1 3.09Å; R119-E142 PolarHBondContact NH2-OE1 3.36Å; R119-E142 VanDerWaalsContact NH2-OE1 3.09Å; R119-E142 IonicContact NH2-OE2 2.71Å; R119-E142 PolarHBondContact NH2-OE2 3.1Å; R119-Q215 VanDerWaalsContact CG-O 3.26Å; R119-Q215 WeakPolarHBondContact CG-O 3.15Å; R119-Q215 PolarHBondContact NE-O 2.93Å
120L95.7Very high93.5Very high5 Ų542.8 Ų42.83%0.02621%0.211CC..Hα-helixtrans-65.8-35.5179-168.866.3000112.4R55 A116 K117 S123 L131 V134R55-L120 VanDerWaalsContact NH2-CD1 3.25Å; A116-L120 VanDerWaalsContact O-CB 3.27Å; A116-L120 WeakPolarHBondContact O-CB 3.37Å; A116-L120 PolarHBondContact O-N 3.38Å; K117-L120 PolarHBondContact O-N 2.77Å; L120-S123 WeakPolarHBondContact CA-OG 3.44Å; L120-S123 PolarHBondContact O-OG 2.65Å; L120-L131 HydrophobicContact CD2-CB 4.37Å; L120-L131 HydrophobicContact CD2-CD1 4.33Å; L120-V134 HydrophobicContact CB-CG2 4.2Å; L120-V134 HydrophobicContact CD1-CG2 4.05Å
121S95.4Very high93.4Very high3 Ų344 Ų442%0.02122%0.217CC..Hα-helixtrans-67.1-35.6178.3-73.40000113.7R20 N24 R55 K117 A118 R119R20-S121 WeakPolarHBondContact CG-O 3.31Å; R20-S121 PolarHBondContact NE-O 2.65Å; N24-S121 PolarHBondContact ND2-O 3.38Å; R55-S121 PolarHBondContact O-OG 3.43Å; R55-S121 VanDerWaalsContact O-OG 3.06Å; K117-S121 PolarHBondContact O-N 3.34Å; K117-S121 PolarHBondContact O-OG 3.39Å; A118-S121 PolarHBondContact O-N 3.39Å; R119-S121 VanDerWaalsContact C-N 3.33Å; R119-S121 PolarHBondContact O-N 2.99Å
122V95.2Very high93.4Very high37 Ų3746.9 Ų46.922%0.22424%0.241CC..Hα-helixtrans-92.1-14.1-179.2-57.80000114.2I23 V27 A118 R119 T216I23-V122 HydrophobicContact CB-CG1 4.5Å; I23-V122 HydrophobicContact CG2-CG1 3.57Å; V27-V122 HydrophobicContact CB-CG1 4.36Å; V27-V122 HydrophobicContact CG2-CG1 4.28Å; A118-V122 PolarHBondContact O-N 2.92Å; R119-V122 WeakPolarHBondContact O-CG2 3.38Å; R119-V122 PolarHBondContact O-N 3.13Å; V122-T216 HydrophobicContact CB-CG2 4.39Å; V122-T216 HydrophobicContact CG1-CG2 3.9Å; V122-T216 HydrophobicContact CG2-CG2 3.57Å
123S93.9Very high93.5Very high2 Ų247.8 Ų47.81%0.01425%0.249CC..SBendtrans-93.1149.9-177.3560000113R55 R119 L120 Y128R55-S123 PolarHBondContact NE-O 3.3Å; R55-S123 PolarHBondContact NH2-O 3.26Å; R119-S123 WeakPolarHBondContact O-CB 3.3Å; R119-S123 PolarHBondContact O-N 2.95Å; R119-S123 VanDerWaalsContact O-N 3.08Å; R119-S123 PolarHBondContact O-OG 3.18Å; L120-S123 WeakPolarHBondContact CA-OG 3.44Å; L120-S123 PolarHBondContact O-OG 2.65Å; S123-Y128 WeakPolarHBondContact OG-CD2 3.09Å
124R90.6Very high93.6Very high172 Ų17246.1 Ų46.165%0.64924%0.241SC*.  trans-75.5157.2170.3-59.5-177.5-169.2172.83.7110.4S126 Q127 Y128R124-S126 PolarHBondContact O-N 2.77Å; R124-Q127 PolarHBondContact O-N 2.63Å; R124-Y128 PolarHBondContact O-N 2.9Å
125K88.6Confident93.7Very high97 Ų9747.9 Ų47.942%0.42225%0.248SC..THydrogen-bonded Turntrans-56.4-31.3175.5-77.3176.5176.9171.60113.2T52 Q127 Y128T52-K125 VanDerWaalsContact OG1-CE 3.29Å; T52-K125 WeakPolarHBondContact OG1-CE 3.35Å; T52-K125 PolarHBondContact OG1-NZ 2.71Å; T52-K125 VanDerWaalsContact OG1-NZ 3.08Å; K125-Q127 VanDerWaalsContact C-N 3.32Å; K125-Q127 PolarHBondContact O-N 2.77Å; K125-Y128 CarbonylContact O-C 3.42Å
126S90.3Very high93.7Very high110 Ų11051.9 Ų51.977%0.76927%0.272SS*.THydrogen-bonded Turntrans-66.7-30.5177.154.90000113.4R124R124-S126 PolarHBondContact O-N 2.77Å
127Q91.7Very high93.8Very high106 Ų10656.4 Ų56.450%0.49529%0.292SS..THydrogen-bonded Turntrans-84.3-42179.4-169.4-176.315.800111.7R124 K125R124-Q127 PolarHBondContact O-N 2.63Å; K125-Q127 VanDerWaalsContact C-N 3.32Å; K125-Q127 PolarHBondContact O-N 2.77Å
128Y93.1Very high93.9Very high16 Ų1655 Ų556%0.06329%0.286CS..  trans-141.5111.4178.7-65.3-68.9000110.4R55 S123 R124 K125 A133 V134 K137R55-Y128 PolarHBondContact NH2-O 2.78Å; S123-Y128 WeakPolarHBondContact OG-CD2 3.09Å; R124-Y128 PolarHBondContact O-N 2.9Å; K125-Y128 CarbonylContact O-C 3.42Å; Y128-A133 HydrophobicContact CD1-CB 4.43Å; Y128-V134 HydrophobicContact CD1-CB 4.21Å; Y128-V134 HydrophobicContact CD1-CG2 3.74Å; Y128-V134 HydrophobicContact CD2-CG2 4.19Å; Y128-V134 HydrophobicContact CE1-CB 4.4Å; Y128-V134 HydrophobicContact CE1-CG2 4.32Å; Y128-V134 HydrophobicContact CG-CG2 3.66Å; Y128-K137 HydrophobicContact CE1-CB 3.87Å; Y128-K137 HydrophobicContact CE1-CD 3.56Å; Y128-K137 HydrophobicContact CE1-CG 4.16Å
129K91.7Very high94Very high172 Ų17261.5 Ų61.575%0.74831%0.31SS*.SBendtrans-72.2-45.8177.5-68-175.5-179.9-179.60111.7
130T92.7Very high94Very high77 Ų7768.2 Ų68.247%0.47234%0.342SS..SBendtrans-129.5166.6-172.2650000111.8A132 A133 V134T130-A132 VanDerWaalsContact C-N 3.29Å; T130-A132 PolarHBondContact O-N 3.47Å; T130-A133 WeakPolarHBondContact O-CB 3.38Å; T130-A133 PolarHBondContact O-N 3.09Å; T130-A133 PolarHBondContact OG1-N 3.45Å; T130-A133 VanDerWaalsContact OG1-N 3.14Å; T130-V134 PolarHBondContact O-N 3.47Å
131L92.3Very high94Very high29 Ų2973 Ų7315%0.15237%0.371CS..Hα-helixtrans-61-40172.4-174.462.5000111.6A59 L113 A116 L120 A133 V134 F135A59-L131 HydrophobicContact CB-CD1 3.71Å; A59-L131 HydrophobicContact CB-CD2 3.74Å; A59-L131 HydrophobicContact CB-CG 4.34Å; L113-L131 HydrophobicContact CD2-CD2 3.97Å; A116-L131 HydrophobicContact CB-CD1 3.48Å; A116-L131 VanDerWaalsContact CB-CD1 3.48Å; A116-L131 HydrophobicContact CB-CG 4.47Å; L120-L131 HydrophobicContact CD2-CB 4.37Å; L120-L131 HydrophobicContact CD2-CD1 4.33Å; L131-A133 VanDerWaalsContact C-N 3.31Å; L131-A133 PolarHBondContact O-N 3.5Å; L131-V134 WeakPolarHBondContact O-CB 3Å; L131-V134 PolarHBondContact O-N 3.15Å; L131-V134 VanDerWaalsContact O-N 3.1Å; L131-F135 HydrophobicContact CD1-CE2 4.16Å; L131-F135 HydrophobicContact CD2-CE2 4.19Å; L131-F135 HydrophobicContact CG-CD2 4.12Å; L131-F135 HydrophobicContact CG-CE2 3.78Å; L131-F135 WeakPolarHBondContact O-CD2 3.4Å; L131-F135 PolarHBondContact O-N 2.87Å
132A94.2Very high94Very high60 Ų6075.5 Ų75.550%0.49638%0.382SS..Hα-helixtrans-60.2-40175.700000112.1T130 V134 F135 V136T130-A132 VanDerWaalsContact C-N 3.29Å; T130-A132 PolarHBondContact O-N 3.47Å; A132-V134 PolarHBondContact O-N 3.05Å; A132-F135 WeakPolarHBondContact O-CB 3.34Å; A132-F135 PolarHBondContact O-N 3.3Å; A132-F135 VanDerWaalsContact O-N 3.1Å; A132-V136 WeakPolarHBondContact O-CG2 3.33Å; A132-V136 PolarHBondContact O-N 2.88Å
133A95.4Very high93.9Very high35 Ų3574.7 Ų74.729%0.28938%0.381SS..Hα-helixtrans-61.4-34175.700000112.5Y128 T130 L131 K137Y128-A133 HydrophobicContact CD1-CB 4.43Å; T130-A133 WeakPolarHBondContact O-CB 3.38Å; T130-A133 PolarHBondContact O-N 3.09Å; T130-A133 PolarHBondContact OG1-N 3.45Å; T130-A133 VanDerWaalsContact OG1-N 3.14Å; L131-A133 VanDerWaalsContact C-N 3.31Å; L131-A133 PolarHBondContact O-N 3.5Å; A133-K137 WeakPolarHBondContact O-CB 3.38Å; A133-K137 PolarHBondContact O-N 2.95Å; A133-K137 VanDerWaalsContact O-N 3.09Å
134V95.2Very high94Very high0 Ų077.5 Ų77.50%040%0.4CS..Hα-helixtrans-64.9-47.5173-173.30000110.3A116 R119 L120 Y128 T130 L131 A132 T138A116-V134 HydrophobicContact CB-CB 4.31Å; A116-V134 HydrophobicContact CB-CG1 4.04Å; R119-V134 HydrophobicContact CB-CG1 3.68Å; R119-V134 HydrophobicContact CG-CG1 4.35Å; L120-V134 HydrophobicContact CB-CG2 4.2Å; L120-V134 HydrophobicContact CD1-CG2 4.05Å; Y128-V134 HydrophobicContact CD1-CB 4.21Å; Y128-V134 HydrophobicContact CD1-CG2 3.74Å; Y128-V134 HydrophobicContact CD2-CG2 4.19Å; Y128-V134 HydrophobicContact CE1-CB 4.4Å; Y128-V134 HydrophobicContact CE1-CG2 4.32Å; Y128-V134 HydrophobicContact CG-CG2 3.66Å; T130-V134 PolarHBondContact O-N 3.47Å; L131-V134 WeakPolarHBondContact O-CB 3Å; L131-V134 PolarHBondContact O-N 3.15Å; L131-V134 VanDerWaalsContact O-N 3.1Å; A132-V134 PolarHBondContact O-N 3.05Å; V134-T138 WeakPolarHBondContact O-CB 3.37Å; V134-T138 PolarHBondContact O-N 2.94Å; V134-T138 PolarHBondContact O-OG1 2.95Å
135F95.1Very high94.2Very high50 Ų5076.3 Ų76.322%0.21941%0.406CS..Hα-helixtrans-60-55.7178.9-80.8-67.8000112.4P112 L113 A116 L131 A132 K137 T138 W139 L147P112-F135 HydrophobicContact CB-CE1 3.62Å; P112-F135 HydrophobicContact CB-CZ 4.3Å; P112-F135 WeakPolarHBondContact O-CE1 3.18Å; P112-F135 WeakPolarHBondContact O-CZ 3.35Å; L113-F135 HydrophobicContact CD2-CE2 3.77Å; L113-F135 HydrophobicContact CD2-CZ 3.68Å; L113-F135 HydrophobicContact CG-CZ 4.09Å; A116-F135 HydrophobicContact CB-CD1 4.36Å; A116-F135 HydrophobicContact CB-CD2 4.11Å; A116-F135 HydrophobicContact CB-CE1 3.92Å; A116-F135 HydrophobicContact CB-CE2 3.67Å; A116-F135 HydrophobicContact CB-CG 4.44Å; A116-F135 HydrophobicContact CB-CZ 3.57Å; L131-F135 HydrophobicContact CD1-CE2 4.16Å; L131-F135 HydrophobicContact CD2-CE2 4.19Å; L131-F135 HydrophobicContact CG-CD2 4.12Å; L131-F135 HydrophobicContact CG-CE2 3.78Å; L131-F135 WeakPolarHBondContact O-CD2 3.4Å; L131-F135 PolarHBondContact O-N 2.87Å; A132-F135 WeakPolarHBondContact O-CB 3.34Å; A132-F135 PolarHBondContact O-N 3.3Å; A132-F135 VanDerWaalsContact O-N 3.1Å; F135-K137 PolarHBondContact O-N 2.91Å; F135-T138 PolarHBondContact O-N 3.46Å; F135-W139 VanDerWaalsContact O-CB 3.28Å; F135-W139 WeakPolarHBondContact O-CB 3.16Å; F135-W139 PolarHBondContact O-N 3.46Å; F135-L147 HydrophobicContact CD1-CD1 4.26Å; F135-L147 HydrophobicContact CD1-CD2 3.68Å; F135-L147 HydrophobicContact CE1-CD2 4.01Å
136V97Very high94.5Very high84 Ų8472 Ų7251%0.50939%0.388SS..Hα-helixtrans-57.1-50.6-1781730000110.2A132 T138 W139 H140A132-V136 WeakPolarHBondContact O-CG2 3.33Å; A132-V136 PolarHBondContact O-N 2.88Å; V136-T138 PolarHBondContact O-N 3.39Å; V136-W139 PolarHBondContact O-N 3.18Å; V136-H140 PolarHBondContact O-CD2 2.89Å; V136-H140 PolarHBondContact O-N 2.95Å
137K96.5Very high94.7Very high94 Ų9467.4 Ų67.441%0.40936%0.355SS..Hα-helixtrans-65.4-41.6-179.9-172171.4-179.2177.80112.3Y128 A133 F135 W139 H140 V141Y128-K137 HydrophobicContact CE1-CB 3.87Å; Y128-K137 HydrophobicContact CE1-CD 3.56Å; Y128-K137 HydrophobicContact CE1-CG 4.16Å; A133-K137 WeakPolarHBondContact O-CB 3.38Å; A133-K137 PolarHBondContact O-N 2.95Å; A133-K137 VanDerWaalsContact O-N 3.09Å; F135-K137 PolarHBondContact O-N 2.91Å; K137-W139 VanDerWaalsContact C-N 3.34Å; K137-H140 PolarHBondContact O-N 3.22Å; K137-V141 HydrophobicContact CG-CG2 3.82Å; K137-V141 WeakPolarHBondContact O-CB 3.31Å; K137-V141 VanDerWaalsContact O-CG2 3.28Å; K137-V141 WeakPolarHBondContact O-CG2 3.4Å; K137-V141 PolarHBondContact O-N 3.04Å
138T95.9Very high94.9Very high0 Ų067 Ų670%035%0.349CS..Hα-helixtrans-62.8-44.6178.3-55.90000110.6L115 R119 V134 F135 V136 E142 G143 A146 L147L115-T138 HydrophobicContact CD2-CG2 4.34Å; R119-T138 PolarHBondContact NH1-OG1 3.47Å; V134-T138 WeakPolarHBondContact O-CB 3.37Å; V134-T138 PolarHBondContact O-N 2.94Å; V134-T138 PolarHBondContact O-OG1 2.95Å; F135-T138 PolarHBondContact O-N 3.46Å; V136-T138 PolarHBondContact O-N 3.39Å; T138-E142 WeakPolarHBondContact O-CB 3.42Å; T138-E142 PolarHBondContact O-N 3.13Å; T138-G143 PolarHBondContact O-N 3.41Å; T138-A146 HydrophobicContact CG2-CB 3.83Å; T138-L147 HydrophobicContact CG2-CD2 3.75Å; T138-L147 HydrophobicContact CG2-CG 4.27Å
139W96.6Very high95.1Very high136 Ų13667.5 Ų67.552%0.51535%0.351SS..Hα-helixtrans-60.8-47.6178.8-176.7-83.3000112.4F135 V136 K137 G143 P144 L147F135-W139 VanDerWaalsContact O-CB 3.28Å; F135-W139 WeakPolarHBondContact O-CB 3.16Å; F135-W139 PolarHBondContact O-N 3.46Å; V136-W139 PolarHBondContact O-N 3.18Å; K137-W139 VanDerWaalsContact C-N 3.34Å; W139-G143 CarbonylContact O-C 3.5Å; W139-G143 WeakPolarHBondContact O-CA 3.4Å; W139-G143 PolarHBondContact O-N 2.72Å; W139-P144 HydrophobicContact CD2-CB 4.15Å; W139-P144 HydrophobicContact CE3-CB 3.72Å; W139-P144 HydrophobicContact CH2-CB 3.62Å; W139-P144 HydrophobicContact CZ2-CB 4.03Å; W139-P144 HydrophobicContact CZ3-CB 3.45Å; W139-P144 VanDerWaalsContact CZ3-CB 3.45Å; W139-L147 HydrophobicContact CE3-CD1 3.81Å; W139-L147 HydrophobicContact CZ3-CD1 4.29Å
140H97.4Very high95.3Very high147 Ų14759.5 Ų59.568%0.68132%0.318SS*.Hα-helixtrans-80.2-33.1-176.6-72.5-68.3000114.2V136 K137V136-H140 PolarHBondContact O-CD2 2.89Å; V136-H140 PolarHBondContact O-N 2.95Å; K137-H140 PolarHBondContact O-N 3.22Å
141V95.4Very high95.4Very high106 Ų10657.3 Ų57.364%0.64230%0.304SS*.Hα-helixtrans-91.4-40.5-174.8179.30000112.5K137K137-V141 HydrophobicContact CG-CG2 3.82Å; K137-V141 WeakPolarHBondContact O-CB 3.31Å; K137-V141 VanDerWaalsContact O-CG2 3.28Å; K137-V141 WeakPolarHBondContact O-CG2 3.4Å; K137-V141 PolarHBondContact O-N 3.04Å
142E94.4Very high95.5Very high55 Ų5559.8 Ų59.826%0.25732%0.32SS..Hα-helixtrans-109.4-8.4-175.8-62.5174.8-130.900112.9R119 T138 A146R119-E142 IonicContact CZ-OE1 3.28Å; R119-E142 VanDerWaalsContact CZ-OE1 3.28Å; R119-E142 IonicContact CZ-OE2 3.59Å; R119-E142 IonicContact NH1-OE1 2.68Å; R119-E142 PolarHBondContact NH1-OE1 3.17Å; R119-E142 IonicContact NH1-OE2 3.57Å; R119-E142 VanDerWaalsContact NH2-CD 3.3Å; R119-E142 IonicContact NH2-OE1 3.09Å; R119-E142 PolarHBondContact NH2-OE1 3.36Å; R119-E142 VanDerWaalsContact NH2-OE1 3.09Å; R119-E142 IonicContact NH2-OE2 2.71Å; R119-E142 PolarHBondContact NH2-OE2 3.1Å; T138-E142 WeakPolarHBondContact O-CB 3.42Å; T138-E142 PolarHBondContact O-N 3.13Å; E142-A146 HydrophobicContact CB-CB 3.38Å; E142-A146 HydrophobicContact CG-CB 4.49Å
143G95.1Very high95.7Very high20 Ų2057 Ų5721%0.20630%0.297CS..  trans87.2166.8-177.500000113.9T138 W139 L145 A146T138-G143 PolarHBondContact O-N 3.41Å; W139-G143 CarbonylContact O-C 3.5Å; W139-G143 WeakPolarHBondContact O-CA 3.4Å; W139-G143 PolarHBondContact O-N 2.72Å; G143-L145 VanDerWaalsContact C-N 3.33Å; G143-L145 PolarHBondContact O-N 3.24Å; G143-A146 VanDerWaalsContact O-CB 3.28Å; G143-A146 WeakPolarHBondContact O-CB 3.25Å; G143-A146 PolarHBondContact O-N 2.87Å; G143-A146 VanDerWaalsContact O-N 3.16Å
144P94.8Very high95.6Very high62 Ų6256.3 Ų56.340%0.40329%0.289SS..G310 helixtrans-63.1-35.8-175.324.4-35.2000113.4W139 A146 L147W139-P144 HydrophobicContact CD2-CB 4.15Å; W139-P144 HydrophobicContact CE3-CB 3.72Å; W139-P144 HydrophobicContact CH2-CB 3.62Å; W139-P144 HydrophobicContact CZ2-CB 4.03Å; W139-P144 HydrophobicContact CZ3-CB 3.45Å; W139-P144 VanDerWaalsContact CZ3-CB 3.45Å; P144-A146 PolarHBondContact O-N 3.42Å; P144-L147 WeakPolarHBondContact O-CB 3.44Å; P144-L147 PolarHBondContact O-N 2.93Å
145L94.3Very high95.6Very high147 Ų14759.8 Ų59.877%0.7731%0.307SS*.G310 helixtrans-64.7-23.9179-67.5174.2000112.7G143 L147 Y148G143-L145 VanDerWaalsContact C-N 3.33Å; G143-L145 PolarHBondContact O-N 3.24Å; L145-L147 PolarHBondContact O-N 3.46Å; L145-Y148 PolarHBondContact O-N 3.29Å
146A95.2Very high95.7Very high7 Ų761.1 Ų61.16%0.05832%0.316CS..G310 helixtrans-63-24177.200000112.6L115 T138 E142 G143 P144 Y148 R149L115-A146 WeakPolarHBondContact CD1-O 3.49Å; T138-A146 HydrophobicContact CG2-CB 3.83Å; E142-A146 HydrophobicContact CB-CB 3.38Å; E142-A146 HydrophobicContact CG-CB 4.49Å; G143-A146 VanDerWaalsContact O-CB 3.28Å; G143-A146 WeakPolarHBondContact O-CB 3.25Å; G143-A146 PolarHBondContact O-N 2.87Å; G143-A146 VanDerWaalsContact O-N 3.16Å; P144-A146 PolarHBondContact O-N 3.42Å; A146-Y148 PolarHBondContact O-N 3.31Å; A146-R149 WeakPolarHBondContact O-CB 3.37Å; A146-R149 PolarHBondContact O-N 2.95Å
147L95.6Very high95.7Very high12 Ų1257.7 Ų57.76%0.06330%0.298CS..G310 helixtrans-66.1-19.2174.1-66.7175.6000113.5Y111 P112 L115 F135 T138 W139 P144 L145Y111-L147 WeakPolarHBondContact CD1-O 3.5Å; P112-L147 HydrophobicContact CB-CB 4.03Å; P112-L147 HydrophobicContact CB-CD1 4.33Å; P112-L147 HydrophobicContact CG-CB 4.22Å; L115-L147 HydrophobicContact CD2-CD2 4.17Å; F135-L147 HydrophobicContact CD1-CD1 4.26Å; F135-L147 HydrophobicContact CD1-CD2 3.68Å; F135-L147 HydrophobicContact CE1-CD2 4.01Å; T138-L147 HydrophobicContact CG2-CD2 3.75Å; T138-L147 HydrophobicContact CG2-CG 4.27Å; W139-L147 HydrophobicContact CE3-CD1 3.81Å; W139-L147 HydrophobicContact CZ3-CD1 4.29Å; P144-L147 WeakPolarHBondContact O-CB 3.44Å; P144-L147 PolarHBondContact O-N 2.93Å; L145-L147 PolarHBondContact O-N 3.46Å
148Y96.2Very high95.6Very high98 Ų9857.2 Ų57.238%0.38430%0.302SS..G310 helixtrans-98.87.7177.5-69.5-88.8000113.3S108 Y111 P112 L145 A146 G150 V151S108-Y148 VanDerWaalsContact O-CE1 3.31Å; S108-Y148 WeakPolarHBondContact O-CE1 3.45Å; Y111-Y148 HydrophobicContact CD1-CD1 4.18Å; Y111-Y148 VanDerWaalsContact CE1-C 3.47Å; P112-Y148 HydrophobicContact CG-CE1 4.36Å; P112-Y148 HydrophobicContact CG-CE2 4.13Å; L145-Y148 PolarHBondContact O-N 3.29Å; A146-Y148 PolarHBondContact O-N 3.31Å; Y148-G150 PolarHBondContact O-N 2.95Å; Y148-V151 VanDerWaalsContact O-CB 3.29Å; Y148-V151 WeakPolarHBondContact O-CB 2.88Å; Y148-V151 VanDerWaalsContact O-CG1 3.23Å; Y148-V151 WeakPolarHBondContact O-CG1 3.17Å; Y148-V151 PolarHBondContact O-N 3.3Å
149R95.4Very high95.6Very high27 Ų2763 Ų6310%0.10233%0.332CS..THydrogen-bonded Turntrans-64.8128.2-176.9-167.1171.7175.3-168.1-8111.6Y111 L115 A146 M214 Q215 T219 P220Y111-R149 WeakPolarHBondContact CE1-O 3.36Å; Y111-R149 PolarHBondContact OH-O 2.87Å; L115-R149 HydrophobicContact CD1-CB 3.79Å; A146-R149 WeakPolarHBondContact O-CB 3.37Å; A146-R149 PolarHBondContact O-N 2.95Å; R149-M214 WeakPolarHBondContact CD-O 3.45Å; R149-M214 HydrophobicContact CG-CB 4.14Å; R149-M214 WeakPolarHBondContact CG-O 3.39Å; R149-M214 PolarHBondContact NE-O 3.3Å; R149-M214 VanDerWaalsContact NE-O 3.15Å; R149-Q215 WeakPolarHBondContact O-CG 3.25Å; R149-T219 PolarHBondContact NH1-O 3.4Å; R149-T219 PolarHBondContact NH2-O 3.42Å; R149-T219 PolarHBondContact NH2-OG1 3.41Å; R149-P220 VanDerWaalsContact NH2-C 3.35Å; R149-P220 PolarHBondContact NH2-O 2.92Å
150G95.9Very high95.6Very high4 Ų458.2 Ų58.24%0.04132%0.319CS..THydrogen-bonded Turntrans86.16.2-174.700000114.9Y111 Y148 V152 P153 T154Y111-G150 VanDerWaalsContact OH-CA 3.3Å; Y111-G150 WeakPolarHBondContact OH-CA 3.2Å; Y111-G150 PolarHBondContact OH-O 3.41Å; Y111-G150 VanDerWaalsContact OH-O 3.07Å; Y148-G150 PolarHBondContact O-N 2.95Å; G150-V152 VanDerWaalsContact C-N 3.32Å; G150-V152 PolarHBondContact O-N 3.48Å; G150-P153 VanDerWaalsContact C-CD 3.47Å; G150-P153 VanDerWaalsContact O-CD 3.25Å; G150-P153 WeakPolarHBondContact O-CD 3.49Å; G150-P153 VanDerWaalsContact O-CG 3.24Å; G150-P153 WeakPolarHBondContact O-CG 3.23Å; G150-T154 PolarHBondContact O-N 3.32Å; G150-T154 VanDerWaalsContact O-N 3.16Å; G150-T154 PolarHBondContact O-OG1 3.43Å
151V95.5Very high95.7Very high30 Ų3056 Ų5618%0.18231%0.305CS..Hα-helixtrans-63.1-40.8176.969.10000111.1Y111 Y148 T154 L155Y111-V151 HydrophobicContact CD1-CB 4.33Å; Y111-V151 HydrophobicContact CD2-CB 4.22Å; Y111-V151 HydrophobicContact CD2-CG2 4Å; Y111-V151 HydrophobicContact CE1-CB 4.08Å; Y111-V151 HydrophobicContact CE2-CB 3.96Å; Y111-V151 HydrophobicContact CE2-CG2 4.13Å; Y111-V151 HydrophobicContact CG-CB 4.41Å; Y111-V151 HydrophobicContact CG-CG2 4.31Å; Y111-V151 PolarHBondContact OH-N 3.41Å; Y148-V151 VanDerWaalsContact O-CB 3.29Å; Y148-V151 WeakPolarHBondContact O-CB 2.88Å; Y148-V151 VanDerWaalsContact O-CG1 3.23Å; Y148-V151 WeakPolarHBondContact O-CG1 3.17Å; Y148-V151 PolarHBondContact O-N 3.3Å; V151-T154 WeakPolarHBondContact O-CA 3.31Å; V151-T154 VanDerWaalsContact O-CB 3.24Å; V151-T154 WeakPolarHBondContact O-CB 3.34Å; V151-T154 PolarHBondContact O-N 3.33Å; V151-T154 VanDerWaalsContact O-N 3.09Å; V151-L155 HydrophobicContact CG2-CD1 4.15Å; V151-L155 HydrophobicContact CG2-CG 4.32Å; V151-L155 WeakPolarHBondContact O-CG 3.38Å; V151-L155 PolarHBondContact O-N 3.13Å
152V95.4Very high95.7Very high81 Ų8152.3 Ų52.349%0.49129%0.285SS..Hα-helixtrans-59.4-54.1178.9-174.70000112.5G150 T154 L155 L156 I225G150-V152 VanDerWaalsContact C-N 3.32Å; G150-V152 PolarHBondContact O-N 3.48Å; V152-T154 PolarHBondContact O-N 2.84Å; V152-L155 PolarHBondContact O-N 3.38Å; V152-L156 HydrophobicContact CG1-CD1 3.93Å; V152-L156 HydrophobicContact CG1-CG 4.26Å; V152-L156 WeakPolarHBondContact O-CB 3.23Å; V152-L156 WeakPolarHBondContact O-CG 3.34Å; V152-L156 PolarHBondContact O-N 2.9Å; V152-I225 HydrophobicContact CB-CD1 4.12Å; V152-I225 HydrophobicContact CG1-CD1 3.66Å
153P96.8Very high95.9Very high1 Ų151.8 Ų51.81%0.00630%0.295CS..Hα-helixtrans-64.4-25.4175.325-34.1000113G150 G157 L207 V210 R211 M214 I225G150-P153 VanDerWaalsContact C-CD 3.47Å; G150-P153 VanDerWaalsContact O-CD 3.25Å; G150-P153 WeakPolarHBondContact O-CD 3.49Å; G150-P153 VanDerWaalsContact O-CG 3.24Å; G150-P153 WeakPolarHBondContact O-CG 3.23Å; P153-G157 PolarHBondContact O-N 3.47Å; P153-L207 HydrophobicContact CB-CD2 4.2Å; P153-V210 HydrophobicContact CB-CB 4.48Å; P153-V210 HydrophobicContact CB-CG1 4.24Å; P153-V210 HydrophobicContact CG-CG1 4.3Å; P153-R211 HydrophobicContact CB-CB 4.31Å; P153-R211 HydrophobicContact CG-CB 4.12Å; P153-M214 HydrophobicContact CG-SD 3.95Å; P153-I225 HydrophobicContact CB-CD1 4.09Å; P153-I225 HydrophobicContact CB-CG1 4.42Å; P153-I225 HydrophobicContact CG-CD1 4.39Å; P153-I225 HydrophobicContact CG-CG1 4.47Å
154T95.2Very high96.1Very high21 Ų2152.8 Ų52.813%0.12930%0.297CS..Hα-helixtrans-64.3-49.4172.5-55.80000111.1Y111 G150 V151 V152 G157 R211Y111-T154 HydrophobicContact CE2-CG2 4.35Å; G150-T154 PolarHBondContact O-N 3.32Å; G150-T154 VanDerWaalsContact O-N 3.16Å; G150-T154 PolarHBondContact O-OG1 3.43Å; V151-T154 WeakPolarHBondContact O-CA 3.31Å; V151-T154 VanDerWaalsContact O-CB 3.24Å; V151-T154 WeakPolarHBondContact O-CB 3.34Å; V151-T154 PolarHBondContact O-N 3.33Å; V151-T154 VanDerWaalsContact O-N 3.09Å; V152-T154 PolarHBondContact O-N 2.84Å; T154-G157 PolarHBondContact O-N 3.48Å; T154-R211 WeakPolarHBondContact OG1-CD 3.28Å; T154-R211 WeakPolarHBondContact OG1-CG 3.47Å; T154-R211 PolarHBondContact OG1-NE 2.91Å
155L94.6Very high96.2Very high74 Ų7450.6 Ų50.639%0.38728%0.283SS..Hα-helixtrans-68-45.7179.5-65.6175.3000111.5V151 V152 G157 V158V151-L155 HydrophobicContact CG2-CD1 4.15Å; V151-L155 HydrophobicContact CG2-CG 4.32Å; V151-L155 WeakPolarHBondContact O-CG 3.38Å; V151-L155 PolarHBondContact O-N 3.13Å; V152-L155 PolarHBondContact O-N 3.38Å; L155-G157 PolarHBondContact O-N 3.05Å; L155-V158 WeakPolarHBondContact O-CB 3.32Å; L155-V158 PolarHBondContact O-N 2.85Å; L155-V158 VanDerWaalsContact O-N 3.09Å
156L96.3Very high96.4Very high78 Ų7850 Ų5041%0.40828%0.275SS..Hα-helixtrans-60-33.3175.7-71.4178.2000111.9V152 V158 I159 P160 L207 I225V152-L156 HydrophobicContact CG1-CD1 3.93Å; V152-L156 HydrophobicContact CG1-CG 4.26Å; V152-L156 WeakPolarHBondContact O-CB 3.23Å; V152-L156 WeakPolarHBondContact O-CG 3.34Å; V152-L156 PolarHBondContact O-N 2.9Å; L156-V158 PolarHBondContact O-N 3.16Å; L156-I159 PolarHBondContact O-N 3.16Å; L156-P160 WeakPolarHBondContact O-CD 3.4Å; L156-L207 HydrophobicContact CB-CD1 3.93Å; L156-I225 HydrophobicContact CD1-CD1 3.75Å
157G96.5Very high96.6Very high11 Ų1156.8 Ų56.811%0.11330%0.303CS..Hα-helixtrans-67.1-21.8178.100000114.1P153 T154 L155 I159 P160 Y161 S204P153-G157 PolarHBondContact O-N 3.47Å; T154-G157 PolarHBondContact O-N 3.48Å; L155-G157 PolarHBondContact O-N 3.05Å; G157-I159 VanDerWaalsContact C-N 3.34Å; G157-P160 WeakPolarHBondContact O-CD 3.21Å; G157-Y161 VanDerWaalsContact O-CB 3.24Å; G157-Y161 WeakPolarHBondContact O-CB 3.29Å; G157-Y161 PolarHBondContact O-N 3.32Å; G157-S204 WeakPolarHBondContact O-CB 2.96Å
158V94.7Very high96.7Very high84 Ų8457.2 Ų57.251%0.50931%0.306SS..Hα-helixtrans-65.2-38.5177.1178.80000111.1L155 L156 Y161 A162L155-V158 WeakPolarHBondContact O-CB 3.32Å; L155-V158 PolarHBondContact O-N 2.85Å; L155-V158 VanDerWaalsContact O-N 3.09Å; L156-V158 PolarHBondContact O-N 3.16Å; V158-Y161 PolarHBondContact O-N 2.91Å; V158-A162 VanDerWaalsContact O-CB 3.22Å; V158-A162 WeakPolarHBondContact O-CB 3.28Å; V158-A162 PolarHBondContact O-N 3.32Å
159I96.3Very high96.8Very high121 Ų12155.1 Ų55.162%0.62130%0.298SS*.Hα-helixtrans-62-58.1-177.4-59.8172.2000112.2L156 G157 Y161 A162 G163L156-I159 PolarHBondContact O-N 3.16Å; G157-I159 VanDerWaalsContact C-N 3.34Å; I159-Y161 VanDerWaalsContact C-N 3.29Å; I159-Y161 PolarHBondContact O-N 2.9Å; I159-A162 PolarHBondContact O-N 3.06Å; I159-G163 PolarHBondContact O-N 2.75Å
160P97.7Very high96.9Very high37 Ų3757.5 Ų57.524%0.2431%0.311CS..Hα-helixtrans-66.7-32178.726.5-33.1000111.9L156 G157 T164 A203 L207L156-P160 WeakPolarHBondContact O-CD 3.4Å; G157-P160 WeakPolarHBondContact O-CD 3.21Å; P160-T164 WeakPolarHBondContact O-CB 3.41Å; P160-T164 PolarHBondContact O-N 3.16Å; P160-T164 VanDerWaalsContact O-N 3.09Å; P160-T164 PolarHBondContact O-OG1 3.07Å; P160-A203 HydrophobicContact CB-CB 4.29Å; P160-L207 HydrophobicContact CG-CD1 4.28Å
161Y97.7Very high97Very high100 Ų10059.2 Ų59.239%0.39232%0.322SS..Hα-helixtrans-62.1-57.6174.5175.5-94.2000111.2G157 V158 I159 S165 G200 Q201G157-Y161 VanDerWaalsContact O-CB 3.24Å; G157-Y161 WeakPolarHBondContact O-CB 3.29Å; G157-Y161 PolarHBondContact O-N 3.32Å; V158-Y161 PolarHBondContact O-N 2.91Å; I159-Y161 VanDerWaalsContact C-N 3.29Å; I159-Y161 PolarHBondContact O-N 2.9Å; Y161-S165 WeakPolarHBondContact O-CB 3.26Å; Y161-S165 PolarHBondContact O-N 3.34Å; Y161-S165 PolarHBondContact O-OG 3.06Å; Y161-G200 VanDerWaalsContact CD2-C 3.49Å; Y161-Q201 HydrophobicContact CD2-CG 4.29Å; Y161-Q201 HydrophobicContact CE2-CG 3.91Å
162A97.1Very high97.1Very high28 Ų2859.8 Ų59.823%0.23132%0.324CS..Hα-helixtrans-65.9-48.8-176.700000110.8V158 I159 T164 S165 F166V158-A162 VanDerWaalsContact O-CB 3.22Å; V158-A162 WeakPolarHBondContact O-CB 3.28Å; V158-A162 PolarHBondContact O-N 3.32Å; I159-A162 PolarHBondContact O-N 3.06Å; A162-T164 PolarHBondContact O-N 3.48Å; A162-S165 PolarHBondContact O-N 3.07Å; A162-F166 HydrophobicContact CB-CD2 4.26Å; A162-F166 HydrophobicContact CB-CE2 4.29Å; A162-F166 WeakPolarHBondContact O-CB 2.94Å; A162-F166 WeakPolarHBondContact O-CD2 3.31Å; A162-F166 PolarHBondContact O-N 3.07Å
163G98Very high97.1Very high44 Ų4458.3 Ų58.345%0.45431%0.31SS..Hα-helixtrans-57.1-51-179.700000112.3I159 F167I159-G163 PolarHBondContact O-N 2.75Å; G163-F167 WeakPolarHBondContact O-CB 3.45Å; G163-F167 PolarHBondContact O-N 2.9Å
164T98.5Very high97Very high41 Ų4163.9 Ų63.925%0.25234%0.34SS..Hα-helixtrans-67.8-38.2179.2-50.60000111.8P160 A162 T168 C199 A203P160-T164 WeakPolarHBondContact O-CB 3.41Å; P160-T164 PolarHBondContact O-N 3.16Å; P160-T164 VanDerWaalsContact O-N 3.09Å; P160-T164 PolarHBondContact O-OG1 3.07Å; A162-T164 PolarHBondContact O-N 3.48Å; T164-T168 VanDerWaalsContact O-CB 3.26Å; T164-T168 WeakPolarHBondContact O-CB 3.25Å; T164-T168 PolarHBondContact O-N 3.42Å; T164-T168 PolarHBondContact O-OG1 2.91Å; T164-C199 HydrophobicContact CG2-CB 3.85Å; T164-A203 HydrophobicContact CG2-CB 4.13Å; T164-A203 WeakPolarHBondContact OG1-CB 3.16Å
165S98.1Very high97Very high17 Ų1767.9 Ų67.912%0.11936%0.36CS..Hα-helixtrans-64.8-49.7178.3-580000111.1Y161 A162 T168 Y169 A196Y161-S165 WeakPolarHBondContact O-CB 3.26Å; Y161-S165 PolarHBondContact O-N 3.34Å; Y161-S165 PolarHBondContact O-OG 3.06Å; A162-S165 PolarHBondContact O-N 3.07Å; S165-T168 PolarHBondContact O-N 2.68Å; S165-Y169 VanDerWaalsContact O-CB 3.25Å; S165-Y169 WeakPolarHBondContact O-CB 3.21Å; S165-Y169 PolarHBondContact O-N 3.49Å; S165-A196 VanDerWaalsContact O-CB 3.25Å; S165-A196 WeakPolarHBondContact O-CB 3.36Å; S165-A196 PolarHBondContact OG-O 3.22Å
166F98Very high97.1Very high135 Ų13565.1 Ų65.159%0.59235%0.345SS*.Hα-helixtrans-63.9-45.4178.5-78-62.9000111.7A162 T168 Y169 E170A162-F166 HydrophobicContact CB-CD2 4.26Å; A162-F166 HydrophobicContact CB-CE2 4.29Å; A162-F166 WeakPolarHBondContact O-CB 2.94Å; A162-F166 WeakPolarHBondContact O-CD2 3.31Å; A162-F166 PolarHBondContact O-N 3.07Å; F166-T168 PolarHBondContact O-N 3.31Å; F166-Y169 PolarHBondContact O-N 3.02Å; F166-E170 WeakPolarHBondContact O-CB 3.05Å; F166-E170 WeakPolarHBondContact O-CG 3.1Å; F166-E170 PolarHBondContact O-N 2.84Å
167F98.5Very high96.9Very high148 Ų14863.9 Ų63.965%0.64935%0.345SS*.Hα-helixtrans-54.5-54.5174.6175.5-99.6000111.2G163 Y169 E170 S171G163-F167 WeakPolarHBondContact O-CB 3.45Å; G163-F167 PolarHBondContact O-N 2.9Å; F167-Y169 PolarHBondContact O-N 3.16Å; F167-E170 PolarHBondContact O-N 3.35Å; F167-S171 WeakPolarHBondContact O-CB 3.35Å; F167-S171 PolarHBondContact O-N 3.3Å; F167-S171 PolarHBondContact O-OG 3.03Å
168T98.5Very high96.7Very high21 Ų2170.3 Ų70.313%0.12937%0.373CS..Hα-helixtrans-61-44.7-178.9-53.60000111.8T164 S165 F166 L172 I195 A196 C199T164-T168 VanDerWaalsContact O-CB 3.26Å; T164-T168 WeakPolarHBondContact O-CB 3.25Å; T164-T168 PolarHBondContact O-N 3.42Å; T164-T168 PolarHBondContact O-OG1 2.91Å; S165-T168 PolarHBondContact O-N 2.68Å; F166-T168 PolarHBondContact O-N 3.31Å; T168-L172 HydrophobicContact CG2-CD1 3.98Å; T168-L172 HydrophobicContact CG2-CG 4.46Å; T168-L172 WeakPolarHBondContact O-CB 3.23Å; T168-L172 VanDerWaalsContact O-CG 3.25Å; T168-L172 WeakPolarHBondContact O-CG 3.42Å; T168-L172 PolarHBondContact O-N 3.24Å; T168-I195 HydrophobicContact CG2-CG2 4.12Å; T168-A196 HydrophobicContact CG2-CB 4.23Å; T168-C199 HydrophobicContact CG2-CB 4.33Å
169Y98.2Very high96.6Very high55 Ų5575.2 Ų75.222%0.21639%0.387CS..Hα-helixtrans-63.2-47.7-178.9-177.9-110.7000111.9S165 F166 F167 L172 K173 F192S165-Y169 VanDerWaalsContact O-CB 3.25Å; S165-Y169 WeakPolarHBondContact O-CB 3.21Å; S165-Y169 PolarHBondContact O-N 3.49Å; F166-Y169 PolarHBondContact O-N 3.02Å; F167-Y169 PolarHBondContact O-N 3.16Å; Y169-L172 PolarHBondContact O-N 2.97Å; Y169-K173 HydrophobicContact CD1-CD 3.73Å; Y169-K173 HydrophobicContact CE1-CD 3.36Å; Y169-K173 HydrophobicContact CE1-CG 4.47Å; Y169-K173 HydrophobicContact CE2-CD 4.24Å; Y169-K173 HydrophobicContact CG-CD 4.34Å; Y169-K173 VanDerWaalsContact O-CG 3.31Å; Y169-K173 WeakPolarHBondContact O-CG 3.39Å; Y169-K173 PolarHBondContact O-N 3.5Å; Y169-K173 VanDerWaalsContact O-N 3.07Å; Y169-F192 HydrophobicContact CD2-CB 3.76Å; Y169-F192 HydrophobicContact CE2-CB 3.9Å
170E97.6Very high96.1Very high77 Ų7771.7 Ų71.736%0.3637%0.373SS..Hα-helixtrans-69.7-39.4179.9-67.5-56.4139.600111.8F166 F167 L172 K173 L174F166-E170 WeakPolarHBondContact O-CB 3.05Å; F166-E170 WeakPolarHBondContact O-CG 3.1Å; F166-E170 PolarHBondContact O-N 2.84Å; F167-E170 PolarHBondContact O-N 3.35Å; E170-L172 PolarHBondContact O-N 3.5Å; E170-K173 PolarHBondContact O-N 2.81Å; E170-K173 IonicContact OE1-NZ 3.58Å; E170-K173 PolarHBondContact OE1-NZ 3.02Å; E170-K173 IonicContact OE2-NZ 3.04Å; E170-K173 PolarHBondContact OE2-NZ 3.49Å; E170-L174 VanDerWaalsContact O-CG 3.32Å; E170-L174 WeakPolarHBondContact O-CG 3.49Å; E170-L174 PolarHBondContact O-N 3.3Å
171S98.1Very high95.3Very high39 Ų3979.3 Ų79.327%0.27340%0.402SS..Hα-helixtrans-59-44.8173-64.20000112.2F167 K173 L174 L175F167-S171 WeakPolarHBondContact O-CB 3.35Å; F167-S171 PolarHBondContact O-N 3.3Å; F167-S171 PolarHBondContact O-OG 3.03Å; S171-K173 VanDerWaalsContact C-N 3.34Å; S171-K173 PolarHBondContact O-N 2.89Å; S171-L174 PolarHBondContact O-N 3.09Å; S171-L175 WeakPolarHBondContact O-CB 3.31Å; S171-L175 VanDerWaalsContact O-CG 3.28Å; S171-L175 WeakPolarHBondContact O-CG 3.3Å; S171-L175 PolarHBondContact O-N 2.93Å
172L97.5Very high94.9Very high43 Ų4380.5 Ų80.523%0.22541%0.406CS..Hα-helixtrans-64.4-38.4177.6-72.3171.9000112.3T168 Y169 E170 H176 F192 I195T168-L172 HydrophobicContact CG2-CD1 3.98Å; T168-L172 HydrophobicContact CG2-CG 4.46Å; T168-L172 WeakPolarHBondContact O-CB 3.23Å; T168-L172 VanDerWaalsContact O-CG 3.25Å; T168-L172 WeakPolarHBondContact O-CG 3.42Å; T168-L172 PolarHBondContact O-N 3.24Å; Y169-L172 PolarHBondContact O-N 2.97Å; E170-L172 PolarHBondContact O-N 3.5Å; L172-H176 VanDerWaalsContact O-CB 3.3Å; L172-H176 WeakPolarHBondContact O-CB 3.48Å; L172-H176 PolarHBondContact O-N 3.14Å; L172-F192 HydrophobicContact CB-CB 4.19Å; L172-F192 HydrophobicContact CB-CD1 3.87Å; L172-F192 HydrophobicContact CB-CD2 4.09Å; L172-F192 HydrophobicContact CB-CE1 4.27Å; L172-F192 HydrophobicContact CB-CE2 4.46Å; L172-F192 HydrophobicContact CB-CG 3.79Å; L172-F192 HydrophobicContact CD1-CB 4.08Å; L172-F192 HydrophobicContact CD1-CD1 3.96Å; L172-F192 HydrophobicContact CD1-CG 4.21Å; L172-F192 HydrophobicContact CG-CD1 4.38Å; L172-I195 HydrophobicContact CD1-CB 4.08Å; L172-I195 HydrophobicContact CD1-CD1 4.35Å; L172-I195 HydrophobicContact CD1-CG2 3.92Å
173K96.3Very high94.5Very high49 Ų4987.6 Ų87.621%0.21344%0.435CS..Hα-helixtrans-64.8-43.5175.1-72.2170.358.7-146.20112.1Y169 E170 S171 H176 A177 I184 F192Y169-K173 HydrophobicContact CD1-CD 3.73Å; Y169-K173 HydrophobicContact CE1-CD 3.36Å; Y169-K173 HydrophobicContact CE1-CG 4.47Å; Y169-K173 HydrophobicContact CE2-CD 4.24Å; Y169-K173 HydrophobicContact CG-CD 4.34Å; Y169-K173 VanDerWaalsContact O-CG 3.31Å; Y169-K173 WeakPolarHBondContact O-CG 3.39Å; Y169-K173 PolarHBondContact O-N 3.5Å; Y169-K173 VanDerWaalsContact O-N 3.07Å; E170-K173 PolarHBondContact O-N 2.81Å; E170-K173 IonicContact OE1-NZ 3.58Å; E170-K173 PolarHBondContact OE1-NZ 3.02Å; E170-K173 IonicContact OE2-NZ 3.04Å; E170-K173 PolarHBondContact OE2-NZ 3.49Å; S171-K173 VanDerWaalsContact C-N 3.34Å; S171-K173 PolarHBondContact O-N 2.89Å; K173-H176 PolarHBondContact O-N 3.09Å; K173-A177 WeakPolarHBondContact O-CB 3.2Å; K173-A177 PolarHBondContact O-N 3.38Å; K173-I184 HydrophobicContact CB-CD1 3.72Å; K173-I184 HydrophobicContact CD-CD1 4.44Å; K173-I184 HydrophobicContact CG-CD1 3.55Å; K173-F192 HydrophobicContact CG-CD2 4.07Å
174L94.8Very high94Very high118 Ų11886.5 Ų86.562%0.61842%0.418SS*.Hα-helixtrans-63.6-48.8178.1-71.4171.7000111.1E170 S171 H176 A177 E178E170-L174 VanDerWaalsContact O-CG 3.32Å; E170-L174 WeakPolarHBondContact O-CG 3.49Å; E170-L174 PolarHBondContact O-N 3.3Å; S171-L174 PolarHBondContact O-N 3.09Å; L174-H176 VanDerWaalsContact C-N 3.28Å; L174-H176 PolarHBondContact O-N 3.31Å; L174-A177 PolarHBondContact O-N 3Å; L174-A177 VanDerWaalsContact O-N 3.16Å; L174-E178 WeakPolarHBondContact O-CB 3.31Å; L174-E178 PolarHBondContact O-N 2.94Å
175L95.3Very high93.8Very high105 Ų10587 Ų8755%0.5542%0.423SS..Hα-helixtrans-59-39.5175.9-71.5170.9000112S171 K179S171-L175 WeakPolarHBondContact O-CB 3.31Å; S171-L175 VanDerWaalsContact O-CG 3.28Å; S171-L175 WeakPolarHBondContact O-CG 3.3Å; S171-L175 PolarHBondContact O-N 2.93Å; L175-K179 WeakPolarHBondContact O-CB 3.46Å; L175-K179 PolarHBondContact O-N 2.86Å
176H94.9Very high93.5Very high17 Ų1791.5 Ų91.58%0.07945%0.45CS..Hα-helixtrans-66.1-45.2175.7-179.490.2000112.4L172 K173 L174 E178 K179 S180 R182 E188 F192L172-H176 VanDerWaalsContact O-CB 3.3Å; L172-H176 WeakPolarHBondContact O-CB 3.48Å; L172-H176 PolarHBondContact O-N 3.14Å; K173-H176 PolarHBondContact O-N 3.09Å; L174-H176 VanDerWaalsContact C-N 3.28Å; L174-H176 PolarHBondContact O-N 3.31Å; H176-E178 VanDerWaalsContact C-N 3.31Å; H176-E178 PolarHBondContact O-N 3.3Å; H176-K179 PolarHBondContact O-N 3.45Å; H176-S180 PolarHBondContact CE1-OG 2.89Å; H176-S180 WeakPolarHBondContact O-CB 3.49Å; H176-S180 PolarHBondContact O-N 3.44Å; H176-S180 PolarHBondContact O-OG 2.99Å; H176-R182 VanDerWaalsContact CE1-CZ 3.49Å; H176-R182 PolarHBondContact CE1-NH1 2.88Å; H176-R182 PolarHBondContact NE2-NH1 2.97Å; H176-E188 VanDerWaalsContact CE1-CD 3.5Å; H176-E188 IonicContact CE1-OE1 2.71Å; H176-E188 PolarHBondContact CE1-OE1 2.91Å; H176-E188 IonicContact CE1-OE2 3.39Å; H176-E188 IonicContact ND1-OE1 2.81Å; H176-E188 IonicContact NE2-OE2 2.66Å; H176-F192 HydrophobicContact CB-CE2 3.89Å; H176-F192 HydrophobicContact CB-CZ 3.85Å
177A92.5Very high93.2Very high51 Ų5189.7 Ų89.742%0.42145%0.45SS..Hα-helixtrans-62.1-40.4179.900000111.4K173 L174 K181K173-A177 WeakPolarHBondContact O-CB 3.2Å; K173-A177 PolarHBondContact O-N 3.38Å; L174-A177 PolarHBondContact O-N 3Å; L174-A177 VanDerWaalsContact O-N 3.16Å; A177-K181 WeakPolarHBondContact O-CA 3.5Å; A177-K181 PolarHBondContact O-N 2.97Å; A177-K181 VanDerWaalsContact O-N 3.15Å
178E92.4Very high93Very high147 Ų14784.2 Ų84.269%0.68743%0.426SS*.Hα-helixtrans-64.4-48.4175.6-174.5177.3-16800111.9L174 H176L174-E178 WeakPolarHBondContact O-CB 3.31Å; L174-E178 PolarHBondContact O-N 2.94Å; H176-E178 VanDerWaalsContact C-N 3.31Å; H176-E178 PolarHBondContact O-N 3.3Å
179K92.6Very high92.8Very high187 Ų18788.8 Ų88.881%0.81344%0.441SS*.Hα-helixtrans-76.4-41.9-174.2-172.2172.1-177.1175.50113.8L175 H176L175-K179 WeakPolarHBondContact O-CB 3.46Å; L175-K179 PolarHBondContact O-N 2.86Å; H176-K179 PolarHBondContact O-N 3.45Å
180S86.9Confident92.6Very high46 Ų4691.2 Ų91.232%0.32246%0.457SS..Hα-helixtrans-102.2-16-168.2-46.20000113.1H176 R182H176-S180 PolarHBondContact CE1-OG 2.89Å; H176-S180 WeakPolarHBondContact O-CB 3.49Å; H176-S180 PolarHBondContact O-N 3.44Å; H176-S180 PolarHBondContact O-OG 2.99Å; S180-R182 PolarHBondContact O-N 3.3Å
181K80.9Confident92.5Very high197 Ų19792.2 Ų92.286%0.85746%0.464SS*.  trans45.418.3-175-60.7-169.3179.7-177.70115.4A177A177-K181 WeakPolarHBondContact O-CA 3.5Å; A177-K181 PolarHBondContact O-N 2.97Å; A177-K181 VanDerWaalsContact O-N 3.15Å
182R88.9Confident92.5Very high125 Ų12591.5 Ų91.547%0.47246%0.457SS..SBendtrans-116.4164.1-178.667.5176.4170.775.6-5.4110.3H176 S180 E188H176-R182 VanDerWaalsContact CE1-CZ 3.49Å; H176-R182 PolarHBondContact CE1-NH1 2.88Å; H176-R182 PolarHBondContact NE2-NH1 2.97Å; S180-R182 PolarHBondContact O-N 3.3Å; R182-E188 IonicContact CZ-OE1 3.32Å; R182-E188 IonicContact CZ-OE2 3.3Å; R182-E188 IonicContact NH1-OE1 2.66Å; R182-E188 PolarHBondContact NH1-OE1 3Å; R182-E188 IonicContact NH1-OE2 3.59Å; R182-E188 PolarHBondContact NH1-OE2 3.19Å; R182-E188 IonicContact NH2-OE1 2.91Å; R182-E188 PolarHBondContact NH2-OE1 3.26Å; R182-E188 IonicContact NH2-OE2 3.05Å
183Q88Confident92.4Very high177 Ų17791 Ų9183%0.82746%0.462SS*.PPolyproline II helixtrans-64.9138.4172.1-64.2-171.8-0.800110.5S185Q183-S185 PolarHBondContact O-N 2.88Å
184I88.6Confident92.3Very high22 Ų2291.3 Ų91.311%0.11347%0.473CS..PPolyproline II helixtrans-68.9119.6177.7-48.2179.5000108.2K173 E188 R189 F192K173-I184 HydrophobicContact CB-CD1 3.72Å; K173-I184 HydrophobicContact CD-CD1 4.44Å; K173-I184 HydrophobicContact CG-CD1 3.55Å; I184-E188 HydrophobicContact CG2-CB 3.55Å; I184-R189 HydrophobicContact CB-CG 4.1Å; I184-R189 HydrophobicContact CG2-CG 3.6Å; I184-R189 PolarHBondContact O-NE 3.48Å; I184-F192 HydrophobicContact CD1-CE2 4.32Å; I184-F192 HydrophobicContact CG2-CD2 4.22Å; I184-F192 HydrophobicContact CG2-CE2 3.78Å
185S93.1Very high92.3Very high50 Ų5089.3 Ų89.335%0.3546%0.462SS..PPolyproline II helixtrans-63.4160.3177.467.80000111.5Q183 V187 E188 R189Q183-S185 PolarHBondContact O-N 2.88Å; S185-V187 VanDerWaalsContact C-N 3.26Å; S185-V187 PolarHBondContact O-N 3.41Å; S185-E188 WeakPolarHBondContact CB-OE2 3.24Å; S185-E188 PolarHBondContact N-OE2 3.15Å; S185-E188 PolarHBondContact O-N 2.85Å; S185-E188 WeakPolarHBondContact OG-CB 3.4Å; S185-E188 VanDerWaalsContact OG-CD 3.23Å; S185-E188 VanDerWaalsContact OG-CG 3.22Å; S185-E188 WeakPolarHBondContact OG-CG 3.25Å; S185-E188 PolarHBondContact OG-N 3.39Å; S185-E188 PolarHBondContact OG-OE2 3.37Å; S185-R189 WeakPolarHBondContact O-CG 3.24Å; S185-R189 PolarHBondContact O-N 3.49Å
186V92.3Very high92.5Very high112 Ų11284.5 Ų84.568%0.67944%0.437SS*.Hα-helixtrans-58.5-41.1177179.70000111E188 R189 L190V186-E188 PolarHBondContact O-N 3.18Å; V186-R189 PolarHBondContact O-N 3.12Å; V186-L190 HydrophobicContact CG1-CD1 4.21Å; V186-L190 VanDerWaalsContact O-CG 3.3Å; V186-L190 WeakPolarHBondContact O-CG 2.91Å; V186-L190 PolarHBondContact O-N 3.26Å
187V92.4Very high92.5Very high98 Ų9884.2 Ų84.259%0.59444%0.439SS*.Hα-helixtrans-62.5-44.3178.2179.50000111.1S185 L190 L191S185-V187 VanDerWaalsContact C-N 3.26Å; S185-V187 PolarHBondContact O-N 3.41Å; V187-L190 WeakPolarHBondContact O-CB 3.3Å; V187-L190 PolarHBondContact O-N 3.09Å; V187-L191 HydrophobicContact CG1-CD1 4.19Å; V187-L191 HydrophobicContact CG1-CG 4.48Å; V187-L191 WeakPolarHBondContact O-CG 3.22Å; V187-L191 PolarHBondContact O-N 3.25Å
188E94.3Very high92.6Very high32 Ų3284.8 Ų84.815%0.1544%0.435CS..Hα-helixtrans-65.8-40.5177.8-72.8164.3140.700112.4H176 R182 I184 S185 V186 L190 L191 F192H176-E188 VanDerWaalsContact CE1-CD 3.5Å; H176-E188 IonicContact CE1-OE1 2.71Å; H176-E188 PolarHBondContact CE1-OE1 2.91Å; H176-E188 IonicContact CE1-OE2 3.39Å; H176-E188 IonicContact ND1-OE1 2.81Å; H176-E188 IonicContact NE2-OE2 2.66Å; R182-E188 IonicContact CZ-OE1 3.32Å; R182-E188 IonicContact CZ-OE2 3.3Å; R182-E188 IonicContact NH1-OE1 2.66Å; R182-E188 PolarHBondContact NH1-OE1 3Å; R182-E188 IonicContact NH1-OE2 3.59Å; R182-E188 PolarHBondContact NH1-OE2 3.19Å; R182-E188 IonicContact NH2-OE1 2.91Å; R182-E188 PolarHBondContact NH2-OE1 3.26Å; R182-E188 IonicContact NH2-OE2 3.05Å; I184-E188 HydrophobicContact CG2-CB 3.55Å; S185-E188 WeakPolarHBondContact CB-OE2 3.24Å; S185-E188 PolarHBondContact N-OE2 3.15Å; S185-E188 PolarHBondContact O-N 2.85Å; S185-E188 WeakPolarHBondContact OG-CB 3.4Å; S185-E188 VanDerWaalsContact OG-CD 3.23Å; S185-E188 VanDerWaalsContact OG-CG 3.22Å; S185-E188 WeakPolarHBondContact OG-CG 3.25Å; S185-E188 PolarHBondContact OG-N 3.39Å; S185-E188 PolarHBondContact OG-OE2 3.37Å; V186-E188 PolarHBondContact O-N 3.18Å; E188-L190 VanDerWaalsContact C-N 3.29Å; E188-L190 PolarHBondContact O-N 2.97Å; E188-L191 PolarHBondContact O-N 3.1Å; E188-F192 HydrophobicContact CB-CE2 4.32Å; E188-F192 HydrophobicContact CB-CZ 4.22Å; E188-F192 WeakPolarHBondContact O-CB 3.27Å; E188-F192 WeakPolarHBondContact O-CD1 3.41Å; E188-F192 WeakPolarHBondContact O-CG 3.13Å; E188-F192 PolarHBondContact O-N 2.74Å
189R94.4Very high92.8Very high117 Ų11780.1 Ų80.144%0.44242%0.418SS..Hα-helixtrans-59.8-42.1173.9-69.1173.7-176.6-114.22111.5I184 S185 V186 G193I184-R189 HydrophobicContact CB-CG 4.1Å; I184-R189 HydrophobicContact CG2-CG 3.6Å; I184-R189 PolarHBondContact O-NE 3.48Å; S185-R189 WeakPolarHBondContact O-CG 3.24Å; S185-R189 PolarHBondContact O-N 3.49Å; V186-R189 PolarHBondContact O-N 3.12Å; R189-G193 PolarHBondContact O-N 2.87Å
190L93.5Very high93.1Very high106 Ų10671.2 Ų71.256%0.55538%0.379SS*.Hα-helixtrans-63.9-42.9175.7-70.5172.5000111.5V186 V187 E188 G193 A194V186-L190 HydrophobicContact CG1-CD1 4.21Å; V186-L190 VanDerWaalsContact O-CG 3.3Å; V186-L190 WeakPolarHBondContact O-CG 2.91Å; V186-L190 PolarHBondContact O-N 3.26Å; V187-L190 WeakPolarHBondContact O-CB 3.3Å; V187-L190 PolarHBondContact O-N 3.09Å; E188-L190 VanDerWaalsContact C-N 3.29Å; E188-L190 PolarHBondContact O-N 2.97Å; L190-G193 PolarHBondContact O-N 3Å; L190-A194 WeakPolarHBondContact O-CB 3.29Å; L190-A194 PolarHBondContact O-N 3.41Å
191L95.1Very high93.5Very high98 Ų9871.6 Ų71.651%0.51338%0.376SS..Hα-helixtrans-64.5-45.2176.5-71.1174.1000112V187 E188 G193 A194 I195V187-L191 HydrophobicContact CG1-CD1 4.19Å; V187-L191 HydrophobicContact CG1-CG 4.48Å; V187-L191 WeakPolarHBondContact O-CG 3.22Å; V187-L191 PolarHBondContact O-N 3.25Å; E188-L191 PolarHBondContact O-N 3.1Å; L191-G193 VanDerWaalsContact C-N 3.32Å; L191-G193 PolarHBondContact O-N 3.25Å; L191-A194 PolarHBondContact O-N 2.91Å; L191-I195 VanDerWaalsContact O-CG1 3.31Å; L191-I195 WeakPolarHBondContact O-CG1 3.04Å; L191-I195 PolarHBondContact O-N 3.05Å
192F97Very high94.2Very high25 Ų2563.6 Ų63.611%0.1135%0.345CS..Hα-helixtrans-62.5-41.6176.3-61.3-15.4000111Y169 L172 K173 H176 I184 E188 I195 A196Y169-F192 HydrophobicContact CD2-CB 3.76Å; Y169-F192 HydrophobicContact CE2-CB 3.9Å; L172-F192 HydrophobicContact CB-CB 4.19Å; L172-F192 HydrophobicContact CB-CD1 3.87Å; L172-F192 HydrophobicContact CB-CD2 4.09Å; L172-F192 HydrophobicContact CB-CE1 4.27Å; L172-F192 HydrophobicContact CB-CE2 4.46Å; L172-F192 HydrophobicContact CB-CG 3.79Å; L172-F192 HydrophobicContact CD1-CB 4.08Å; L172-F192 HydrophobicContact CD1-CD1 3.96Å; L172-F192 HydrophobicContact CD1-CG 4.21Å; L172-F192 HydrophobicContact CG-CD1 4.38Å; K173-F192 HydrophobicContact CG-CD2 4.07Å; H176-F192 HydrophobicContact CB-CE2 3.89Å; H176-F192 HydrophobicContact CB-CZ 3.85Å; I184-F192 HydrophobicContact CD1-CE2 4.32Å; I184-F192 HydrophobicContact CG2-CD2 4.22Å; I184-F192 HydrophobicContact CG2-CE2 3.78Å; E188-F192 HydrophobicContact CB-CE2 4.32Å; E188-F192 HydrophobicContact CB-CZ 4.22Å; E188-F192 WeakPolarHBondContact O-CB 3.27Å; E188-F192 WeakPolarHBondContact O-CD1 3.41Å; E188-F192 WeakPolarHBondContact O-CG 3.13Å; E188-F192 PolarHBondContact O-N 2.74Å; F192-I195 PolarHBondContact O-N 3.2Å; F192-A196 WeakPolarHBondContact O-CB 3.23Å; F192-A196 PolarHBondContact O-N 2.9Å
193G95.8Very high94.6Very high33 Ų3359.6 Ų59.634%0.3434%0.339SS..Hα-helixtrans-62.6-40.6174.300000112.7R189 L190 L191 G197R189-G193 PolarHBondContact O-N 2.87Å; L190-G193 PolarHBondContact O-N 3Å; L191-G193 VanDerWaalsContact C-N 3.32Å; L191-G193 PolarHBondContact O-N 3.25Å; G193-G197 PolarHBondContact O-N 3.09Å
194A94.4Very high95.1Very high54 Ų5452 Ų5245%0.44631%0.305SS..Hα-helixtrans-64.8-48.817600000111.7L190 L191 G197 L198L190-A194 WeakPolarHBondContact O-CB 3.29Å; L190-A194 PolarHBondContact O-N 3.41Å; L191-A194 PolarHBondContact O-N 2.91Å; A194-G197 PolarHBondContact O-N 3.44Å; A194-L198 VanDerWaalsContact O-CG 3.3Å; A194-L198 WeakPolarHBondContact O-CG 3.46Å; A194-L198 PolarHBondContact O-N 2.87Å
195I96.2Very high95.5Very high77 Ų7751 Ų5140%0.39530%0.3SS..Hα-helixtrans-60.9-47.6177.6-66.2165.4000110.3T168 L172 L191 F192 G197 L198 C199T168-I195 HydrophobicContact CG2-CG2 4.12Å; L172-I195 HydrophobicContact CD1-CB 4.08Å; L172-I195 HydrophobicContact CD1-CD1 4.35Å; L172-I195 HydrophobicContact CD1-CG2 3.92Å; L191-I195 VanDerWaalsContact O-CG1 3.31Å; L191-I195 WeakPolarHBondContact O-CG1 3.04Å; L191-I195 PolarHBondContact O-N 3.05Å; F192-I195 PolarHBondContact O-N 3.2Å; I195-G197 VanDerWaalsContact C-N 3.34Å; I195-G197 PolarHBondContact O-N 3.3Å; I195-L198 WeakPolarHBondContact O-CB 3.17Å; I195-L198 PolarHBondContact O-N 3.35Å; I195-L198 VanDerWaalsContact O-N 3.12Å; I195-C199 PolarHBondContact O-N 2.8Å; I195-C199 PolarHBondContact O-SG 2.98Å; I195-C199 VanDerWaalsContact O-SG 3.4Å
196A97.8Very high95.8Very high3 Ų349.5 Ų49.53%0.02529%0.288CS..Hα-helixtrans-56.1-47.3175.500000112.4S165 T168 F192 L198 C199 G200S165-A196 VanDerWaalsContact O-CB 3.25Å; S165-A196 WeakPolarHBondContact O-CB 3.36Å; S165-A196 PolarHBondContact OG-O 3.22Å; T168-A196 HydrophobicContact CG2-CB 4.23Å; F192-A196 WeakPolarHBondContact O-CB 3.23Å; F192-A196 PolarHBondContact O-N 2.9Å; A196-L198 VanDerWaalsContact C-N 3.3Å; A196-L198 PolarHBondContact O-N 2.84Å; A196-C199 PolarHBondContact O-N 3.46Å; A196-G200 PolarHBondContact O-N 2.96Å
197G95.4Very high96Very high11 Ų1145.4 Ų45.411%0.11326%0.263CS..Hα-helixtrans-62.7-34.4176.600000113.1G193 A194 I195 Q201G193-G197 PolarHBondContact O-N 3.09Å; A194-G197 PolarHBondContact O-N 3.44Å; I195-G197 VanDerWaalsContact C-N 3.34Å; I195-G197 PolarHBondContact O-N 3.3Å; G197-Q201 VanDerWaalsContact O-CB 3.3Å; G197-Q201 WeakPolarHBondContact O-CB 3.28Å; G197-Q201 WeakPolarHBondContact O-CG 3.12Å; G197-Q201 PolarHBondContact O-N 3.2Å; G197-Q201 PolarHBondContact O-NE2 2.95Å
198L95.2Very high96.2Very high64 Ų6442 Ų4234%0.33524%0.241SC..Hα-helixtrans-70.2-42.1174.6-69.7175.3000112A194 I195 A196 Q201 S202 W250A194-L198 VanDerWaalsContact O-CG 3.3Å; A194-L198 WeakPolarHBondContact O-CG 3.46Å; A194-L198 PolarHBondContact O-N 2.87Å; I195-L198 WeakPolarHBondContact O-CB 3.17Å; I195-L198 PolarHBondContact O-N 3.35Å; I195-L198 VanDerWaalsContact O-N 3.12Å; A196-L198 VanDerWaalsContact C-N 3.3Å; A196-L198 PolarHBondContact O-N 2.84Å; L198-Q201 PolarHBondContact O-N 3.2Å; L198-S202 WeakPolarHBondContact O-CB 3.31Å; L198-S202 PolarHBondContact O-N 3.31Å; L198-S202 PolarHBondContact O-OG 3.46Å; L198-W250 VanDerWaalsContact CD2-CD1 3.43Å; L198-W250 HydrophobicContact CD2-CG 4.3Å
199C96.9Very high96.4Very high48 Ų4840.5 Ų40.532%0.32423%0.234SC..Hα-helixtrans-63.3-46.8174.7-680000111.2T164 T168 I195 A196 Q201 S202 A203T164-C199 HydrophobicContact CG2-CB 3.85Å; T168-C199 HydrophobicContact CG2-CB 4.33Å; I195-C199 PolarHBondContact O-N 2.8Å; I195-C199 PolarHBondContact O-SG 2.98Å; I195-C199 VanDerWaalsContact O-SG 3.4Å; A196-C199 PolarHBondContact O-N 3.46Å; C199-Q201 PolarHBondContact O-N 3.07Å; C199-S202 WeakPolarHBondContact O-CB 3.4Å; C199-S202 PolarHBondContact O-N 3.12Å; C199-A203 PolarHBondContact O-N 2.93Å
200G97.7Very high96.6Very high0 Ų035 Ų350%021%0.213CC..Hα-helixtrans-63.1-40.1175.800000113.6Y161 A196 S202 A203 S204Y161-G200 VanDerWaalsContact CD2-C 3.49Å; A196-G200 PolarHBondContact O-N 2.96Å; G200-S202 VanDerWaalsContact C-N 3.32Å; G200-S202 PolarHBondContact O-N 3.4Å; G200-A203 PolarHBondContact O-N 3.48Å; G200-S204 WeakPolarHBondContact O-CB 3.32Å; G200-S204 PolarHBondContact O-N 2.95Å; G200-S204 PolarHBondContact O-OG 3.23Å
201Q95.7Very high96.8Very high54 Ų5431.7 Ų31.725%0.25219%0.194SC..Hα-helixtrans-61.5-42.1172.5-80.9173.359.700111.7Y161 G197 L198 C199 S204 Y205 N249Y161-Q201 HydrophobicContact CD2-CG 4.29Å; Y161-Q201 HydrophobicContact CE2-CG 3.91Å; G197-Q201 VanDerWaalsContact O-CB 3.3Å; G197-Q201 WeakPolarHBondContact O-CB 3.28Å; G197-Q201 WeakPolarHBondContact O-CG 3.12Å; G197-Q201 PolarHBondContact O-N 3.2Å; G197-Q201 PolarHBondContact O-NE2 2.95Å; L198-Q201 PolarHBondContact O-N 3.2Å; C199-Q201 PolarHBondContact O-N 3.07Å; Q201-S204 PolarHBondContact O-N 2.75Å; Q201-S204 PolarHBondContact O-OG 3.29Å; Q201-Y205 WeakPolarHBondContact O-CA 3.42Å; Q201-Y205 VanDerWaalsContact O-CB 3.28Å; Q201-Y205 WeakPolarHBondContact O-CB 3.27Å; Q201-Y205 PolarHBondContact O-N 2.98Å; Q201-N249 PolarHBondContact OE1-ND2 2.9Å
202S96.3Very high96.9Very high30 Ų3028.6 Ų28.621%0.2118%0.175CC..Hα-helixtrans-64.4-46.5179.3-56.20000110.5L198 C199 G200 S204 Y205 Y243L198-S202 WeakPolarHBondContact O-CB 3.31Å; L198-S202 PolarHBondContact O-N 3.31Å; L198-S202 PolarHBondContact O-OG 3.46Å; C199-S202 WeakPolarHBondContact O-CB 3.4Å; C199-S202 PolarHBondContact O-N 3.12Å; G200-S202 VanDerWaalsContact C-N 3.32Å; G200-S202 PolarHBondContact O-N 3.4Å; S202-S204 VanDerWaalsContact C-N 3.34Å; S202-S204 PolarHBondContact O-N 3.29Å; S202-Y205 WeakPolarHBondContact O-CB 3.39Å; S202-Y205 PolarHBondContact O-N 3.45Å; S202-Y243 WeakPolarHBondContact O-CE1 3.35Å
203A97.6Very high96.9Very high41 Ų4128.3 Ų28.334%0.33917%0.173SC..Hα-helixtrans-62.3-36.8178.100000113.6P160 T164 C199 G200P160-A203 HydrophobicContact CB-CB 4.29Å; T164-A203 HydrophobicContact CG2-CB 4.13Å; T164-A203 WeakPolarHBondContact OG1-CB 3.16Å; C199-A203 PolarHBondContact O-N 2.93Å; G200-A203 PolarHBondContact O-N 3.48Å
204S97.5Very high97Very high16 Ų1627.8 Ų27.811%0.11216%0.162CC..Hα-helixtrans-87-7.617956.70000114.2G157 G200 Q201 S202 L207 D208G157-S204 WeakPolarHBondContact O-CB 2.96Å; G200-S204 WeakPolarHBondContact O-CB 3.32Å; G200-S204 PolarHBondContact O-N 2.95Å; G200-S204 PolarHBondContact O-OG 3.23Å; Q201-S204 PolarHBondContact O-N 2.75Å; Q201-S204 PolarHBondContact O-OG 3.29Å; S202-S204 VanDerWaalsContact C-N 3.34Å; S202-S204 PolarHBondContact O-N 3.29Å; S204-L207 PolarHBondContact O-N 3.27Å; S204-L207 VanDerWaalsContact O-N 3.12Å; S204-D208 PolarHBondContact O-N 3.46Å
205Y97.4Very high97.1Very high2 Ų225.2 Ų25.21%0.00814%0.141CC..Hα-helixtrans-62.2-38.4-170.4-151.4-93.4000115K22 Q26 Q201 S202 L207 D208 I209 L242 Y243 K244 G245 L246K22-Y205 WeakPolarHBondContact CE-OH 3.31Å; Q26-Y205 PolarHBondContact NE2-OH 3.17Å; Q26-Y205 VanDerWaalsContact NE2-OH 3.13Å; Q201-Y205 WeakPolarHBondContact O-CA 3.42Å; Q201-Y205 VanDerWaalsContact O-CB 3.28Å; Q201-Y205 WeakPolarHBondContact O-CB 3.27Å; Q201-Y205 PolarHBondContact O-N 2.98Å; S202-Y205 WeakPolarHBondContact O-CB 3.39Å; S202-Y205 PolarHBondContact O-N 3.45Å; Y205-L207 PolarHBondContact O-N 2.91Å; Y205-D208 WeakPolarHBondContact O-CA 3.46Å; Y205-D208 WeakPolarHBondContact O-CB 3.46Å; Y205-D208 PolarHBondContact O-N 3.37Å; Y205-I209 HydrophobicContact CD1-CD1 4.38Å; Y205-I209 HydrophobicContact CD1-CG1 4.07Å; Y205-I209 HydrophobicContact CE1-CD1 3.79Å; Y205-I209 HydrophobicContact CE1-CG1 3.98Å; Y205-I209 PolarHBondContact O-N 3.48Å; Y205-L242 VanDerWaalsContact CD1-O 3.27Å; Y205-L242 WeakPolarHBondContact CD1-O 3.25Å; Y205-Y243 HydrophobicContact CD1-CD1 4.41Å; Y205-K244 VanDerWaalsContact CE1-O 3.23Å; Y205-K244 WeakPolarHBondContact CE1-O 2.94Å; Y205-K244 PolarHBondContact OH-O 3.35Å; Y205-G245 PolarHBondContact OH-O 3Å; Y205-L246 HydrophobicContact CD1-CB 4.41Å; Y205-L246 HydrophobicContact CD2-CB 4.29Å; Y205-L246 HydrophobicContact CD2-CD1 3.42Å; Y205-L246 VanDerWaalsContact CD2-CD1 3.42Å; Y205-L246 HydrophobicContact CD2-CG 4.42Å; Y205-L246 HydrophobicContact CE1-CB 4.14Å; Y205-L246 HydrophobicContact CE2-CB 4.01Å; Y205-L246 HydrophobicContact CE2-CD1 3.7Å; Y205-L246 HydrophobicContact CE2-CG 4.48Å; Y205-L246 HydrophobicContact CG-CB 4.46Å; Y205-L246 HydrophobicContact CG-CD1 3.98Å; Y205-L246 PolarHBondContact OH-N 3.28Å; Y205-L246 VanDerWaalsContact OH-N 3.09Å
206P98Very high97.1Very high18 Ų1822.4 Ų22.412%0.11713%0.128CC..Hα-helixtrans-56.8-37.3174.6-27.936.8000113.1I209 V210 M229 L242 Y243P206-I209 PolarHBondContact O-N 2.76Å; P206-V210 WeakPolarHBondContact O-CG2 3.3Å; P206-V210 PolarHBondContact O-N 3.03Å; P206-V210 VanDerWaalsContact O-N 3.13Å; P206-M229 HydrophobicContact CB-CE 4.41Å; P206-L242 HydrophobicContact CB-CB 4.27Å; P206-L242 HydrophobicContact CB-CD1 4.38Å; P206-L242 HydrophobicContact CB-CD2 4.42Å; P206-L242 HydrophobicContact CG-CB 4.31Å; P206-Y243 HydrophobicContact CG-CE1 4.41Å; P206-Y243 HydrophobicContact CG-CE2 4.45Å
207L97.8Very high96.6Very high27 Ų2723.9 Ų23.914%0.14114%0.143CC..Hα-helixtrans-73.7-30.5175.4-69.3170.2000112P153 L156 P160 S204 Y205 V210 R211 I225 M229P153-L207 HydrophobicContact CB-CD2 4.2Å; L156-L207 HydrophobicContact CB-CD1 3.93Å; P160-L207 HydrophobicContact CG-CD1 4.28Å; S204-L207 PolarHBondContact O-N 3.27Å; S204-L207 VanDerWaalsContact O-N 3.12Å; Y205-L207 PolarHBondContact O-N 2.91Å; L207-V210 PolarHBondContact O-N 3.4Å; L207-R211 VanDerWaalsContact O-CB 3.22Å; L207-R211 WeakPolarHBondContact O-CB 3.28Å; L207-R211 PolarHBondContact O-N 3.09Å; L207-I225 HydrophobicContact CD2-CG2 4.01Å; L207-M229 HydrophobicContact CD2-CE 4.47Å
208D97.2Very high96.5Very high27 Ų2727.1 Ų27.114%0.14416%0.16CC..Hα-helixtrans-63-42.9169.7-16936.2000110.6K22 Q26 S204 Y205 V210 R211 R212K22-D208 IonicContact NZ-OD2 2.63Å; K22-D208 PolarHBondContact NZ-OD2 3.17Å; Q26-D208 PolarHBondContact NE2-OD2 3.22Å; S204-D208 PolarHBondContact O-N 3.46Å; Y205-D208 WeakPolarHBondContact O-CA 3.46Å; Y205-D208 WeakPolarHBondContact O-CB 3.46Å; Y205-D208 PolarHBondContact O-N 3.37Å; D208-V210 PolarHBondContact O-N 2.82Å; D208-R211 WeakPolarHBondContact O-CB 3.36Å; D208-R211 PolarHBondContact O-N 3.36Å; D208-R212 VanDerWaalsContact O-CG 3.31Å; D208-R212 WeakPolarHBondContact O-CG 3.5Å; D208-R212 PolarHBondContact O-N 3.2Å; D208-R212 IonicContact OD1-NE 3.8Å; D208-R212 PolarHBondContact OD1-NE 2.96Å; D208-R212 IonicContact OD1-NH2 3.98Å
209I97.7Very high96.4Very high0 Ų025 Ų250%015%0.15CC..Hα-helixtrans-58.8-49.8174.6-64.8-62.4000111.3Q26 Y205 P206 R211 R212 R213 V232 L242 K244Q26-I209 HydrophobicContact CB-CD1 3.75Å; Q26-I209 HydrophobicContact CG-CD1 3.54Å; Y205-I209 HydrophobicContact CD1-CD1 4.38Å; Y205-I209 HydrophobicContact CD1-CG1 4.07Å; Y205-I209 HydrophobicContact CE1-CD1 3.79Å; Y205-I209 HydrophobicContact CE1-CG1 3.98Å; Y205-I209 PolarHBondContact O-N 3.48Å; P206-I209 PolarHBondContact O-N 2.76Å; I209-R211 PolarHBondContact O-N 3.26Å; I209-R212 PolarHBondContact O-N 3.4Å; I209-R213 WeakPolarHBondContact O-CG 3.31Å; I209-R213 PolarHBondContact O-N 2.91Å; I209-R213 VanDerWaalsContact O-N 3.07Å; I209-V232 HydrophobicContact CG2-CG1 4.34Å; I209-V232 HydrophobicContact CG2-CG2 4.21Å; I209-L242 VanDerWaalsContact CG1-O 3.31Å; I209-L242 WeakPolarHBondContact CG1-O 3.24Å; I209-K244 HydrophobicContact CD1-CB 4.15Å
210V97.9Very high96.2Very high0 Ų027.4 Ų27.40%017%0.165CC..Hα-helixtrans-60.6-46.5178.5175.50000110.8P153 P206 L207 D208 R212 R213 M214 I225 V228 M229P153-V210 HydrophobicContact CB-CB 4.48Å; P153-V210 HydrophobicContact CB-CG1 4.24Å; P153-V210 HydrophobicContact CG-CG1 4.3Å; P206-V210 WeakPolarHBondContact O-CG2 3.3Å; P206-V210 PolarHBondContact O-N 3.03Å; P206-V210 VanDerWaalsContact O-N 3.13Å; L207-V210 PolarHBondContact O-N 3.4Å; D208-V210 PolarHBondContact O-N 2.82Å; V210-R212 PolarHBondContact O-N 2.88Å; V210-R213 PolarHBondContact O-N 3.43Å; V210-M214 HydrophobicContact CG1-CG 4.22Å; V210-M214 HydrophobicContact CG1-SD 3.68Å; V210-M214 WeakPolarHBondContact O-CB 3.27Å; V210-M214 VanDerWaalsContact O-CG 3.3Å; V210-M214 WeakPolarHBondContact O-CG 3.38Å; V210-M214 PolarHBondContact O-N 2.96Å; V210-I225 HydrophobicContact CG1-CB 4.31Å; V210-I225 HydrophobicContact CG1-CG1 4.3Å; V210-I225 HydrophobicContact CG1-CG2 4.01Å; V210-I225 HydrophobicContact CG2-CG2 4.5Å; V210-V228 HydrophobicContact CB-CG1 4.35Å; V210-V228 HydrophobicContact CG1-CB 4.02Å; V210-V228 HydrophobicContact CG1-CG1 4.04Å; V210-V228 HydrophobicContact CG2-CB 4.38Å; V210-V228 HydrophobicContact CG2-CG1 4.13Å; V210-M229 HydrophobicContact CG2-CB 4.18Å; V210-M229 HydrophobicContact CG2-CE 4.39Å
211R97.7Very high95.7Very high37 Ų3731.8 Ų31.814%0.1419%0.188CC..Hα-helixtrans-52.7-52.8175.3175.1-167.8178.5174.38.8111.1D114 P153 T154 L207 D208 I209 R213 M214 Q215D114-R211 IonicContact OD2-NH2 2.75Å; D114-R211 PolarHBondContact OD2-NH2 3.01Å; P153-R211 HydrophobicContact CB-CB 4.31Å; P153-R211 HydrophobicContact CG-CB 4.12Å; T154-R211 WeakPolarHBondContact OG1-CD 3.28Å; T154-R211 WeakPolarHBondContact OG1-CG 3.47Å; T154-R211 PolarHBondContact OG1-NE 2.91Å; L207-R211 VanDerWaalsContact O-CB 3.22Å; L207-R211 WeakPolarHBondContact O-CB 3.28Å; L207-R211 PolarHBondContact O-N 3.09Å; D208-R211 WeakPolarHBondContact O-CB 3.36Å; D208-R211 PolarHBondContact O-N 3.36Å; I209-R211 PolarHBondContact O-N 3.26Å; R211-R213 PolarHBondContact O-N 2.66Å; R211-M214 PolarHBondContact O-N 3.28Å; R211-Q215 HydrophobicContact CG-CG 4.22Å; R211-Q215 VanDerWaalsContact NE-NE2 3.12Å; R211-Q215 WeakPolarHBondContact O-CB 3.37Å; R211-Q215 VanDerWaalsContact O-CG 3.29Å; R211-Q215 WeakPolarHBondContact O-CG 3.22Å; R211-Q215 PolarHBondContact O-N 3.46Å
212R97.7Very high95.3Very high33 Ų3337.3 Ų37.313%0.12522%0.219CC..Hα-helixtrans-63.4-39.8-176.6-65.1-50.3174.7172.81.9112.6Q26 V27 D208 I209 V210 Q215 T216Q26-R212 HydrophobicContact CB-CB 4.3Å; Q26-R212 HydrophobicContact CB-CG 4.39Å; V27-R212 HydrophobicContact CG2-CB 3.83Å; D208-R212 VanDerWaalsContact O-CG 3.31Å; D208-R212 WeakPolarHBondContact O-CG 3.5Å; D208-R212 PolarHBondContact O-N 3.2Å; D208-R212 IonicContact OD1-NE 3.8Å; D208-R212 PolarHBondContact OD1-NE 2.96Å; D208-R212 IonicContact OD1-NH2 3.98Å; I209-R212 PolarHBondContact O-N 3.4Å; V210-R212 PolarHBondContact O-N 2.88Å; R212-Q215 PolarHBondContact O-N 3.49Å; R212-T216 WeakPolarHBondContact O-CB 3.44Å; R212-T216 WeakPolarHBondContact O-CG2 3.37Å; R212-T216 PolarHBondContact O-N 2.95Å; R212-T216 VanDerWaalsContact O-N 3.09Å; R212-T216 PolarHBondContact O-OG1 2.9Å
213R97.4Very high95.2Very high20 Ų2037.1 Ų37.18%0.07522%0.217CC..Hα-helixtrans-66.4-41.1177.1-71-171.1-177.8-149.4-1.8112.7Q26 I209 V210 R211 T216 G217 V218 T219 V228 V232 E236Q26-R213 PolarHBondContact O-NE 3.37Å; Q26-R213 PolarHBondContact O-NH2 2.99Å; I209-R213 WeakPolarHBondContact O-CG 3.31Å; I209-R213 PolarHBondContact O-N 2.91Å; I209-R213 VanDerWaalsContact O-N 3.07Å; V210-R213 PolarHBondContact O-N 3.43Å; R211-R213 PolarHBondContact O-N 2.66Å; R213-T216 PolarHBondContact O-OG1 3.21Å; R213-G217 PolarHBondContact O-N 3.04Å; R213-V218 HydrophobicContact CB-CG2 3.71Å; R213-V218 HydrophobicContact CG-CG2 3.89Å; R213-V218 VanDerWaalsContact O-CG2 3.3Å; R213-V218 WeakPolarHBondContact O-CG2 3.3Å; R213-V218 PolarHBondContact O-N 3Å; R213-T219 HydrophobicContact CB-CG2 3.92Å; R213-V228 HydrophobicContact CB-CG1 4.19Å; R213-V232 VanDerWaalsContact NH1-CG2 3.32Å; R213-E236 IonicContact CZ-OE1 3.63Å; R213-E236 IonicContact CZ-OE2 2.74Å; R213-E236 IonicContact NH1-OE1 2.95Å; R213-E236 PolarHBondContact NH1-OE1 2.86Å; R213-E236 IonicContact NH2-OE1 2.95Å; R213-E236 PolarHBondContact NH2-OE1 3.46Å; R213-E236 IonicContact NH2-OE2 3.24Å; R213-E236 PolarHBondContact NH2-OE2 3.44Å
214M97.2Very high95.2Very high22 Ų2237.7 Ų37.711%0.10822%0.218CC..Hα-helixtrans-67.4-43.9175.5-68.5-179.881.700111.9R149 P153 V210 R211 T216 I225 V228R149-M214 WeakPolarHBondContact CD-O 3.45Å; R149-M214 HydrophobicContact CG-CB 4.14Å; R149-M214 WeakPolarHBondContact CG-O 3.39Å; R149-M214 PolarHBondContact NE-O 3.3Å; R149-M214 VanDerWaalsContact NE-O 3.15Å; P153-M214 HydrophobicContact CG-SD 3.95Å; V210-M214 HydrophobicContact CG1-CG 4.22Å; V210-M214 HydrophobicContact CG1-SD 3.68Å; V210-M214 WeakPolarHBondContact O-CB 3.27Å; V210-M214 VanDerWaalsContact O-CG 3.3Å; V210-M214 WeakPolarHBondContact O-CG 3.38Å; V210-M214 PolarHBondContact O-N 2.96Å; R211-M214 PolarHBondContact O-N 3.28Å; M214-T216 VanDerWaalsContact C-N 3.34Å; M214-T216 PolarHBondContact O-N 2.89Å; M214-I225 HydrophobicContact SD-CG1 4.42Å; M214-V228 HydrophobicContact CG-CG2 4.27Å
215Q96.6Very high95.1Very high0 Ų038.7 Ų38.70%022%0.222CC..Hα-helixtrans-64.2-37.3-179.3-77.2-177.3-26.700112.8Y111 L115 A118 R119 R149 R211 R212Y111-Q215 WeakPolarHBondContact OH-CG 3.33Å; Y111-Q215 PolarHBondContact OH-NE2 2.94Å; L115-Q215 HydrophobicContact CG-CB 4.47Å; A118-Q215 HydrophobicContact CB-CB 3.98Å; R119-Q215 VanDerWaalsContact CG-O 3.26Å; R119-Q215 WeakPolarHBondContact CG-O 3.15Å; R119-Q215 PolarHBondContact NE-O 2.93Å; R149-Q215 WeakPolarHBondContact O-CG 3.25Å; R211-Q215 HydrophobicContact CG-CG 4.22Å; R211-Q215 VanDerWaalsContact NE-NE2 3.12Å; R211-Q215 WeakPolarHBondContact O-CB 3.37Å; R211-Q215 VanDerWaalsContact O-CG 3.29Å; R211-Q215 WeakPolarHBondContact O-CG 3.22Å; R211-Q215 PolarHBondContact O-N 3.46Å; R212-Q215 PolarHBondContact O-N 3.49Å
216T95.8Very high95.1Very high18 Ų1842.8 Ų42.811%0.1124%0.244CC..Hα-helixtrans-86.1-4.9-173.852.40000114.7V27 A118 V122 R212 R213 M214 V218V27-T216 HydrophobicContact CG1-CG2 4.38Å; V27-T216 WeakPolarHBondContact CG1-OG1 3.37Å; V27-T216 HydrophobicContact CG2-CG2 3.81Å; V27-T216 WeakPolarHBondContact CG2-OG1 3.27Å; A118-T216 HydrophobicContact CB-CG2 4.1Å; V122-T216 HydrophobicContact CB-CG2 4.39Å; V122-T216 HydrophobicContact CG1-CG2 3.9Å; V122-T216 HydrophobicContact CG2-CG2 3.57Å; R212-T216 WeakPolarHBondContact O-CB 3.44Å; R212-T216 WeakPolarHBondContact O-CG2 3.37Å; R212-T216 PolarHBondContact O-N 2.95Å; R212-T216 VanDerWaalsContact O-N 3.09Å; R212-T216 PolarHBondContact O-OG1 2.9Å; R213-T216 PolarHBondContact O-OG1 3.21Å; M214-T216 VanDerWaalsContact C-N 3.34Å; M214-T216 PolarHBondContact O-N 2.89Å; T216-V218 VanDerWaalsContact C-N 3.29Å; T216-V218 PolarHBondContact O-N 3.35Å
217G88.2Confident95.1Very high34 Ų3446.9 Ų46.935%0.35126%0.261SS..THydrogen-bonded Turntrans76.811.5177.800000114.3R213 T219R213-G217 PolarHBondContact O-N 3.04Å; G217-T219 PolarHBondContact O-N 3.27Å
218V92.5Very high95.1Very high78 Ų7845.8 Ų45.847%0.47326%0.256SS..  trans-72.4-15.7174.4-64.80000113.2V27 R213 T216V27-V218 HydrophobicContact CG1-CB 4.15Å; V27-V218 HydrophobicContact CG1-CG1 3.28Å; V27-V218 HydrophobicContact CG1-CG2 3.77Å; R213-V218 HydrophobicContact CB-CG2 3.71Å; R213-V218 HydrophobicContact CG-CG2 3.89Å; R213-V218 VanDerWaalsContact O-CG2 3.3Å; R213-V218 WeakPolarHBondContact O-CG2 3.3Å; R213-V218 PolarHBondContact O-N 3Å; T216-V218 VanDerWaalsContact C-N 3.29Å; T216-V218 PolarHBondContact O-N 3.35Å
219T93.9Very high95.1Very high20 Ų2047 Ų4712%0.12326%0.261CS..SBendtrans-99.9156.3171.9610000110.9R149 R213 G217 V228R149-T219 PolarHBondContact NH1-O 3.4Å; R149-T219 PolarHBondContact NH2-O 3.42Å; R149-T219 PolarHBondContact NH2-OG1 3.41Å; R213-T219 HydrophobicContact CB-CG2 3.92Å; G217-T219 PolarHBondContact O-N 3.27Å; T219-V228 HydrophobicContact CG2-CG1 4.05Å; T219-V228 HydrophobicContact CG2-CG2 3.91Å
220P91.9Very high95.1Very high98 Ų9854.8 Ų54.864%0.63629%0.29SS*.PPolyproline II helixtrans-61.4154172.1-22.734.1000112.4R149 V223R149-P220 VanDerWaalsContact NH2-C 3.35Å; R149-P220 PolarHBondContact NH2-O 2.92Å; P220-V223 VanDerWaalsContact O-CG1 3.3Å; P220-V223 WeakPolarHBondContact O-CG1 3.24Å
221L87.8Confident95.1Very high93 Ų9357.5 Ų57.549%0.48731%0.309SS..THydrogen-bonded Turntrans-59.4150.5169.8-66.1171.1000109.9V223L221-V223 PolarHBondContact O-N 3.35Å
222N88.2Confident95.1Very high169 Ų16955.7 Ų55.790%0.90430%0.302SS*.THydrogen-bonded Turntrans6120.3178.2-55-26.7000116.6
223V93.9Very high95.1Very high27 Ų2756.7 Ų56.716%0.16431%0.312CS..  trans-75.7138.3170.870.30000111.5P220 L221 Q227 V228P220-V223 VanDerWaalsContact O-CG1 3.3Å; P220-V223 WeakPolarHBondContact O-CG1 3.24Å; L221-V223 PolarHBondContact O-N 3.35Å; V223-Q227 HydrophobicContact CG2-CB 3.55Å; V223-V228 HydrophobicContact CB-CG2 4.27Å; V223-V228 HydrophobicContact CG1-CG2 3.5Å; V223-V228 VanDerWaalsContact CG1-CG2 3.5Å; V223-V228 HydrophobicContact CG2-CG2 3.72Å
224S96.1Very high95.1Very high53 Ų5359.6 Ų59.637%0.37134%0.341SS..  trans-78.1155.9175.675.80000112.3L226 Q227 V228S224-L226 PolarHBondContact O-N 3.5Å; S224-Q227 PolarHBondContact O-N 3.21Å; S224-Q227 VanDerWaalsContact O-N 3.15Å; S224-Q227 WeakPolarHBondContact OG-CB 3.45Å; S224-Q227 VanDerWaalsContact OG-CG 3.3Å; S224-Q227 WeakPolarHBondContact OG-CG 3.27Å; S224-Q227 PolarHBondContact OG-N 2.86Å; S224-Q227 PolarHBondContact OG-OE1 3.45Å; S224-V228 WeakPolarHBondContact O-CG2 3.43Å; S224-V228 PolarHBondContact O-N 3.39Å
225I97Very high95Very high36 Ų3665.8 Ų65.819%0.18537%0.369CS..Hα-helixtrans-54-42.1176.2-66.1174000110.8V152 P153 L156 L207 V210 M214 V228 M229V152-I225 HydrophobicContact CB-CD1 4.12Å; V152-I225 HydrophobicContact CG1-CD1 3.66Å; P153-I225 HydrophobicContact CB-CD1 4.09Å; P153-I225 HydrophobicContact CB-CG1 4.42Å; P153-I225 HydrophobicContact CG-CD1 4.39Å; P153-I225 HydrophobicContact CG-CG1 4.47Å; L156-I225 HydrophobicContact CD1-CD1 3.75Å; L207-I225 HydrophobicContact CD2-CG2 4.01Å; V210-I225 HydrophobicContact CG1-CB 4.31Å; V210-I225 HydrophobicContact CG1-CG1 4.3Å; V210-I225 HydrophobicContact CG1-CG2 4.01Å; V210-I225 HydrophobicContact CG2-CG2 4.5Å; M214-I225 HydrophobicContact SD-CG1 4.42Å; I225-V228 PolarHBondContact O-N 2.9Å; I225-M229 WeakPolarHBondContact O-CB 3.39Å; I225-M229 PolarHBondContact O-N 3.47Å
226L97.6Very high95Very high88 Ų8867.1 Ų67.146%0.46138%0.375SS..Hα-helixtrans-69.4-37.5-178.5-172.758.6000112.1S224 M229 R230S224-L226 PolarHBondContact O-N 3.5Å; L226-M229 PolarHBondContact O-N 2.81Å; L226-R230 HydrophobicContact CD1-CG 4.4Å; L226-R230 HydrophobicContact CG-CG 4.5Å; L226-R230 WeakPolarHBondContact O-CB 3.25Å; L226-R230 VanDerWaalsContact O-CG 3.25Å; L226-R230 WeakPolarHBondContact O-CG 3.41Å; L226-R230 PolarHBondContact O-N 2.89Å
227Q97.5Very high95Very high105 Ų10567.6 Ų67.649%0.49138%0.384SS..Hα-helixtrans-63.5-44.4173.4-77.9169.4-28.900111.5V223 S224 R230 S231V223-Q227 HydrophobicContact CG2-CB 3.55Å; S224-Q227 PolarHBondContact O-N 3.21Å; S224-Q227 VanDerWaalsContact O-N 3.15Å; S224-Q227 WeakPolarHBondContact OG-CB 3.45Å; S224-Q227 VanDerWaalsContact OG-CG 3.3Å; S224-Q227 WeakPolarHBondContact OG-CG 3.27Å; S224-Q227 PolarHBondContact OG-N 2.86Å; S224-Q227 PolarHBondContact OG-OE1 3.45Å; Q227-R230 PolarHBondContact O-N 3.41Å; Q227-S231 VanDerWaalsContact O-CB 3.25Å; Q227-S231 WeakPolarHBondContact O-CB 3.18Å; Q227-S231 PolarHBondContact O-N 2.9Å
228V97.5Very high95.4Very high4 Ų469.8 Ų69.82%0.02439%0.39CS..Hα-helixtrans-62-45.9175.7-179.40000110.5V210 R213 M214 T219 V223 S224 I225 S231 V232V210-V228 HydrophobicContact CB-CG1 4.35Å; V210-V228 HydrophobicContact CG1-CB 4.02Å; V210-V228 HydrophobicContact CG1-CG1 4.04Å; V210-V228 HydrophobicContact CG2-CB 4.38Å; V210-V228 HydrophobicContact CG2-CG1 4.13Å; R213-V228 HydrophobicContact CB-CG1 4.19Å; M214-V228 HydrophobicContact CG-CG2 4.27Å; T219-V228 HydrophobicContact CG2-CG1 4.05Å; T219-V228 HydrophobicContact CG2-CG2 3.91Å; V223-V228 HydrophobicContact CB-CG2 4.27Å; V223-V228 HydrophobicContact CG1-CG2 3.5Å; V223-V228 VanDerWaalsContact CG1-CG2 3.5Å; V223-V228 HydrophobicContact CG2-CG2 3.72Å; S224-V228 WeakPolarHBondContact O-CG2 3.43Å; S224-V228 PolarHBondContact O-N 3.39Å; I225-V228 PolarHBondContact O-N 2.9Å; V228-S231 PolarHBondContact O-N 2.86Å; V228-V232 HydrophobicContact CG1-CG2 4.32Å; V228-V232 WeakPolarHBondContact O-CG2 3.41Å; V228-V232 PolarHBondContact O-N 2.91Å
229M97.5Very high95.4Very high51 Ų5170.9 Ų70.925%0.25140%0.397SS..Hα-helixtrans-62-47.1179.7-169.2-179.8-68.300111.9P206 L207 V210 I225 L226 S231 V232 V233 L242P206-M229 HydrophobicContact CB-CE 4.41Å; L207-M229 HydrophobicContact CD2-CE 4.47Å; V210-M229 HydrophobicContact CG2-CB 4.18Å; V210-M229 HydrophobicContact CG2-CE 4.39Å; I225-M229 WeakPolarHBondContact O-CB 3.39Å; I225-M229 PolarHBondContact O-N 3.47Å; L226-M229 PolarHBondContact O-N 2.81Å; M229-S231 PolarHBondContact O-N 3.4Å; M229-V232 PolarHBondContact O-N 2.86Å; M229-V233 WeakPolarHBondContact O-CG2 3.4Å; M229-V233 PolarHBondContact O-N 2.95Å; M229-L242 HydrophobicContact CG-CD1 4.28Å; M229-L242 HydrophobicContact CG-CD2 3.86Å
230R97.9Very high95.5Very high165 Ų16573.9 Ų73.962%0.62341%0.409SS*.Hα-helixtrans-60.3-44.1175-75176.1-176.3163.4-0.6111.7L226 Q227 V232 V233 A234L226-R230 HydrophobicContact CD1-CG 4.4Å; L226-R230 HydrophobicContact CG-CG 4.5Å; L226-R230 WeakPolarHBondContact O-CB 3.25Å; L226-R230 VanDerWaalsContact O-CG 3.25Å; L226-R230 WeakPolarHBondContact O-CG 3.41Å; L226-R230 PolarHBondContact O-N 2.89Å; Q227-R230 PolarHBondContact O-N 3.41Å; R230-V232 VanDerWaalsContact C-N 3.35Å; R230-V232 PolarHBondContact O-N 3.27Å; R230-V233 PolarHBondContact O-N 3.25Å; R230-A234 VanDerWaalsContact O-CB 3.3Å; R230-A234 WeakPolarHBondContact O-CB 3.3Å; R230-A234 PolarHBondContact O-N 3.45Å
231S97Very high95.7Very high56 Ų5669.2 Ų69.239%0.39238%0.379SS..Hα-helixtrans-59.7-44.5176.8175.10000111.6Q227 V228 M229 A234 H235Q227-S231 VanDerWaalsContact O-CB 3.25Å; Q227-S231 WeakPolarHBondContact O-CB 3.18Å; Q227-S231 PolarHBondContact O-N 2.9Å; V228-S231 PolarHBondContact O-N 2.86Å; M229-S231 PolarHBondContact O-N 3.4Å; S231-A234 PolarHBondContact O-N 3.09Å; S231-H235 PolarHBondContact O-N 2.72Å; S231-H235 VanDerWaalsContact O-N 3.09Å; S231-H235 PolarHBondContact O-ND1 3.45Å
232V97.2Very high96.1Very high0 Ų065.5 Ų65.50%036%0.359CS..Hα-helixtrans-61.6-48.4176.2177.70000110.9I209 R213 V228 M229 R230 A234 H235 E236 G237 L242I209-V232 HydrophobicContact CG2-CG1 4.34Å; I209-V232 HydrophobicContact CG2-CG2 4.21Å; R213-V232 VanDerWaalsContact NH1-CG2 3.32Å; V228-V232 HydrophobicContact CG1-CG2 4.32Å; V228-V232 WeakPolarHBondContact O-CG2 3.41Å; V228-V232 PolarHBondContact O-N 2.91Å; M229-V232 PolarHBondContact O-N 2.86Å; R230-V232 VanDerWaalsContact C-N 3.35Å; R230-V232 PolarHBondContact O-N 3.27Å; V232-A234 VanDerWaalsContact C-N 3.34Å; V232-A234 PolarHBondContact O-N 3.3Å; V232-H235 PolarHBondContact O-N 3.4Å; V232-E236 WeakPolarHBondContact O-CA 3.48Å; V232-E236 WeakPolarHBondContact O-CB 3.35Å; V232-E236 PolarHBondContact O-N 3.24Å; V232-G237 PolarHBondContact O-N 2.65Å; V232-L242 HydrophobicContact CB-CD2 4.16Å; V232-L242 HydrophobicContact CG1-CD2 3.92Å
233V97.8Very high96.5Very high53 Ų5361.7 Ų61.732%0.32133%0.333SS..Hα-helixtrans-63.5-40.8-179.1173.30000111.4M229 R230 G237 V238 L242M229-V233 WeakPolarHBondContact O-CG2 3.4Å; M229-V233 PolarHBondContact O-N 2.95Å; R230-V233 PolarHBondContact O-N 3.25Å; V233-G237 WeakPolarHBondContact O-CA 3.39Å; V233-G237 PolarHBondContact O-N 2.8Å; V233-V238 HydrophobicContact CG1-CG2 3.92Å; V233-V238 HydrophobicContact CG2-CG2 4.37Å; V233-L242 HydrophobicContact CG2-CD1 3.61Å; V233-L242 HydrophobicContact CG2-CD2 4.15Å; V233-L242 HydrophobicContact CG2-CG 3.8Å
234A97.3Very high96.6Very high82 Ų8260.6 Ų60.668%0.67833%0.326SS*.Hα-helixtrans-66.9-40.9-179.700000113.1R230 S231 V232R230-A234 VanDerWaalsContact O-CB 3.3Å; R230-A234 WeakPolarHBondContact O-CB 3.3Å; R230-A234 PolarHBondContact O-N 3.45Å; S231-A234 PolarHBondContact O-N 3.09Å; V232-A234 VanDerWaalsContact C-N 3.34Å; V232-A234 PolarHBondContact O-N 3.3Å
235H96.5Very high96.6Very high151 Ų15158.1 Ų58.170%0.69931%0.309SS*.Hα-helixtrans-93-23.7-174.5-63.186.3000113.9S231 V232S231-H235 PolarHBondContact O-N 2.72Å; S231-H235 VanDerWaalsContact O-N 3.09Å; S231-H235 PolarHBondContact O-ND1 3.45Å; V232-H235 PolarHBondContact O-N 3.4Å
236E95.9Very high96.5Very high29 Ų2957.4 Ų57.414%0.13631%0.305CS..Hα-helixtrans-130.4-10.2-170.5-57.4170-151.300113.2R213 V232 H240 K244R213-E236 IonicContact CZ-OE1 3.63Å; R213-E236 IonicContact CZ-OE2 2.74Å; R213-E236 IonicContact NH1-OE1 2.95Å; R213-E236 PolarHBondContact NH1-OE1 2.86Å; R213-E236 IonicContact NH2-OE1 2.95Å; R213-E236 PolarHBondContact NH2-OE1 3.46Å; R213-E236 IonicContact NH2-OE2 3.24Å; R213-E236 PolarHBondContact NH2-OE2 3.44Å; V232-E236 WeakPolarHBondContact O-CA 3.48Å; V232-E236 WeakPolarHBondContact O-CB 3.35Å; V232-E236 PolarHBondContact O-N 3.24Å; E236-H240 WeakPolarHBondContact O-CB 3.3Å; E236-K244 IonicContact OE1-NZ 3.43Å; E236-K244 WeakPolarHBondContact OE2-CE 3.45Å; E236-K244 IonicContact OE2-NZ 2.81Å; E236-K244 PolarHBondContact OE2-NZ 2.98Å
237G95.9Very high96.4Very high28 Ų2855 Ų5529%0.28930%0.296SS..  trans78.7171.9-176.500000114V232 V233 G241V232-G237 PolarHBondContact O-N 2.65Å; V233-G237 WeakPolarHBondContact O-CA 3.39Å; V233-G237 PolarHBondContact O-N 2.8Å; G237-G241 VanDerWaalsContact O-CA 3.25Å; G237-G241 WeakPolarHBondContact O-CA 3.42Å; G237-G241 PolarHBondContact O-N 3.32Å
238V96.1Very high96.2Very high79 Ų7950.2 Ų50.248%0.47927%0.273SS..Iπ-helixtrans-67.9-57.3-176.7179.50000111.3V233 L242 Y243V233-V238 HydrophobicContact CG1-CG2 3.92Å; V233-V238 HydrophobicContact CG2-CG2 4.37Å; V238-L242 HydrophobicContact CG1-CD1 4.43Å; V238-L242 WeakPolarHBondContact O-CA 3.49Å; V238-L242 VanDerWaalsContact O-CB 3.31Å; V238-L242 WeakPolarHBondContact O-CB 3.18Å; V238-L242 PolarHBondContact O-N 2.99Å; V238-Y243 HydrophobicContact CG1-CE2 4.45Å
239V94.2Very high96Very high102 Ų10250.6 Ų50.662%0.61828%0.275SS*.Iπ-helixtrans-69.4-47.7-174.9-179.70000111.6Y243V239-Y243 WeakPolarHBondContact O-CB 3.46Å; V239-Y243 PolarHBondContact O-N 3.49Å
240H94.4Very high95.6Very high83 Ų8354.6 Ų54.638%0.38429%0.288SS..Iπ-helixtrans-81.3-18.2-175.8-61110.7000113.8R31 E236 K244R31-H240 PolarHBondContact NE-CD2 2.76Å; R31-H240 PolarHBondContact NE-NE2 2.98Å; R31-H240 VanDerWaalsContact NE-NE2 3.17Å; R31-H240 PolarHBondContact NH2-CE1 3.08Å; R31-H240 PolarHBondContact NH2-NE2 3.39Å; E236-H240 WeakPolarHBondContact O-CB 3.3Å; H240-K244 WeakPolarHBondContact O-CB 3.22Å; H240-K244 WeakPolarHBondContact O-CE 3.43Å
241G96.6Very high95.4Very high0 Ų049.6 Ų49.60%027%0.272CS..Iπ-helixtrans-96.2-67.6174.600000112.4G237 Y243 K244G237-G241 VanDerWaalsContact O-CA 3.25Å; G237-G241 WeakPolarHBondContact O-CA 3.42Å; G237-G241 PolarHBondContact O-N 3.32Å; G241-Y243 VanDerWaalsContact C-N 3.3Å; G241-Y243 PolarHBondContact O-N 3.39Å; G241-K244 VanDerWaalsContact O-CB 3.31Å; G241-K244 WeakPolarHBondContact O-CB 3.35Å; G241-K244 PolarHBondContact O-N 2.86Å
242L97Very high95.3Very high15 Ų1548.7 Ų48.78%0.07926%0.262CS..Iπ-helixtrans-70.3-20.2-172.6-61.2-176.1000114.4Y205 P206 I209 M229 V232 V233 V238Y205-L242 VanDerWaalsContact CD1-O 3.27Å; Y205-L242 WeakPolarHBondContact CD1-O 3.25Å; P206-L242 HydrophobicContact CB-CB 4.27Å; P206-L242 HydrophobicContact CB-CD1 4.38Å; P206-L242 HydrophobicContact CB-CD2 4.42Å; P206-L242 HydrophobicContact CG-CB 4.31Å; I209-L242 VanDerWaalsContact CG1-O 3.31Å; I209-L242 WeakPolarHBondContact CG1-O 3.24Å; M229-L242 HydrophobicContact CG-CD1 4.28Å; M229-L242 HydrophobicContact CG-CD2 3.86Å; V232-L242 HydrophobicContact CB-CD2 4.16Å; V232-L242 HydrophobicContact CG1-CD2 3.92Å; V233-L242 HydrophobicContact CG2-CD1 3.61Å; V233-L242 HydrophobicContact CG2-CD2 4.15Å; V233-L242 HydrophobicContact CG2-CG 3.8Å; V238-L242 HydrophobicContact CG1-CD1 4.43Å; V238-L242 WeakPolarHBondContact O-CA 3.49Å; V238-L242 VanDerWaalsContact O-CB 3.31Å; V238-L242 WeakPolarHBondContact O-CB 3.18Å; V238-L242 PolarHBondContact O-N 2.99Å
243Y96.9Very high95Very high88 Ų8850.1 Ų50.135%0.34528%0.276SS..THydrogen-bonded Turntrans-114.718.2177.6-64.3-86.5000113.2S202 Y205 P206 V238 V239 G241 G245 L246S202-Y243 WeakPolarHBondContact O-CE1 3.35Å; Y205-Y243 HydrophobicContact CD1-CD1 4.41Å; P206-Y243 HydrophobicContact CG-CE1 4.41Å; P206-Y243 HydrophobicContact CG-CE2 4.45Å; V238-Y243 HydrophobicContact CG1-CE2 4.45Å; V239-Y243 WeakPolarHBondContact O-CB 3.46Å; V239-Y243 PolarHBondContact O-N 3.49Å; G241-Y243 VanDerWaalsContact C-N 3.3Å; G241-Y243 PolarHBondContact O-N 3.39Å; Y243-G245 PolarHBondContact O-N 3.38Å; Y243-L246 HydrophobicContact CD1-CD2 4.09Å; Y243-L246 WeakPolarHBondContact O-CB 3.26Å; Y243-L246 PolarHBondContact O-N 2.94Å; Y243-L246 VanDerWaalsContact O-N 3.14Å
244K95.9Very high94.8Very high5 Ų551.9 Ų51.92%0.02229%0.288CS..THydrogen-bonded Turntrans-60.6118.3-176.3-167.8178.8-68.3-171.40112.3F25 Q26 S28 S29 T30 Y205 I209 E236 H240 G241F25-K244 HydrophobicContact CB-CD 4.43Å; F25-K244 WeakPolarHBondContact O-CD 3.45Å; Q26-K244 WeakPolarHBondContact CG-O 3.39Å; S28-K244 PolarHBondContact O-NZ 3.4Å; S29-K244 PolarHBondContact O-NZ 3.3Å; T30-K244 PolarHBondContact O-NZ 3.28Å; T30-K244 VanDerWaalsContact O-NZ 3.11Å; Y205-K244 VanDerWaalsContact CE1-O 3.23Å; Y205-K244 WeakPolarHBondContact CE1-O 2.94Å; Y205-K244 PolarHBondContact OH-O 3.35Å; I209-K244 HydrophobicContact CD1-CB 4.15Å; E236-K244 IonicContact OE1-NZ 3.43Å; E236-K244 WeakPolarHBondContact OE2-CE 3.45Å; E236-K244 IonicContact OE2-NZ 2.81Å; E236-K244 PolarHBondContact OE2-NZ 2.98Å; H240-K244 WeakPolarHBondContact O-CB 3.22Å; H240-K244 WeakPolarHBondContact O-CE 3.43Å; G241-K244 VanDerWaalsContact O-CB 3.31Å; G241-K244 WeakPolarHBondContact O-CB 3.35Å; G241-K244 PolarHBondContact O-N 2.86Å
245G95.5Very high94.7Very high1 Ų151.2 Ų51.21%0.0127%0.273CS..THydrogen-bonded Turntrans82.1817800000115Y205 Y243 S247 M248Y205-G245 PolarHBondContact OH-O 3Å; Y243-G245 PolarHBondContact O-N 3.38Å; G245-S247 PolarHBondContact O-N 3Å; G245-M248 WeakPolarHBondContact O-CB 3.44Å; G245-M248 PolarHBondContact O-N 3.38Å
246L95Very high94.7Very high21 Ų2145 Ų4511%0.1125%0.248CC..Hα-helixtrans-55.1-41.3179.217565.1000111.4Y205 Y243 M248 N249 W250Y205-L246 HydrophobicContact CD1-CB 4.41Å; Y205-L246 HydrophobicContact CD2-CB 4.29Å; Y205-L246 HydrophobicContact CD2-CD1 3.42Å; Y205-L246 VanDerWaalsContact CD2-CD1 3.42Å; Y205-L246 HydrophobicContact CD2-CG 4.42Å; Y205-L246 HydrophobicContact CE1-CB 4.14Å; Y205-L246 HydrophobicContact CE2-CB 4.01Å; Y205-L246 HydrophobicContact CE2-CD1 3.7Å; Y205-L246 HydrophobicContact CE2-CG 4.48Å; Y205-L246 HydrophobicContact CG-CB 4.46Å; Y205-L246 HydrophobicContact CG-CD1 3.98Å; Y205-L246 PolarHBondContact OH-N 3.28Å; Y205-L246 VanDerWaalsContact OH-N 3.09Å; Y243-L246 HydrophobicContact CD1-CD2 4.09Å; Y243-L246 WeakPolarHBondContact O-CB 3.26Å; Y243-L246 PolarHBondContact O-N 2.94Å; Y243-L246 VanDerWaalsContact O-N 3.14Å; L246-M248 PolarHBondContact O-N 3.04Å; L246-M248 VanDerWaalsContact O-N 3.13Å; L246-N249 VanDerWaalsContact O-CB 3.27Å; L246-N249 WeakPolarHBondContact O-CB 3.35Å; L246-N249 PolarHBondContact O-N 2.74Å; L246-W250 HydrophobicContact CD2-CZ2 4.34Å
247S94Very high94.5Very high37 Ų3747.4 Ų47.426%0.25926%0.264SS..Hα-helixtrans-63.1-20.8178.568.50000113.9Y32 G245 N249 W250 I251Y32-S247 VanDerWaalsContact CE1-OG 3.25Å; Y32-S247 WeakPolarHBondContact CE1-OG 3.28Å; Y32-S247 PolarHBondContact OH-OG 3.16Å; Y32-S247 VanDerWaalsContact OH-OG 3.1Å; G245-S247 PolarHBondContact O-N 3Å; S247-N249 PolarHBondContact O-N 2.69Å; S247-W250 WeakPolarHBondContact O-CB 3.49Å; S247-W250 PolarHBondContact O-N 3Å; S247-W250 VanDerWaalsContact O-N 3.09Å; S247-I251 PolarHBondContact O-N 3.23Å
248M95.2Very high94.4Very high5 Ų547.7 Ų47.73%0.02527%0.267CS..Hα-helixtrans-64.6-31.4172.2-168.558.77300111.3L18 T21 K22 Y32 A37 G245 L246 W250 I251 K252L18-M248 HydrophobicContact CB-CG 4.41Å; L18-M248 HydrophobicContact CB-SD 3.87Å; L18-M248 HydrophobicContact CD2-SD 3.95Å; L18-M248 HydrophobicContact CG-SD 4.33Å; T21-M248 HydrophobicContact CG2-CE 4.21Å; K22-M248 HydrophobicContact CB-CB 4.24Å; K22-M248 HydrophobicContact CB-CG 3.94Å; K22-M248 HydrophobicContact CG-CB 4.24Å; K22-M248 HydrophobicContact CG-CG 4.45Å; Y32-M248 HydrophobicContact CE2-CE 4.18Å; Y32-M248 PolarHBondContact OH-N 2.88Å; A37-M248 HydrophobicContact CB-CE 3.64Å; G245-M248 WeakPolarHBondContact O-CB 3.44Å; G245-M248 PolarHBondContact O-N 3.38Å; L246-M248 PolarHBondContact O-N 3.04Å; L246-M248 VanDerWaalsContact O-N 3.13Å; M248-W250 VanDerWaalsContact C-N 3.26Å; M248-W250 PolarHBondContact O-N 3.4Å; M248-I251 PolarHBondContact O-N 3.1Å; M248-K252 WeakPolarHBondContact O-CB 3.34Å; M248-K252 WeakPolarHBondContact O-CD 3.27Å; M248-K252 WeakPolarHBondContact O-CG 3.47Å; M248-K252 PolarHBondContact O-N 3Å
249N92.3Very high94.5Very high12 Ų1245.6 Ų45.66%0.06425%0.254CS..Hα-helixtrans-63.4-35.1173.1-72.6-10000111.7K22 Q201 L246 S247 I251 K252 G253K22-N249 WeakPolarHBondContact CD-OD1 3.25Å; K22-N249 VanDerWaalsContact CE-OD1 3.26Å; K22-N249 WeakPolarHBondContact CE-OD1 3.25Å; K22-N249 PolarHBondContact NZ-OD1 3.21Å; Q201-N249 PolarHBondContact OE1-ND2 2.9Å; L246-N249 VanDerWaalsContact O-CB 3.27Å; L246-N249 WeakPolarHBondContact O-CB 3.35Å; L246-N249 PolarHBondContact O-N 2.74Å; S247-N249 PolarHBondContact O-N 2.69Å; N249-I251 VanDerWaalsContact C-N 3.31Å; N249-I251 PolarHBondContact O-N 3.31Å; N249-K252 WeakPolarHBondContact OD1-CE 3.49Å; N249-G253 PolarHBondContact O-N 2.93Å
250W89.3Confident94.5Very high135 Ų13542.6 Ų42.651%0.51124%0.238SC..Hα-helixtrans-72.9-26.4-178.2-55.3-3.7000112.3L198 L246 S247 M248 P254L198-W250 VanDerWaalsContact CD2-CD1 3.43Å; L198-W250 HydrophobicContact CD2-CG 4.3Å; L246-W250 HydrophobicContact CD2-CZ2 4.34Å; S247-W250 WeakPolarHBondContact O-CB 3.49Å; S247-W250 PolarHBondContact O-N 3Å; S247-W250 VanDerWaalsContact O-N 3.09Å; M248-W250 VanDerWaalsContact C-N 3.26Å; M248-W250 PolarHBondContact O-N 3.4Å; W250-P254 WeakPolarHBondContact O-CD 3.25Å; W250-P254 VanDerWaalsContact O-CG 3.32Å; W250-P254 WeakPolarHBondContact O-CG 3.12Å
251I93.7Very high94.5Very high59 Ų5944.2 Ų44.230%0.30324%0.244SC..Hα-helixtrans-82.6-49.2175-63.4170.4000110.2L18 L34 S247 M248 N249 G253 I255L18-I251 HydrophobicContact CD1-CG2 4.19Å; L34-I251 HydrophobicContact CD1-CD1 4.39Å; L34-I251 HydrophobicContact CD2-CD1 3.41Å; L34-I251 VanDerWaalsContact CD2-CD1 3.41Å; S247-I251 PolarHBondContact O-N 3.23Å; M248-I251 PolarHBondContact O-N 3.1Å; N249-I251 VanDerWaalsContact C-N 3.31Å; N249-I251 PolarHBondContact O-N 3.31Å; I251-G253 VanDerWaalsContact C-N 3.32Å; I251-G253 PolarHBondContact O-N 3.17Å; I251-I255 HydrophobicContact CG2-CD1 3.88Å; I251-I255 WeakPolarHBondContact O-CD1 3.2Å; I251-I255 WeakPolarHBondContact O-CG1 3.32Å
252K94.1Very high94.4Very high38 Ų3848.4 Ų48.417%0.16527%0.27CS..Hα-helixtrans-70.3-28.3-174.481.3-160.9-168.583.90113I15 L18 D19 M248 N249 A256I15-K252 HydrophobicContact CB-CB 4.26Å; I15-K252 HydrophobicContact CD1-CB 4.23Å; I15-K252 HydrophobicContact CD1-CG 4.27Å; I15-K252 HydrophobicContact CG2-CB 4.3Å; L18-K252 HydrophobicContact CB-CB 4.32Å; L18-K252 HydrophobicContact CD1-CB 4.06Å; D19-K252 VanDerWaalsContact OD1-CD 3.31Å; D19-K252 WeakPolarHBondContact OD1-CD 3.31Å; D19-K252 VanDerWaalsContact OD1-CE 3.29Å; D19-K252 WeakPolarHBondContact OD1-CE 3.3Å; D19-K252 IonicContact OD1-NZ 3.4Å; D19-K252 PolarHBondContact OD1-NZ 2.69Å; M248-K252 WeakPolarHBondContact O-CB 3.34Å; M248-K252 WeakPolarHBondContact O-CD 3.27Å; M248-K252 WeakPolarHBondContact O-CG 3.47Å; M248-K252 PolarHBondContact O-N 3Å; N249-K252 WeakPolarHBondContact OD1-CE 3.49Å; K252-A256 VanDerWaalsContact O-CB 3.28Å; K252-A256 WeakPolarHBondContact O-CB 3.14Å; K252-A256 PolarHBondContact O-N 3.42Å
253G91.3Very high94.4Very high29 Ų2948.9 Ų48.930%0.29927%0.273SS..Hα-helixtrans-60.7-61.8-179.900000112.4N249 I251 I255 A256 V257N249-G253 PolarHBondContact O-N 2.93Å; I251-G253 VanDerWaalsContact C-N 3.32Å; I251-G253 PolarHBondContact O-N 3.17Å; G253-I255 VanDerWaalsContact C-N 3.31Å; G253-I255 PolarHBondContact O-N 2.89Å; G253-A256 PolarHBondContact O-N 2.91Å; G253-V257 WeakPolarHBondContact O-CG2 3.37Å; G253-V257 PolarHBondContact O-N 2.93Å
254P93.1Very high94.3Very high90 Ų9049.7 Ų49.758%0.58428%0.277SS*.Hα-helixtrans-56.1-41177.2-27.836.3000113.6W250 V257 G258W250-P254 WeakPolarHBondContact O-CD 3.25Å; W250-P254 VanDerWaalsContact O-CG 3.32Å; W250-P254 WeakPolarHBondContact O-CG 3.12Å; P254-V257 PolarHBondContact O-N 3.42Å; P254-G258 PolarHBondContact O-N 3.37Å
255I95.9Very high94.2Very high69 Ų6953.3 Ų53.335%0.35430%0.296SS..Hα-helixtrans-61.7-49176.7-63.7171.1000110.6T14 I15 L18 I251 G253 V257 G258 V259T14-I255 HydrophobicContact CG2-CG2 4.28Å; I15-I255 HydrophobicContact CG2-CB 4.12Å; I15-I255 HydrophobicContact CG2-CG2 3.81Å; L18-I255 HydrophobicContact CD1-CD1 4.02Å; I251-I255 HydrophobicContact CG2-CD1 3.88Å; I251-I255 WeakPolarHBondContact O-CD1 3.2Å; I251-I255 WeakPolarHBondContact O-CG1 3.32Å; G253-I255 VanDerWaalsContact C-N 3.31Å; G253-I255 PolarHBondContact O-N 2.89Å; I255-V257 VanDerWaalsContact C-N 3.32Å; I255-V257 PolarHBondContact O-N 3.4Å; I255-G258 PolarHBondContact O-N 3.48Å; I255-V259 HydrophobicContact CG2-CG2 4.26Å; I255-V259 WeakPolarHBondContact O-CB 3.35Å; I255-V259 VanDerWaalsContact O-CG2 3.22Å; I255-V259 WeakPolarHBondContact O-CG2 3.39Å; I255-V259 PolarHBondContact O-N 2.84Å
256A95.5Very high94.1Very high21 Ų2156.6 Ų56.617%0.17432%0.316CS..Hα-helixtrans-61.4-41.4179.500000112A11 I15 K252 G253 S260A11-A256 HydrophobicContact CB-CB 4.43Å; A11-A256 VanDerWaalsContact CB-O 3.32Å; A11-A256 WeakPolarHBondContact CB-O 3.45Å; I15-A256 HydrophobicContact CD1-CB 4.08Å; I15-A256 HydrophobicContact CG1-CB 4.47Å; I15-A256 HydrophobicContact CG2-CB 3.98Å; K252-A256 VanDerWaalsContact O-CB 3.28Å; K252-A256 WeakPolarHBondContact O-CB 3.14Å; K252-A256 PolarHBondContact O-N 3.42Å; G253-A256 PolarHBondContact O-N 2.91Å; A256-S260 WeakPolarHBondContact O-CB 3.14Å; A256-S260 PolarHBondContact O-N 2.95Å
257V92.6Very high94Very high79 Ų7957.4 Ų57.448%0.47932%0.32SS..Hα-helixtrans-64.6-49.5178.1172.50000110.9G253 P254 I255 V259 S260 F261G253-V257 WeakPolarHBondContact O-CG2 3.37Å; G253-V257 PolarHBondContact O-N 2.93Å; P254-V257 PolarHBondContact O-N 3.42Å; I255-V257 VanDerWaalsContact C-N 3.32Å; I255-V257 PolarHBondContact O-N 3.4Å; V257-V259 PolarHBondContact O-N 2.87Å; V257-S260 PolarHBondContact O-N 2.95Å; V257-F261 HydrophobicContact CG1-CD2 3.61Å; V257-F261 HydrophobicContact CG1-CE2 3.37Å; V257-F261 VanDerWaalsContact O-CD2 3.28Å; V257-F261 WeakPolarHBondContact O-CD2 3.22Å; V257-F261 PolarHBondContact O-N 3.44Å
258G94.9Very high93.9Very high34 Ų3456.9 Ų56.935%0.35132%0.316SS..Hα-helixtrans-61.5-43.5179.300000113P254 I255 F261 T262P254-G258 PolarHBondContact O-N 3.37Å; I255-G258 PolarHBondContact O-N 3.48Å; G258-F261 PolarHBondContact O-N 3.45Å; G258-T262 WeakPolarHBondContact O-CB 3.44Å; G258-T262 PolarHBondContact O-N 3.24Å; G258-T262 PolarHBondContact O-OG1 3.49Å
259V96.7Very high93.7Very high34 Ų3463.5 Ų63.521%0.20634%0.344CS..Hα-helixtrans-65.3-40.8175.6173.30000111.1V10 A11 T14 I255 V257 T262 T263V10-V259 HydrophobicContact CG1-CG1 3.85Å; A11-V259 HydrophobicContact CB-CB 4.39Å; A11-V259 HydrophobicContact CB-CG1 4.23Å; T14-V259 HydrophobicContact CG2-CG2 3.99Å; I255-V259 HydrophobicContact CG2-CG2 4.26Å; I255-V259 WeakPolarHBondContact O-CB 3.35Å; I255-V259 VanDerWaalsContact O-CG2 3.22Å; I255-V259 WeakPolarHBondContact O-CG2 3.39Å; I255-V259 PolarHBondContact O-N 2.84Å; V257-V259 PolarHBondContact O-N 2.87Å; V259-T262 PolarHBondContact O-N 3.36Å; V259-T263 VanDerWaalsContact O-CB 3.23Å; V259-T263 WeakPolarHBondContact O-CB 3.3Å; V259-T263 PolarHBondContact O-N 2.71Å; V259-T263 PolarHBondContact O-OG1 3.31Å
260S94.9Very high93.7Very high39 Ų3967.8 Ų67.827%0.27337%0.366SS..Hα-helixtrans-61.9-46.5177.6-171.80000111.4A7 A256 V257 Y264A7-S260 WeakPolarHBondContact CB-O 3.33Å; A256-S260 WeakPolarHBondContact O-CB 3.14Å; A256-S260 PolarHBondContact O-N 2.95Å; V257-S260 PolarHBondContact O-N 2.95Å; S260-Y264 VanDerWaalsContact O-CB 3.23Å; S260-Y264 WeakPolarHBondContact O-CB 3.42Å; S260-Y264 PolarHBondContact O-N 3.04Å
261F93.9Very high93.7Very high117 Ų11765.6 Ų65.651%0.51336%0.364SS..Hα-helixtrans-63.9-49.5177.2-77-56.6000111.9V257 G258 T263 Y264 D265V257-F261 HydrophobicContact CG1-CD2 3.61Å; V257-F261 HydrophobicContact CG1-CE2 3.37Å; V257-F261 VanDerWaalsContact O-CD2 3.28Å; V257-F261 WeakPolarHBondContact O-CD2 3.22Å; V257-F261 PolarHBondContact O-N 3.44Å; G258-F261 PolarHBondContact O-N 3.45Å; F261-T263 VanDerWaalsContact C-N 3.29Å; F261-T263 PolarHBondContact O-N 2.95Å; F261-Y264 PolarHBondContact O-N 2.75Å; F261-Y264 VanDerWaalsContact O-N 3.15Å; F261-D265 PolarHBondContact O-N 3.05Å
262T95.8Very high93.4Very high88 Ų8870.3 Ų70.354%0.5438%0.378SS..Hα-helixtrans-58.6-43.2-179.9-540000111.6G258 V259 T266G258-T262 WeakPolarHBondContact O-CB 3.44Å; G258-T262 PolarHBondContact O-N 3.24Å; G258-T262 PolarHBondContact O-OG1 3.49Å; V259-T262 PolarHBondContact O-N 3.36Å; T262-T266 WeakPolarHBondContact O-CB 3.14Å; T262-T266 PolarHBondContact O-N 2.75Å; T262-T266 PolarHBondContact O-OG1 3.44Å
263T95.5Very high93.1Very high25 Ų2572.2 Ų72.215%0.15340%0.395CS..Hα-helixtrans-68.1-43.6178.7-53.20000110.8A7 V10 V259 F261 T266 L267A7-T263 HydrophobicContact CB-CG2 4.07Å; V10-T263 HydrophobicContact CB-CG2 4.12Å; V10-T263 HydrophobicContact CG1-CG2 4.33Å; V10-T263 HydrophobicContact CG2-CG2 4.08Å; V259-T263 VanDerWaalsContact O-CB 3.23Å; V259-T263 WeakPolarHBondContact O-CB 3.3Å; V259-T263 PolarHBondContact O-N 2.71Å; V259-T263 PolarHBondContact O-OG1 3.31Å; F261-T263 VanDerWaalsContact C-N 3.29Å; F261-T263 PolarHBondContact O-N 2.95Å; T263-T266 PolarHBondContact O-N 3.17Å; T263-L267 HydrophobicContact CG2-CD1 3.79Å; T263-L267 HydrophobicContact CG2-CG 4.28Å; T263-L267 WeakPolarHBondContact O-CB 3.46Å; T263-L267 WeakPolarHBondContact O-CG 3.25Å; T263-L267 PolarHBondContact O-N 3.3Å
264Y94.4Very high92.8Very high106 Ų10678 Ų7842%0.41641%0.409SS..Hα-helixtrans-59.7-50177.6178.9-97.9000111.7A3 S260 F261 T266 L267 V268A3-Y264 HydrophobicContact CB-CD2 4.1Å; A3-Y264 HydrophobicContact CB-CE2 4.17Å; S260-Y264 VanDerWaalsContact O-CB 3.23Å; S260-Y264 WeakPolarHBondContact O-CB 3.42Å; S260-Y264 PolarHBondContact O-N 3.04Å; F261-Y264 PolarHBondContact O-N 2.75Å; F261-Y264 VanDerWaalsContact O-N 3.15Å; Y264-T266 VanDerWaalsContact C-N 3.32Å; Y264-T266 PolarHBondContact O-N 3.13Å; Y264-L267 PolarHBondContact O-N 3.42Å; Y264-V268 HydrophobicContact CD1-CG2 4.18Å; Y264-V268 HydrophobicContact CD2-CG2 4.32Å; Y264-V268 HydrophobicContact CE1-CG2 3.78Å; Y264-V268 HydrophobicContact CE2-CG2 3.93Å; Y264-V268 HydrophobicContact CG-CG2 4.44Å; Y264-V268 WeakPolarHBondContact O-CB 3.45Å; Y264-V268 WeakPolarHBondContact O-CG2 3.42Å; Y264-V268 PolarHBondContact O-N 3.05Å
265D93.8Very high92.4Very high80 Ų8075 Ų7543%0.42839%0.389SS..Hα-helixtrans-62.8-40.4-179-69.5-17.3000111.5F261 K269F261-D265 PolarHBondContact O-N 3.05Å; D265-K269 WeakPolarHBondContact O-CB 3.26Å; D265-K269 WeakPolarHBondContact O-CG 3.31Å; D265-K269 PolarHBondContact O-N 3.37Å
266T94.5Very high91.8Very high71 Ų7179.9 Ų79.944%0.43641%0.408SS..Hα-helixtrans-63.9-46.3176.5-57.30000111.1T262 T263 Y264 K269 I270T262-T266 WeakPolarHBondContact O-CB 3.14Å; T262-T266 PolarHBondContact O-N 2.75Å; T262-T266 PolarHBondContact O-OG1 3.44Å; T263-T266 PolarHBondContact O-N 3.17Å; Y264-T266 VanDerWaalsContact C-N 3.32Å; Y264-T266 PolarHBondContact O-N 3.13Å; T266-K269 PolarHBondContact O-N 2.66Å; T266-I270 HydrophobicContact CG2-CD1 3.92Å; T266-I270 VanDerWaalsContact O-CG1 3.29Å; T266-I270 WeakPolarHBondContact O-CG1 3.25Å; T266-I270 PolarHBondContact O-N 3.33Å
267L93Very high91Very high37 Ų3786 Ų8619%0.19444%0.435CS..Hα-helixtrans-65.4-41.9179.2-70.6171.3000112.1A3 L6 T263 Y264 I270 L271A3-L267 HydrophobicContact CB-CB 3.88Å; A3-L267 HydrophobicContact CB-CD1 4.29Å; L6-L267 HydrophobicContact CB-CD1 3.82Å; L6-L267 HydrophobicContact CD2-CD1 3.63Å; L6-L267 HydrophobicContact CD2-CD2 3.8Å; L6-L267 HydrophobicContact CD2-CG 4.38Å; L6-L267 HydrophobicContact CG-CD1 3.81Å; T263-L267 HydrophobicContact CG2-CD1 3.79Å; T263-L267 HydrophobicContact CG2-CG 4.28Å; T263-L267 WeakPolarHBondContact O-CB 3.46Å; T263-L267 WeakPolarHBondContact O-CG 3.25Å; T263-L267 PolarHBondContact O-N 3.3Å; Y264-L267 PolarHBondContact O-N 3.42Å; L267-I270 PolarHBondContact O-N 2.92Å; L267-L271 WeakPolarHBondContact O-CB 3.43Å; L267-L271 WeakPolarHBondContact O-CD1 3.3Å; L267-L271 WeakPolarHBondContact O-CG 3.46Å; L267-L271 PolarHBondContact O-N 2.91Å
268V92Very high90.5Very high27 Ų2787 Ų8716%0.16444%0.437CS..Hα-helixtrans-64.4-40.7176.3170.30000110.9A3 Y264 L271 R272A3-V268 HydrophobicContact CB-CG2 4.3Å; Y264-V268 HydrophobicContact CD1-CG2 4.18Å; Y264-V268 HydrophobicContact CD2-CG2 4.32Å; Y264-V268 HydrophobicContact CE1-CG2 3.78Å; Y264-V268 HydrophobicContact CE2-CG2 3.93Å; Y264-V268 HydrophobicContact CG-CG2 4.44Å; Y264-V268 WeakPolarHBondContact O-CB 3.45Å; Y264-V268 WeakPolarHBondContact O-CG2 3.42Å; Y264-V268 PolarHBondContact O-N 3.05Å; V268-L271 PolarHBondContact O-N 3.25Å; V268-R272 HydrophobicContact CG1-CG 4.38Å; V268-R272 WeakPolarHBondContact O-CB 3.38Å; V268-R272 VanDerWaalsContact O-CG 3.27Å; V268-R272 WeakPolarHBondContact O-CG 3.34Å; V268-R272 PolarHBondContact O-N 3.07Å
269K91.6Very high89.1Confident143 Ų14388.4 Ų88.462%0.62245%0.452SS*.Hα-helixtrans-61.7-45.7174.5-75.6171.5-1761780111.9D265 T266 R272 C273D265-K269 WeakPolarHBondContact O-CB 3.26Å; D265-K269 WeakPolarHBondContact O-CG 3.31Å; D265-K269 PolarHBondContact O-N 3.37Å; T266-K269 PolarHBondContact O-N 2.66Å; K269-R272 PolarHBondContact O-N 3.38Å; K269-C273 WeakPolarHBondContact O-CB 3.32Å; K269-C273 PolarHBondContact O-N 2.97Å
270I91.2Very high87.5Confident103 Ų10393 Ų9353%0.52847%0.471SS..Hα-helixtrans-62-46.1176.7-68.3166.4000110.4T266 L267 R272 C273 Y274T266-I270 HydrophobicContact CG2-CD1 3.92Å; T266-I270 VanDerWaalsContact O-CG1 3.29Å; T266-I270 WeakPolarHBondContact O-CG1 3.25Å; T266-I270 PolarHBondContact O-N 3.33Å; L267-I270 PolarHBondContact O-N 2.92Å; I270-R272 PolarHBondContact O-N 3.34Å; I270-C273 WeakPolarHBondContact O-CB 3.17Å; I270-C273 PolarHBondContact O-N 3.47Å; I270-Y274 WeakPolarHBondContact O-CB 3.38Å; I270-Y274 PolarHBondContact O-N 3.44Å
271L89.5Confident85.4Confident88 Ų8898.1 Ų98.146%0.46150%0.501SS..Hα-helixtrans-60-43.9176.9-81.4157.6000111.7A3 L267 V268 Y274 V275A3-L271 HydrophobicContact CB-CD1 4.12Å; L267-L271 WeakPolarHBondContact O-CB 3.43Å; L267-L271 WeakPolarHBondContact O-CD1 3.3Å; L267-L271 WeakPolarHBondContact O-CG 3.46Å; L267-L271 PolarHBondContact O-N 2.91Å; V268-L271 PolarHBondContact O-N 3.25Å; L271-Y274 PolarHBondContact O-N 3.44Å; L271-V275 WeakPolarHBondContact O-CB 3.42Å; L271-V275 WeakPolarHBondContact O-CG2 3.18Å; L271-V275 PolarHBondContact O-N 2.98Å
272R88Confident83.6Confident159 Ų15995.9 Ų95.960%0.650%0.497SS*.Hα-helixtrans-63.2-42.5175.8-75.3175.4-178.7176.11.8112.1V268 K269 I270 Y274 F276V268-R272 HydrophobicContact CG1-CG 4.38Å; V268-R272 WeakPolarHBondContact O-CB 3.38Å; V268-R272 VanDerWaalsContact O-CG 3.27Å; V268-R272 WeakPolarHBondContact O-CG 3.34Å; V268-R272 PolarHBondContact O-N 3.07Å; K269-R272 PolarHBondContact O-N 3.38Å; I270-R272 PolarHBondContact O-N 3.34Å; R272-Y274 VanDerWaalsContact C-N 3.35Å; R272-F276 VanDerWaalsContact O-CB 3.24Å; R272-F276 WeakPolarHBondContact O-CB 3.28Å; R272-F276 PolarHBondContact O-N 2.81Å
273C86.6Confident81.2Confident77 Ų7798.8 Ų98.852%0.5251%0.509SS..Hα-helixtrans-61.7-44.9175.5-171.80000110.8K269 I270 F276 M277K269-C273 WeakPolarHBondContact O-CB 3.32Å; K269-C273 PolarHBondContact O-N 2.97Å; I270-C273 WeakPolarHBondContact O-CB 3.17Å; I270-C273 PolarHBondContact O-N 3.47Å; C273-F276 PolarHBondContact O-N 2.9Å; C273-M277 WeakPolarHBondContact O-CB 3.45Å; C273-M277 WeakPolarHBondContact O-CG 3.37Å; C273-M277 PolarHBondContact O-N 3.15Å
274Y86.1Confident79.2Confident150 Ų150104.8 Ų104.859%0.58853%0.533SS*.Hα-helixtrans-64.7-45.3178.6-171.5-101.1000112.5I270 L271 R272 F276 M277 L278I270-Y274 WeakPolarHBondContact O-CB 3.38Å; I270-Y274 PolarHBondContact O-N 3.44Å; L271-Y274 PolarHBondContact O-N 3.44Å; R272-Y274 VanDerWaalsContact C-N 3.35Å; Y274-F276 PolarHBondContact O-N 3.47Å; Y274-M277 PolarHBondContact O-N 3.38Å; Y274-L278 HydrophobicContact CD1-CD1 3.74Å; Y274-L278 HydrophobicContact CD1-CG 4.35Å; Y274-L278 HydrophobicContact CE1-CD1 3.25Å; Y274-L278 HydrophobicContact CE1-CG 4.04Å; Y274-L278 WeakPolarHBondContact O-CG 3.34Å; Y274-L278 PolarHBondContact O-N 2.96Å
275V84.1Confident76.3Confident29 Ų29109 Ų10918%0.17655%0.553CS.*Hα-helixtrans-62.4-42176.2168.30000111.2L271 L278 G279 E280 V282L271-V275 WeakPolarHBondContact O-CB 3.42Å; L271-V275 WeakPolarHBondContact O-CG2 3.18Å; L271-V275 PolarHBondContact O-N 2.98Å; V275-L278 PolarHBondContact O-N 2.85Å; V275-G279 PolarHBondContact O-N 3.37Å; V275-E280 WeakPolarHBondContact CG1-O 3.49Å; V275-E280 PolarHBondContact O-N 2.71Å; V275-V282 HydrophobicContact CG1-CB 4.25Å; V275-V282 HydrophobicContact CG1-CG2 4.25Å
276F82.7Confident73.6Confident171 Ų171114.6 Ų114.675%0.7560%0.599SS**Hα-helixtrans-62.3-42.2173.9-178.2-97.9000112.3R272 C273 Y274 L278 G279R272-F276 VanDerWaalsContact O-CB 3.24Å; R272-F276 WeakPolarHBondContact O-CB 3.28Å; R272-F276 PolarHBondContact O-N 2.81Å; C273-F276 PolarHBondContact O-N 2.9Å; Y274-F276 PolarHBondContact O-N 3.47Å; F276-L278 VanDerWaalsContact C-N 3.27Å; F276-L278 PolarHBondContact O-N 3.16Å; F276-G279 PolarHBondContact O-N 2.82Å; F276-G279 VanDerWaalsContact O-N 3.15Å
277M80.2Confident72.5Confident150 Ų150116.8 Ų116.874%0.73961%0.607SS**Hα-helixtrans-66.1-27.4176-69.7-72.9-72.200113C273 Y274 G279C273-M277 WeakPolarHBondContact O-CB 3.45Å; C273-M277 WeakPolarHBondContact O-CG 3.37Å; C273-M277 PolarHBondContact O-N 3.15Å; Y274-M277 PolarHBondContact O-N 3.38Å; M277-G279 VanDerWaalsContact C-N 3.34Å
278L80.5Confident71.4Confident98 Ų98120.9 Ų120.951%0.51363%0.629SS.*THydrogen-bonded Turntrans-83.1-6.3174.6-71.3-179.5000113.8Y274 V275 F276 E280Y274-L278 HydrophobicContact CD1-CD1 3.74Å; Y274-L278 HydrophobicContact CD1-CG 4.35Å; Y274-L278 HydrophobicContact CE1-CD1 3.25Å; Y274-L278 HydrophobicContact CE1-CG 4.04Å; Y274-L278 WeakPolarHBondContact O-CG 3.34Å; Y274-L278 PolarHBondContact O-N 2.96Å; V275-L278 PolarHBondContact O-N 2.85Å; F276-L278 VanDerWaalsContact C-N 3.27Å; F276-L278 PolarHBondContact O-N 3.16Å; L278-E280 PolarHBondContact O-N 3.47Å
279G67Low70.3Confident65 Ų65126.2 Ų126.267%0.6766%0.655SS**THydrogen-bonded Turntrans72.57.7179.900000115.1V275 F276 M277V275-G279 PolarHBondContact O-N 3.37Å; F276-G279 PolarHBondContact O-N 2.82Å; F276-G279 VanDerWaalsContact O-N 3.15Å; M277-G279 VanDerWaalsContact C-N 3.34Å
280E61.3Low69Low129 Ų129125.2 Ų125.260%0.60366%0.657SS**  trans-90.9116.8176.5-68.7-171.8162.300110.2V275 L278 V282V275-E280 WeakPolarHBondContact CG1-O 3.49Å; V275-E280 PolarHBondContact O-N 2.71Å; L278-E280 PolarHBondContact O-N 3.47Å; E280-V282 HydrophobicContact CB-CG2 4.38Å; E280-V282 PolarHBondContact O-N 3.05Å; E280-V282 VanDerWaalsContact O-N 3.07Å
281T52.6Low67.7Low147 Ų147126.6 Ų126.690%0.90267%0.665SS**  trans-77.191.2171.351.30000109.9
282V55.5Low66.2Low71 Ų71129.1 Ų129.143%0.4368%0.678SS.*  trans-99.4108.8170-1710000110.1V275 E280 F284V275-V282 HydrophobicContact CG1-CB 4.25Å; V275-V282 HydrophobicContact CG1-CG2 4.25Å; E280-V282 HydrophobicContact CB-CG2 4.38Å; E280-V282 PolarHBondContact O-N 3.05Å; E280-V282 VanDerWaalsContact O-N 3.07Å; V282-F284 HydrophobicContact CB-CD2 4.08Å; V282-F284 HydrophobicContact CB-CE2 3.71Å; V282-F284 HydrophobicContact CB-CZ 4.48Å; V282-F284 HydrophobicContact CG1-CD2 3.69Å; V282-F284 HydrophobicContact CG1-CE1 4.34Å; V282-F284 HydrophobicContact CG1-CE2 3.27Å; V282-F284 HydrophobicContact CG1-CG 4.39Å; V282-F284 HydrophobicContact CG1-CZ 3.64Å; V282-F284 PolarHBondContact O-N 2.95Å; V282-F284 VanDerWaalsContact O-N 3.1Å
283D45.6Very low64.6Low148 Ų148127 Ų12779%0.79168%0.684SS**  trans-79.189.7-179.6-141.1-16.6000110.3K285D283-K285 VanDerWaalsContact C-N 3.28Å; D283-K285 PolarHBondContact O-N 3.16Å
284F53.4Low63Low151 Ų151130.8 Ų130.866%0.66270%0.696SS**  trans-82.472.4175.4-75.4-80.7000110.8V282V282-F284 HydrophobicContact CB-CD2 4.08Å; V282-F284 HydrophobicContact CB-CE2 3.71Å; V282-F284 HydrophobicContact CB-CZ 4.48Å; V282-F284 HydrophobicContact CG1-CD2 3.69Å; V282-F284 HydrophobicContact CG1-CE1 4.34Å; V282-F284 HydrophobicContact CG1-CE2 3.27Å; V282-F284 HydrophobicContact CG1-CG 4.39Å; V282-F284 HydrophobicContact CG1-CZ 3.64Å; V282-F284 PolarHBondContact O-N 2.95Å; V282-F284 VanDerWaalsContact O-N 3.1Å
285K33.6Very low61Low194 Ų194129.3 Ų129.384%0.84371%0.705SS**  trans-120.983.8161.9-86.4-176.7177.5172.60110D283D283-K285 VanDerWaalsContact C-N 3.28Å; D283-K285 PolarHBondContact O-N 3.16Å
286S35.8Very low58.9Low198 Ų198138.4 Ų138.4100%1.38575%0.754SS**  trans-164.50150.8-1630000109.1

Retrieved 286 of 286 residues in 203.5 ms (Link to these results)

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