G4LW70_SCHMA Loading...

Tetraspanin

AlphaFold DB , UniProt , Accession G4LW70, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 218 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
1M46.4Very low70.7Confident200 Ų20086.5 Ų86.599%0.98552%0.52SS*.  098.50-142.4-176.3-70.300106.8T3M1-T3 PolarHBondContact O-N 2.89Å; M1-T3 VanDerWaalsContact O-N 3.12Å
2A55.6Low71.9Confident57 Ų5783.5 Ų83.547%0.47150%0.495SS..  trans-51.7124.5172.300000107.4L4A2-L4 PolarHBondContact O-N 3.49Å
3T54.8Low73.2Confident128 Ų12882.7 Ų82.779%0.78550%0.496SS*.  trans-69.480.517541.90000107.1M1 G5M1-T3 PolarHBondContact O-N 2.89Å; M1-T3 VanDerWaalsContact O-N 3.12Å; T3-G5 PolarHBondContact O-N 3.49Å
4L62.1Low74.2Confident32 Ų3281.9 Ų81.917%0.16850%0.495CS..  trans-50.6117.3164.4-105.774.8000105.3A2 T6 M8 R9 L208A2-L4 PolarHBondContact O-N 3.49Å; L4-T6 PolarHBondContact O-N 3.26Å; L4-M8 HydrophobicContact CB-CB 4.37Å; L4-M8 HydrophobicContact CD2-CB 3.99Å; L4-M8 HydrophobicContact CD2-CG 3.58Å; L4-M8 HydrophobicContact CG-CB 3.99Å; L4-M8 HydrophobicContact CG-CG 3.79Å; L4-R9 HydrophobicContact CB-CG 3.57Å; L4-R9 HydrophobicContact CD2-CG 4Å; L4-R9 HydrophobicContact CG-CG 4.45Å; L4-R9 PolarHBondContact O-NE 3.39Å; L4-R9 PolarHBondContact O-NH2 3.28Å; L4-L208 HydrophobicContact CD2-CD2 4.04Å
5G72.9Confident75.1Confident50 Ų5077.8 Ų77.852%0.51547%0.47SS..  trans-50.5143.1171.500000108.4T3 G7 M8 R9T3-G5 PolarHBondContact O-N 3.49Å; G5-G7 PolarHBondContact O-N 3.05Å; G5-M8 PolarHBondContact O-N 3.01Å; G5-R9 PolarHBondContact O-N 3.37Å
6T76.9Confident76.2Confident114 Ų11476.9 Ų76.970%0.69946%0.458SS*.Hα-helixtrans-46.8-37.9-174.2-50.50000112.2L4 M8 R9 C10L4-T6 PolarHBondContact O-N 3.26Å; T6-M8 PolarHBondContact O-N 3.12Å; T6-R9 PolarHBondContact O-N 3.42Å; T6-C10 PolarHBondContact O-N 2.89Å; T6-C10 VanDerWaalsContact O-N 3.16Å; T6-C10 PolarHBondContact O-SG 3.42Å; T6-C10 VanDerWaalsContact O-SG 3.4Å
7G79.7Confident77.2Confident47 Ų4777.1 Ų77.149%0.48546%0.46SS..Hα-helixtrans-58.6-44.6174.900000114.8G5 R9 C10 L11G5-G7 PolarHBondContact O-N 3.05Å; G7-R9 VanDerWaalsContact C-N 3.33Å; G7-R9 PolarHBondContact O-N 3.48Å; G7-C10 PolarHBondContact O-N 3.28Å; G7-L11 WeakPolarHBondContact O-CG 3.49Å; G7-L11 PolarHBondContact O-N 3.14Å
8M78.2Confident78.1Confident42 Ų4277.3 Ų77.321%0.20746%0.458CS..Hα-helixtrans-68.3-33.2-180-171.762.773.800111.9L4 G5 T6 L11 K12 C207 L208L4-M8 HydrophobicContact CB-CB 4.37Å; L4-M8 HydrophobicContact CD2-CB 3.99Å; L4-M8 HydrophobicContact CD2-CG 3.58Å; L4-M8 HydrophobicContact CG-CB 3.99Å; L4-M8 HydrophobicContact CG-CG 3.79Å; G5-M8 PolarHBondContact O-N 3.01Å; T6-M8 PolarHBondContact O-N 3.12Å; M8-L11 PolarHBondContact O-N 3.01Å; M8-K12 WeakPolarHBondContact O-CB 3.35Å; M8-K12 PolarHBondContact O-N 3.48Å; M8-C207 HydrophobicContact CE-CB 3.86Å; M8-L208 HydrophobicContact CG-CD2 4.24Å; M8-L208 HydrophobicContact SD-CD2 4.49Å
9R82.7Confident78.9Confident128 Ų12873.8 Ų73.848%0.48344%0.437SS..Hα-helixtrans-65.2-45.3174.8-57-171.9-161.6-165.12.2111L4 G5 T6 G7 L11 K12 S13L4-R9 HydrophobicContact CB-CG 3.57Å; L4-R9 HydrophobicContact CD2-CG 4Å; L4-R9 HydrophobicContact CG-CG 4.45Å; L4-R9 PolarHBondContact O-NE 3.39Å; L4-R9 PolarHBondContact O-NH2 3.28Å; G5-R9 PolarHBondContact O-N 3.37Å; T6-R9 PolarHBondContact O-N 3.42Å; G7-R9 VanDerWaalsContact C-N 3.33Å; G7-R9 PolarHBondContact O-N 3.48Å; R9-L11 VanDerWaalsContact C-N 3.34Å; R9-L11 PolarHBondContact O-N 3.46Å; R9-K12 PolarHBondContact O-N 2.88Å; R9-S13 PolarHBondContact O-N 3.02Å; R9-S13 PolarHBondContact O-OG 3.28Å
10C85Confident79.8Confident74 Ų7473.2 Ų73.250%0.543%0.43SS..Hα-helixtrans-59.3-46.4174.8-65.30000110.9T6 G7 S13 C14T6-C10 PolarHBondContact O-N 2.89Å; T6-C10 VanDerWaalsContact O-N 3.16Å; T6-C10 PolarHBondContact O-SG 3.42Å; T6-C10 VanDerWaalsContact O-SG 3.4Å; G7-C10 PolarHBondContact O-N 3.28Å; C10-S13 PolarHBondContact O-N 3.31Å; C10-C14 WeakPolarHBondContact O-CB 3.44Å; C10-C14 PolarHBondContact O-N 3.36Å; C10-C14 PolarHBondContact O-SG 3.35Å
11L83.2Confident80.6Confident80 Ų8073.9 Ų73.942%0.41943%0.431SS..Hα-helixtrans-62.8-43.9178.6-71.2175.8000112.9G7 M8 R9 S13 C14 V15 I204G7-L11 WeakPolarHBondContact O-CG 3.49Å; G7-L11 PolarHBondContact O-N 3.14Å; M8-L11 PolarHBondContact O-N 3.01Å; R9-L11 VanDerWaalsContact C-N 3.34Å; R9-L11 PolarHBondContact O-N 3.46Å; L11-S13 PolarHBondContact O-N 3.07Å; L11-C14 PolarHBondContact O-N 3.38Å; L11-V15 WeakPolarHBondContact O-CG2 3.41Å; L11-V15 PolarHBondContact O-N 3.16Å; L11-I204 HydrophobicContact CB-CD1 3.82Å; L11-I204 HydrophobicContact CB-CG1 4.25Å; L11-I204 HydrophobicContact CD1-CD1 4.32Å; L11-I204 HydrophobicContact CD1-CG1 4.4Å; L11-I204 HydrophobicContact CD2-CD1 4.16Å; L11-I204 HydrophobicContact CG-CD1 4.32Å
12K85.2Confident83Confident50 Ų5066.9 Ų66.922%0.21740%0.402CS..Hα-helixtrans-56.8-49.4174-179.4179179.2178.30110.6M8 R9 V15 F16 A76 E79 L208M8-K12 WeakPolarHBondContact O-CB 3.35Å; M8-K12 PolarHBondContact O-N 3.48Å; R9-K12 PolarHBondContact O-N 2.88Å; K12-V15 PolarHBondContact O-N 2.85Å; K12-F16 VanDerWaalsContact O-CB 3.31Å; K12-F16 WeakPolarHBondContact O-CB 3.44Å; K12-F16 PolarHBondContact O-N 3.49Å; K12-A76 WeakPolarHBondContact CE-O 3.29Å; K12-A76 PolarHBondContact NZ-O 3.36Å; K12-E79 IonicContact NZ-OE1 3.43Å; K12-E79 PolarHBondContact NZ-OE1 3.26Å; K12-L208 HydrophobicContact CB-CD1 4.06Å; K12-L208 HydrophobicContact CB-CD2 4.5Å; K12-L208 HydrophobicContact CD-CD1 4.15Å; K12-L208 HydrophobicContact CD-CD2 4.13Å; K12-L208 HydrophobicContact CG-CD1 3.84Å
13S88.4Confident85Confident73 Ų7365.7 Ų65.751%0.5139%0.387SS..Hα-helixtrans-63.1-42178.9-67.30000112.3R9 C10 L11 F16 V17R9-S13 PolarHBondContact O-N 3.02Å; R9-S13 PolarHBondContact O-OG 3.28Å; C10-S13 PolarHBondContact O-N 3.31Å; L11-S13 PolarHBondContact O-N 3.07Å; S13-F16 PolarHBondContact O-N 3.32Å; S13-V17 WeakPolarHBondContact O-CG2 3.48Å; S13-V17 PolarHBondContact O-N 3.08Å
14C87.9Confident87Confident72 Ų7264.5 Ų64.549%0.48638%0.375SS..Hα-helixtrans-61.2-49.5175.7-70.90000111.7C10 L11 F16 V17 L18C10-C14 WeakPolarHBondContact O-CB 3.44Å; C10-C14 PolarHBondContact O-N 3.36Å; C10-C14 PolarHBondContact O-SG 3.35Å; L11-C14 PolarHBondContact O-N 3.38Å; C14-F16 VanDerWaalsContact C-N 3.3Å; C14-F16 PolarHBondContact O-N 3Å; C14-V17 PolarHBondContact O-N 2.96Å; C14-L18 WeakPolarHBondContact O-CB 3.4Å; C14-L18 VanDerWaalsContact O-CG 3.27Å; C14-L18 WeakPolarHBondContact O-CG 3.46Å; C14-L18 PolarHBondContact O-N 3.18Å
15V88.3Confident88.7Confident20 Ų2066.1 Ų66.112%0.12139%0.389CS..Hα-helixtrans-61.7-40.2178.3170.20000111.1L11 K12 L18 N19 I204L11-V15 WeakPolarHBondContact O-CG2 3.41Å; L11-V15 PolarHBondContact O-N 3.16Å; K12-V15 PolarHBondContact O-N 2.85Å; V15-L18 PolarHBondContact O-N 3.03Å; V15-N19 VanDerWaalsContact CG1-ND2 3.29Å; V15-N19 WeakPolarHBondContact CG1-ND2 3.49Å; V15-N19 WeakPolarHBondContact O-CB 3.29Å; V15-N19 PolarHBondContact O-N 3.31Å; V15-N19 PolarHBondContact O-ND2 3.49Å; V15-I204 HydrophobicContact CG2-CB 4.43Å; V15-I204 HydrophobicContact CG2-CD1 3.52Å; V15-I204 HydrophobicContact CG2-CG2 4.19Å
16F92.1Very high89.9Confident63 Ų6363.8 Ų63.828%0.27636%0.364SS..Hα-helixtrans-61.1-49.8176.6177.8-106.9000112K12 S13 C14 L18 N19 I20 C73 A76 I77K12-F16 VanDerWaalsContact O-CB 3.31Å; K12-F16 WeakPolarHBondContact O-CB 3.44Å; K12-F16 PolarHBondContact O-N 3.49Å; S13-F16 PolarHBondContact O-N 3.32Å; C14-F16 VanDerWaalsContact C-N 3.3Å; C14-F16 PolarHBondContact O-N 3Å; F16-L18 PolarHBondContact O-N 3.28Å; F16-N19 PolarHBondContact O-N 3.25Å; F16-I20 HydrophobicContact CE1-CG1 4.32Å; F16-I20 HydrophobicContact CE2-CG1 4.34Å; F16-I20 HydrophobicContact CZ-CD1 4.32Å; F16-I20 HydrophobicContact CZ-CG1 4.08Å; F16-I20 PolarHBondContact O-N 3.33Å; F16-C73 HydrophobicContact CE2-CB 4.4Å; F16-C73 VanDerWaalsContact CE2-SG 3.52Å; F16-A76 HydrophobicContact CD2-CB 4.27Å; F16-I77 HydrophobicContact CD2-CG1 4.21Å; F16-I77 HydrophobicContact CE2-CD1 3.48Å; F16-I77 VanDerWaalsContact CE2-CD1 3.48Å; F16-I77 HydrophobicContact CE2-CG1 3.36Å; F16-I77 HydrophobicContact CZ-CD1 3.69Å; F16-I77 HydrophobicContact CZ-CG1 3.82Å
17V93.3Very high90.9Very high80 Ų8062.6 Ų62.649%0.48535%0.353SS..Hα-helixtrans-62.8-43.5178.2171.90000111.3S13 C14 N19 I20 I21S13-V17 WeakPolarHBondContact O-CG2 3.48Å; S13-V17 PolarHBondContact O-N 3.08Å; C14-V17 PolarHBondContact O-N 2.96Å; V17-N19 PolarHBondContact O-N 2.92Å; V17-I20 PolarHBondContact O-N 3.36Å; V17-I21 HydrophobicContact CG1-CD1 4.04Å; V17-I21 WeakPolarHBondContact O-CG1 3.34Å; V17-I21 PolarHBondContact O-N 3.25Å
18L92.4Very high91.8Very high82 Ų8265.2 Ų65.243%0.42936%0.36SS..Hα-helixtrans-60.9-42.8176.9-72.3172.4000111.8C14 V15 F16 I20 I21 C22C14-L18 WeakPolarHBondContact O-CB 3.4Å; C14-L18 VanDerWaalsContact O-CG 3.27Å; C14-L18 WeakPolarHBondContact O-CG 3.46Å; C14-L18 PolarHBondContact O-N 3.18Å; V15-L18 PolarHBondContact O-N 3.03Å; F16-L18 PolarHBondContact O-N 3.28Å; L18-I20 VanDerWaalsContact C-N 3.34Å; L18-I20 PolarHBondContact O-N 3.34Å; L18-I21 PolarHBondContact O-N 3.09Å; L18-C22 WeakPolarHBondContact O-CB 3.41Å; L18-C22 PolarHBondContact O-N 3.19Å; L18-C22 PolarHBondContact O-SG 2.98Å
19N95Very high92.7Very high10 Ų1066.4 Ų66.45%0.05337%0.367CS..Hα-helixtrans-64.7-35.3176.1-79.7-66.7000112.3V15 F16 V17 L23 S69 Y87V15-N19 VanDerWaalsContact CG1-ND2 3.29Å; V15-N19 WeakPolarHBondContact CG1-ND2 3.49Å; V15-N19 WeakPolarHBondContact O-CB 3.29Å; V15-N19 PolarHBondContact O-N 3.31Å; V15-N19 PolarHBondContact O-ND2 3.49Å; F16-N19 PolarHBondContact O-N 3.25Å; V17-N19 PolarHBondContact O-N 2.92Å; N19-L23 VanDerWaalsContact O-CB 3.24Å; N19-L23 WeakPolarHBondContact O-CB 3.34Å; N19-L23 PolarHBondContact O-N 2.95Å; N19-S69 WeakPolarHBondContact O-CB 3.37Å; N19-Y87 PolarHBondContact ND2-OH 3.42Å; N19-Y87 PolarHBondContact OD1-OH 3.23Å
20I96Very high93.4Very high61 Ų6162.2 Ų62.231%0.31335%0.354SS..Hα-helixtrans-64.4-43.5172.9-69-66.1000111.1F16 V17 L18 L23 L24 C73F16-I20 HydrophobicContact CE1-CG1 4.32Å; F16-I20 HydrophobicContact CE2-CG1 4.34Å; F16-I20 HydrophobicContact CZ-CD1 4.32Å; F16-I20 HydrophobicContact CZ-CG1 4.08Å; F16-I20 PolarHBondContact O-N 3.33Å; V17-I20 PolarHBondContact O-N 3.36Å; L18-I20 VanDerWaalsContact C-N 3.34Å; L18-I20 PolarHBondContact O-N 3.34Å; I20-L23 WeakPolarHBondContact O-CB 3.39Å; I20-L23 PolarHBondContact O-N 3.47Å; I20-L24 WeakPolarHBondContact O-CG 3.34Å; I20-L24 PolarHBondContact O-N 3.35Å; I20-C73 HydrophobicContact CD1-CB 4.42Å; I20-C73 WeakPolarHBondContact CD1-SG 3.22Å
21I96.6Very high94Very high88 Ų8860.7 Ų60.745%0.45135%0.35SS..Hα-helixtrans-61.6-49176.5-65.9167.3000110.2V17 L18 L23 L24 C25V17-I21 HydrophobicContact CG1-CD1 4.04Å; V17-I21 WeakPolarHBondContact O-CG1 3.34Å; V17-I21 PolarHBondContact O-N 3.25Å; L18-I21 PolarHBondContact O-N 3.09Å; I21-L23 VanDerWaalsContact C-N 3.28Å; I21-L23 PolarHBondContact O-N 2.91Å; I21-L24 PolarHBondContact O-N 3.49Å; I21-L24 VanDerWaalsContact O-N 3.16Å; I21-C25 PolarHBondContact O-N 3.35Å; I21-C25 PolarHBondContact O-SG 2.86Å; I21-C25 VanDerWaalsContact O-SG 3.32Å
22C96.1Very high94.4Very high53 Ų5359.3 Ų59.336%0.35835%0.35SS..Hα-helixtrans-59.5-38.2176.8-68.90000112.2L18 C25 S26 I65 S69L18-C22 WeakPolarHBondContact O-CB 3.41Å; L18-C22 PolarHBondContact O-N 3.19Å; L18-C22 PolarHBondContact O-SG 2.98Å; C22-C25 PolarHBondContact O-N 2.74Å; C22-S26 WeakPolarHBondContact O-CB 3.33Å; C22-S26 PolarHBondContact O-N 3.05Å; C22-I65 HydrophobicContact CB-CG2 4.14Å; C22-S69 VanDerWaalsContact CB-OG 3.31Å; C22-S69 WeakPolarHBondContact CB-OG 3.16Å
23L97.6Very high94.8Very high32 Ų3256.9 Ų56.917%0.16834%0.34CS..Hα-helixtrans-60.7-48.5174.6-173.3153.1000110.9N19 I20 I21 S26 L27 L66N19-L23 VanDerWaalsContact O-CB 3.24Å; N19-L23 WeakPolarHBondContact O-CB 3.34Å; N19-L23 PolarHBondContact O-N 2.95Å; I20-L23 WeakPolarHBondContact O-CB 3.39Å; I20-L23 PolarHBondContact O-N 3.47Å; I21-L23 VanDerWaalsContact C-N 3.28Å; I21-L23 PolarHBondContact O-N 2.91Å; L23-S26 PolarHBondContact O-N 3.02Å; L23-S26 PolarHBondContact O-OG 3.18Å; L23-L27 HydrophobicContact CD2-CD1 4.13Å; L23-L27 PolarHBondContact O-N 3.5Å; L23-L66 HydrophobicContact CG-CD1 4.06Å
24L97.6Very high95.1Very high103 Ų10355.3 Ų55.354%0.53933%0.331SS..Hα-helixtrans-63.9-43.7177.6-64.4179.4000112I20 I21 S26 L27 V28I20-L24 WeakPolarHBondContact O-CG 3.34Å; I20-L24 PolarHBondContact O-N 3.35Å; I21-L24 PolarHBondContact O-N 3.49Å; I21-L24 VanDerWaalsContact O-N 3.16Å; L24-S26 VanDerWaalsContact C-N 3.27Å; L24-S26 PolarHBondContact O-N 3.35Å; L24-L27 PolarHBondContact O-N 3.33Å; L24-V28 PolarHBondContact O-N 3.39Å
25C97.3Very high95.3Very high67 Ų6759.5 Ų59.545%0.45334%0.338SS..Hα-helixtrans-59-39.3174.9-680000111.9I21 C22 L27 V28 L29I21-C25 PolarHBondContact O-N 3.35Å; I21-C25 PolarHBondContact O-SG 2.86Å; I21-C25 VanDerWaalsContact O-SG 3.32Å; C22-C25 PolarHBondContact O-N 2.74Å; C25-L27 PolarHBondContact O-N 2.9Å; C25-V28 PolarHBondContact O-N 3.5Å; C25-L29 WeakPolarHBondContact O-CG 3.49Å; C25-L29 PolarHBondContact O-N 3.26Å
26S98.1Very high95.1Very high0 Ų061.1 Ų61.10%035%0.348CS..Hα-helixtrans-64.3-38.3179.874.40000112.9C22 L23 L24 V28 L29 I30 G62 L66C22-S26 WeakPolarHBondContact O-CB 3.33Å; C22-S26 PolarHBondContact O-N 3.05Å; L23-S26 PolarHBondContact O-N 3.02Å; L23-S26 PolarHBondContact O-OG 3.18Å; L24-S26 VanDerWaalsContact C-N 3.27Å; L24-S26 PolarHBondContact O-N 3.35Å; S26-V28 VanDerWaalsContact C-N 3.33Å; S26-V28 PolarHBondContact O-N 2.88Å; S26-L29 PolarHBondContact O-N 3.01Å; S26-I30 VanDerWaalsContact O-CG1 3.25Å; S26-I30 WeakPolarHBondContact O-CG1 3.25Å; S26-I30 PolarHBondContact O-N 3.42Å; S26-G62 WeakPolarHBondContact CB-O 3.39Å; S26-L66 WeakPolarHBondContact OG-CA 3.2Å; S26-L66 WeakPolarHBondContact OG-CB 3.29Å; S26-L66 WeakPolarHBondContact OG-CD1 3.35Å
27L98.2Very high94.8Very high89 Ų8959.7 Ų59.747%0.46634%0.342SS..Hα-helixtrans-64.7-38.8174.9-64.9175.2000111.6L23 L24 C25 G31 L66L23-L27 HydrophobicContact CD2-CD1 4.13Å; L23-L27 PolarHBondContact O-N 3.5Å; L24-L27 PolarHBondContact O-N 3.33Å; C25-L27 PolarHBondContact O-N 2.9Å; L27-G31 PolarHBondContact O-N 3.02Å; L27-L66 HydrophobicContact CD2-CD1 3.96Å; L27-L66 HydrophobicContact CD2-CD2 4.23Å; L27-L66 HydrophobicContact CG-CD1 4.37Å
28V97.9Very high94.4Very high103 Ų10360 Ų6062%0.62434%0.344SS*.Hα-helixtrans-64.9-44.6175.1176.30000111L24 C25 S26 G31 A32L24-V28 PolarHBondContact O-N 3.39Å; C25-V28 PolarHBondContact O-N 3.5Å; S26-V28 VanDerWaalsContact C-N 3.33Å; S26-V28 PolarHBondContact O-N 2.88Å; V28-G31 PolarHBondContact O-N 2.89Å; V28-A32 VanDerWaalsContact O-CB 3.3Å; V28-A32 WeakPolarHBondContact O-CB 3.4Å; V28-A32 PolarHBondContact O-N 3.43Å
29L97.1Very high93.8Very high67 Ų6759.5 Ų59.535%0.35134%0.338SS..Hα-helixtrans-61.1-47.1177.4-71.3173.8000112C25 S26 G31 A32 G33 I58 I65C25-L29 WeakPolarHBondContact O-CG 3.49Å; C25-L29 PolarHBondContact O-N 3.26Å; S26-L29 PolarHBondContact O-N 3.01Å; L29-G31 PolarHBondContact O-N 3.05Å; L29-A32 PolarHBondContact O-N 3.35Å; L29-G33 PolarHBondContact O-N 3Å; L29-I58 HydrophobicContact CB-CG2 4.25Å; L29-I58 HydrophobicContact CD2-CG2 4.26Å; L29-I58 WeakPolarHBondContact O-CG2 3.35Å; L29-I65 HydrophobicContact CD1-CD1 4.25Å
30I98Very high92.9Very high40 Ų4060 Ų6021%0.20534%0.34CS..Hα-helixtrans-61.6-46.3177.6-65.3164.4000110.2S26 G33 A34 V63 L66S26-I30 VanDerWaalsContact O-CG1 3.25Å; S26-I30 WeakPolarHBondContact O-CG1 3.25Å; S26-I30 PolarHBondContact O-N 3.42Å; I30-G33 PolarHBondContact O-N 3.45Å; I30-A34 VanDerWaalsContact O-CB 3.25Å; I30-A34 WeakPolarHBondContact O-CB 3.13Å; I30-A34 PolarHBondContact O-N 3.32Å; I30-V63 HydrophobicContact CD1-CG2 3.92Å; I30-V63 HydrophobicContact CG1-CG2 4.15Å; I30-L66 HydrophobicContact CD1-CB 4.3Å; I30-L66 HydrophobicContact CD1-CD2 3.86Å
31G97.1Very high91.9Very high41 Ų4160.3 Ų60.342%0.42335%0.347SS..Hα-helixtrans-61.8-44.5178.600000112.8L27 V28 L29 Y35L27-G31 PolarHBondContact O-N 3.02Å; V28-G31 PolarHBondContact O-N 2.89Å; L29-G31 PolarHBondContact O-N 3.05Å; G31-Y35 VanDerWaalsContact O-CB 3.29Å; G31-Y35 WeakPolarHBondContact O-CB 3.16Å; G31-Y35 PolarHBondContact O-N 3.45Å
32A93.5Very high90.7Very high51 Ų5162.3 Ų62.342%0.42136%0.355SS..Hα-helixtrans-65.4-46.4177.300000111.8V28 L29 Y35 V36V28-A32 VanDerWaalsContact O-CB 3.3Å; V28-A32 WeakPolarHBondContact O-CB 3.4Å; V28-A32 PolarHBondContact O-N 3.43Å; L29-A32 PolarHBondContact O-N 3.35Å; A32-Y35 PolarHBondContact O-N 3.48Å; A32-V36 VanDerWaalsContact O-CG2 3.3Å; A32-V36 WeakPolarHBondContact O-CG2 3.5Å; A32-V36 PolarHBondContact O-N 3.07Å
33G93.3Very high89.2Confident0 Ų064.6 Ų64.60%036%0.357CS..Hα-helixtrans-61.4-45.3177.100000112.2L29 I30 Y35 V36 E37L29-G33 PolarHBondContact O-N 3Å; I30-G33 PolarHBondContact O-N 3.45Å; G33-Y35 PolarHBondContact O-N 2.9Å; G33-V36 PolarHBondContact O-N 2.83Å; G33-E37 WeakPolarHBondContact O-CB 3.47Å; G33-E37 PolarHBondContact O-N 3.34Å
34A93.7Very high87.6Confident40 Ų4064.6 Ų64.633%0.33137%0.365SS..Hα-helixtrans-64.5-39.917700000112.4I30 E37 V38 I59I30-A34 VanDerWaalsContact O-CB 3.25Å; I30-A34 WeakPolarHBondContact O-CB 3.13Å; I30-A34 PolarHBondContact O-N 3.32Å; A34-E37 PolarHBondContact O-N 3.16Å; A34-V38 WeakPolarHBondContact O-CG2 3.37Å; A34-V38 PolarHBondContact O-N 2.99Å; A34-I59 HydrophobicContact CB-CD1 4.47Å
35Y91.4Very high86Confident159 Ų15966 Ų6662%0.62437%0.373SS*.Hα-helixtrans-59.4-46.9174.9175.6-95.2000111.6G31 A32 G33 K39G31-Y35 VanDerWaalsContact O-CB 3.29Å; G31-Y35 WeakPolarHBondContact O-CB 3.16Å; G31-Y35 PolarHBondContact O-N 3.45Å; A32-Y35 PolarHBondContact O-N 3.48Å; G33-Y35 PolarHBondContact O-N 2.9Å; Y35-K39 HydrophobicContact CE1-CG 4.4Å; Y35-K39 WeakPolarHBondContact O-CG 3.29Å; Y35-K39 PolarHBondContact O-N 3.26Å
36V85.2Confident84Confident55 Ų5568.2 Ų68.233%0.33338%0.38SS..Hα-helixtrans-64.6-47.2178177.10000110.1A32 G33 V38 K39 F40 P55A32-V36 VanDerWaalsContact O-CG2 3.3Å; A32-V36 WeakPolarHBondContact O-CG2 3.5Å; A32-V36 PolarHBondContact O-N 3.07Å; G33-V36 PolarHBondContact O-N 2.83Å; V36-V38 PolarHBondContact O-N 3.46Å; V36-K39 WeakPolarHBondContact O-CA 3.31Å; V36-K39 WeakPolarHBondContact O-CB 3.49Å; V36-K39 PolarHBondContact O-N 2.9Å; V36-F40 HydrophobicContact CG1-CD2 3.53Å; V36-F40 HydrophobicContact CG1-CE2 3.48Å; V36-F40 VanDerWaalsContact CG1-CE2 3.48Å; V36-F40 WeakPolarHBondContact O-CD2 3.45Å; V36-F40 PolarHBondContact O-N 3.5Å; V36-P55 HydrophobicContact CB-CB 4.31Å; V36-P55 HydrophobicContact CB-CG 4.25Å; V36-P55 HydrophobicContact CG1-CB 4.14Å; V36-P55 HydrophobicContact CG1-CG 3.54Å
37E85.4Confident81.8Confident32 Ų3269.7 Ų69.715%0.1539%0.388CS..Hα-helixtrans-58.6-45.4-178.5-172.469.6171.900113.2G33 A34 K39 F40 S41 H48 P55 I59G33-E37 WeakPolarHBondContact O-CB 3.47Å; G33-E37 PolarHBondContact O-N 3.34Å; A34-E37 PolarHBondContact O-N 3.16Å; E37-K39 PolarHBondContact O-N 3Å; E37-F40 PolarHBondContact O-N 3.4Å; E37-F40 VanDerWaalsContact O-N 3.12Å; E37-S41 PolarHBondContact O-N 3.09Å; E37-H48 IonicContact OE1-CE1 3.64Å; E37-H48 PolarHBondContact OE1-CE1 3.34Å; E37-H48 IonicContact OE1-NE2 2.99Å; E37-P55 HydrophobicContact CB-CB 4.2Å; E37-I59 HydrophobicContact CB-CD1 4.5Å
38V85.6Confident79.9Confident87 Ų8767.7 Ų67.753%0.52738%0.376SS..Hα-helixtrans-62.5-33.8176.9170.60000111.6A34 V36 S41A34-V38 WeakPolarHBondContact O-CG2 3.37Å; A34-V38 PolarHBondContact O-N 2.99Å; V36-V38 PolarHBondContact O-N 3.46Å; V38-S41 PolarHBondContact O-OG 2.97Å; V38-S41 VanDerWaalsContact O-OG 3.05Å
39K79.6Confident78.4Confident71 Ų7169.4 Ų69.431%0.30938%0.375SS..Hα-helixtrans-69-41.9174.1-74.5-69.9-173.6177.30111.4Y35 V36 E37 Y43 E130Y35-K39 HydrophobicContact CE1-CG 4.4Å; Y35-K39 WeakPolarHBondContact O-CG 3.29Å; Y35-K39 PolarHBondContact O-N 3.26Å; V36-K39 WeakPolarHBondContact O-CA 3.31Å; V36-K39 WeakPolarHBondContact O-CB 3.49Å; V36-K39 PolarHBondContact O-N 2.9Å; E37-K39 PolarHBondContact O-N 3Å; K39-Y43 VanDerWaalsContact O-CD2 3.24Å; K39-Y43 WeakPolarHBondContact O-CD2 3.13Å; K39-Y43 WeakPolarHBondContact O-CE2 3.45Å; K39-E130 HydrophobicContact CB-CG 4.33Å
40F76.2Confident76.6Confident21 Ų2169.7 Ų69.79%0.09238%0.379CS..Hα-helixtrans-67.8-34.5178.3-88.1-89.8000113.4V36 E37 Q42 Y43 W51 I131V36-F40 HydrophobicContact CG1-CD2 3.53Å; V36-F40 HydrophobicContact CG1-CE2 3.48Å; V36-F40 VanDerWaalsContact CG1-CE2 3.48Å; V36-F40 WeakPolarHBondContact O-CD2 3.45Å; V36-F40 PolarHBondContact O-N 3.5Å; E37-F40 PolarHBondContact O-N 3.4Å; E37-F40 VanDerWaalsContact O-N 3.12Å; F40-Q42 PolarHBondContact O-N 2.91Å; F40-Y43 PolarHBondContact O-N 3.4Å; F40-W51 HydrophobicContact CD1-CB 3.7Å; F40-W51 HydrophobicContact CD1-CG 4.45Å; F40-W51 HydrophobicContact CE1-CB 3.31Å; F40-W51 HydrophobicContact CE1-CD2 4.26Å; F40-W51 AromaticContact CE1-CG 3.69Å; F40-W51 HydrophobicContact CE1-CG 3.69Å; F40-W51 HydrophobicContact CZ-CB 4.04Å; F40-W51 HydrophobicContact CZ-CE3 4.45Å; F40-W51 HydrophobicContact CZ-CG 4.36Å; F40-I131 HydrophobicContact CE1-CD1 3.81Å; F40-I131 HydrophobicContact CE1-CG1 3.46Å; F40-I131 VanDerWaalsContact CE1-CG1 3.46Å; F40-I131 HydrophobicContact CZ-CG1 3.8Å
41S73.9Confident75.4Confident67 Ų6768.7 Ų68.747%0.46937%0.373SS..G310 helixtrans-65.3-18.6-17970.90000114E37 V38 Y43E37-S41 PolarHBondContact O-N 3.09Å; V38-S41 PolarHBondContact O-OG 2.97Å; V38-S41 VanDerWaalsContact O-OG 3.05Å; S41-Y43 VanDerWaalsContact C-N 3.32Å; S41-Y43 PolarHBondContact O-N 3.45Å
42Q73Confident74.4Confident131 Ų13169.3 Ų69.361%0.61237%0.365SS*.G310 helixtrans-78.2-11.7-178.1-68.5-177.9-13.600114.2F40F40-Q42 PolarHBondContact O-N 2.91Å
43Y64.6Low73.8Confident100 Ų10070 Ų7039%0.39237%0.371SS..G310 helixtrans-113.47.1-168.3-66.5-87.8000115.6K39 F40 S41 T128 E130K39-Y43 VanDerWaalsContact O-CD2 3.24Å; K39-Y43 WeakPolarHBondContact O-CD2 3.13Å; K39-Y43 WeakPolarHBondContact O-CE2 3.45Å; F40-Y43 PolarHBondContact O-N 3.4Å; S41-Y43 VanDerWaalsContact C-N 3.32Å; S41-Y43 PolarHBondContact O-N 3.45Å; Y43-T128 HydrophobicContact CD1-CG2 4.1Å; Y43-T128 HydrophobicContact CG-CG2 3.91Å; Y43-E130 WeakPolarHBondContact CE2-OE1 3.49Å; Y43-E130 WeakPolarHBondContact CE2-OE2 3.49Å; Y43-E130 VanDerWaalsContact CZ-OE1 3.31Å; Y43-E130 PolarHBondContact OH-OE1 2.87Å; Y43-E130 PolarHBondContact OH-OE2 3.24Å
44G62.1Low73.4Confident33 Ų3372.5 Ų72.534%0.3439%0.391SS..  trans114.9146.1164.500000116.4N46 L47 H48G44-N46 VanDerWaalsContact C-N 3.29Å; G44-N46 PolarHBondContact O-N 3.3Å; G44-N46 VanDerWaalsContact O-N 3.13Å; G44-L47 PolarHBondContact O-N 2.97Å; G44-L47 VanDerWaalsContact O-N 3.11Å; G44-H48 PolarHBondContact O-N 3.42Å; G44-H48 VanDerWaalsContact O-N 3.15Å
45D64.4Low73.1Confident133 Ų13370.9 Ų70.971%0.71138%0.378SS*.Hα-helixtrans-56.3-33.5-168.2-64-14.5000115.3
46N55.1Low73.1Confident112 Ų11266.6 Ų66.660%0.59937%0.365SS*.Hα-helixtrans-78.2-26.9-177.6-71.9-34.1000113.2G44G44-N46 VanDerWaalsContact C-N 3.29Å; G44-N46 PolarHBondContact O-N 3.3Å; G44-N46 VanDerWaalsContact O-N 3.13Å
47L52.8Low73.4Confident32 Ų3266.4 Ų66.417%0.16837%0.369CS..Hα-helixtrans-83.3-37.2175.3-84.376.6000111.1G44 K49 V50 W51 K126 T128 I131G44-L47 PolarHBondContact O-N 2.97Å; G44-L47 VanDerWaalsContact O-N 3.11Å; L47-K49 VanDerWaalsContact C-N 3.28Å; L47-K49 PolarHBondContact O-N 3.47Å; L47-V50 PolarHBondContact O-N 3.47Å; L47-W51 PolarHBondContact O-N 2.84Å; L47-K126 HydrophobicContact CD1-CB 3.91Å; L47-K126 HydrophobicContact CD1-CD 3.55Å; L47-K126 HydrophobicContact CD1-CG 4.29Å; L47-K126 HydrophobicContact CD2-CB 3.9Å; L47-K126 WeakPolarHBondContact CD2-O 3.32Å; L47-K126 HydrophobicContact CG-CB 3.8Å; L47-K126 HydrophobicContact CG-CD 4.08Å; L47-T128 HydrophobicContact CD2-CG2 3.32Å; L47-I131 HydrophobicContact CD2-CD1 4.19Å
48H58.6Low73.8Confident46 Ų4668.5 Ų68.521%0.21338%0.38CS..Hα-helixtrans-53.1-46.7176.7-171.867.1000110.7E37 G44 V50 W51 Q52E37-H48 IonicContact OE1-CE1 3.64Å; E37-H48 PolarHBondContact OE1-CE1 3.34Å; E37-H48 IonicContact OE1-NE2 2.99Å; G44-H48 PolarHBondContact O-N 3.42Å; G44-H48 VanDerWaalsContact O-N 3.15Å; H48-V50 VanDerWaalsContact C-N 3.34Å; H48-V50 PolarHBondContact O-N 3.49Å; H48-W51 PolarHBondContact O-N 3.32Å; H48-Q52 PolarHBondContact CD2-OE1 3.4Å; H48-Q52 PolarHBondContact NE2-OE1 3.16Å; H48-Q52 WeakPolarHBondContact O-CA 3.41Å; H48-Q52 WeakPolarHBondContact O-CB 3.45Å; H48-Q52 WeakPolarHBondContact O-CG 3.3Å; H48-Q52 PolarHBondContact O-N 3.44Å; H48-Q52 PolarHBondContact O-OE1 2.95Å
49K64.9Low74.4Confident140 Ų14066.4 Ų66.461%0.60937%0.365SS*.Hα-helixtrans-57.3-36.7-178.7-73.5179.2-177.2175.20115.8L47L47-K49 VanDerWaalsContact C-N 3.28Å; L47-K49 PolarHBondContact O-N 3.47Å
50V60.6Low75.2Confident72 Ų7266.6 Ų66.644%0.43637%0.372SS..Hα-helixtrans-79.3-37.2-176.3179.70000110.9L47 H48 L119L47-V50 PolarHBondContact O-N 3.47Å; H48-V50 VanDerWaalsContact C-N 3.34Å; H48-V50 PolarHBondContact O-N 3.49Å; V50-L119 HydrophobicContact CG1-CD1 3.9Å
51W71.6Confident76.1Confident19 Ų1969.2 Ų69.27%0.07239%0.39CS..Hα-helixtrans-102.7-19-172.3-73.291.4000115F40 L47 H48 A53 A54 P55 L119 A123 I131 F134F40-W51 HydrophobicContact CD1-CB 3.7Å; F40-W51 HydrophobicContact CD1-CG 4.45Å; F40-W51 HydrophobicContact CE1-CB 3.31Å; F40-W51 HydrophobicContact CE1-CD2 4.26Å; F40-W51 AromaticContact CE1-CG 3.69Å; F40-W51 HydrophobicContact CE1-CG 3.69Å; F40-W51 HydrophobicContact CZ-CB 4.04Å; F40-W51 HydrophobicContact CZ-CE3 4.45Å; F40-W51 HydrophobicContact CZ-CG 4.36Å; L47-W51 PolarHBondContact O-N 2.84Å; H48-W51 PolarHBondContact O-N 3.32Å; W51-A53 PolarHBondContact O-N 3.33Å; W51-A53 VanDerWaalsContact O-N 3.11Å; W51-A54 PolarHBondContact O-N 2.84Å; W51-P55 WeakPolarHBondContact O-CD 3.35Å; W51-L119 HydrophobicContact CD2-CD1 3.81Å; W51-L119 HydrophobicContact CE3-CD1 3.93Å; W51-L119 HydrophobicContact CG-CD1 4.43Å; W51-L119 HydrophobicContact CH2-CD1 3.9Å; W51-L119 HydrophobicContact CH2-CD2 4.45Å; W51-L119 HydrophobicContact CH2-CG 3.81Å; W51-L119 HydrophobicContact CZ2-CD1 3.73Å; W51-L119 HydrophobicContact CZ2-CG 3.97Å; W51-L119 WeakPolarHBondContact CZ2-O 3.1Å; W51-L119 HydrophobicContact CZ3-CD1 4Å; W51-L119 HydrophobicContact CZ3-CD2 4.38Å; W51-L119 HydrophobicContact CZ3-CG 4.12Å; W51-A123 HydrophobicContact CH2-CB 3.92Å; W51-A123 HydrophobicContact CZ2-CB 3.22Å; W51-I131 HydrophobicContact CG-CD1 4.35Å; W51-F134 HydrophobicContact CZ3-CD1 4.21Å; W51-F134 HydrophobicContact CZ3-CE1 4.06Å
52Q76.5Confident77.3Confident54 Ų5466 Ų6625%0.25237%0.368SS..THydrogen-bonded Turntrans-58.7-24.4177.468.6-171.828.700112.4H48 A54 P55 I56H48-Q52 PolarHBondContact CD2-OE1 3.4Å; H48-Q52 PolarHBondContact NE2-OE1 3.16Å; H48-Q52 WeakPolarHBondContact O-CA 3.41Å; H48-Q52 WeakPolarHBondContact O-CB 3.45Å; H48-Q52 WeakPolarHBondContact O-CG 3.3Å; H48-Q52 PolarHBondContact O-N 3.44Å; H48-Q52 PolarHBondContact O-OE1 2.95Å; Q52-A54 VanDerWaalsContact C-N 3.29Å; Q52-A54 PolarHBondContact O-N 2.96Å; Q52-P55 WeakPolarHBondContact O-CD 3.25Å; Q52-I56 HydrophobicContact CB-CD1 3.78Å; Q52-I56 HydrophobicContact CB-CG1 4.48Å; Q52-I56 HydrophobicContact CG-CD1 3.97Å; Q52-I56 WeakPolarHBondContact O-CB 3.4Å; Q52-I56 WeakPolarHBondContact O-CD1 3.46Å; Q52-I56 WeakPolarHBondContact O-CG1 3.24Å; Q52-I56 PolarHBondContact O-N 2.91Å
53A81.6Confident78.5Confident67 Ų6762.6 Ų62.655%0.55436%0.356SS*.Hα-helixtrans-59.4-40.3-176.300000112.1W51 A57W51-A53 PolarHBondContact O-N 3.33Å; W51-A53 VanDerWaalsContact O-N 3.11Å; A53-A57 WeakPolarHBondContact O-CB 3.33Å; A53-A57 PolarHBondContact O-N 3.38Å
54A84.1Confident80.1Confident51 Ų5161.1 Ų61.142%0.42135%0.354SS..Hα-helixtrans-74.2-51.5-177.400000113.2W51 Q52 I56 A57 I58W51-A54 PolarHBondContact O-N 2.84Å; Q52-A54 VanDerWaalsContact C-N 3.29Å; Q52-A54 PolarHBondContact O-N 2.96Å; A54-I56 PolarHBondContact O-N 2.82Å; A54-A57 PolarHBondContact O-N 3.15Å; A54-I58 WeakPolarHBondContact O-CG1 3.31Å; A54-I58 PolarHBondContact O-N 2.89Å
55P88.9Confident81.8Confident7 Ų762.1 Ų62.15%0.04535%0.351CS..Hα-helixtrans-61-42.2175.7-22.934.1000112.6V36 E37 W51 Q52 A57 I58 I59V36-P55 HydrophobicContact CB-CB 4.31Å; V36-P55 HydrophobicContact CB-CG 4.25Å; V36-P55 HydrophobicContact CG1-CB 4.14Å; V36-P55 HydrophobicContact CG1-CG 3.54Å; E37-P55 HydrophobicContact CB-CB 4.2Å; W51-P55 WeakPolarHBondContact O-CD 3.35Å; Q52-P55 WeakPolarHBondContact O-CD 3.25Å; P55-A57 VanDerWaalsContact C-N 3.34Å; P55-A57 PolarHBondContact O-N 3.41Å; P55-I58 PolarHBondContact O-N 3.37Å; P55-I59 VanDerWaalsContact O-CG1 3.31Å; P55-I59 WeakPolarHBondContact O-CG1 3.28Å; P55-I59 PolarHBondContact O-N 2.84Å
56I91.1Very high83.4Confident69 Ų6958.1 Ų58.135%0.35433%0.329SS..Hα-helixtrans-60.7-44.6175.6-66.5171.4000110.4Q52 A54 I58 I59 V60Q52-I56 HydrophobicContact CB-CD1 3.78Å; Q52-I56 HydrophobicContact CB-CG1 4.48Å; Q52-I56 HydrophobicContact CG-CD1 3.97Å; Q52-I56 WeakPolarHBondContact O-CB 3.4Å; Q52-I56 WeakPolarHBondContact O-CD1 3.46Å; Q52-I56 WeakPolarHBondContact O-CG1 3.24Å; Q52-I56 PolarHBondContact O-N 2.91Å; A54-I56 PolarHBondContact O-N 2.82Å; I56-I58 VanDerWaalsContact C-N 3.34Å; I56-I58 PolarHBondContact O-N 3.13Å; I56-I59 PolarHBondContact O-N 2.78Å; I56-V60 HydrophobicContact CG2-CG2 4.2Å; I56-V60 VanDerWaalsContact O-CG2 3.3Å; I56-V60 WeakPolarHBondContact O-CG2 3.49Å; I56-V60 PolarHBondContact O-N 3.14Å
57A91.8Very high85.4Confident51 Ų5156.9 Ų56.942%0.42132%0.322SS..Hα-helixtrans-59.9-42.8176.600000112.1A53 A54 P55 I59 V60 V61A53-A57 WeakPolarHBondContact O-CB 3.33Å; A53-A57 PolarHBondContact O-N 3.38Å; A54-A57 PolarHBondContact O-N 3.15Å; P55-A57 VanDerWaalsContact C-N 3.34Å; P55-A57 PolarHBondContact O-N 3.41Å; A57-I59 PolarHBondContact O-N 3.33Å; A57-V60 PolarHBondContact O-N 2.89Å; A57-V61 WeakPolarHBondContact O-CB 3.37Å; A57-V61 VanDerWaalsContact O-CG2 3.3Å; A57-V61 WeakPolarHBondContact O-CG2 3.39Å; A57-V61 PolarHBondContact O-N 3.47Å
58I93.7Very high87.6Confident76 Ų7655.8 Ų55.839%0.3932%0.316SS..Hα-helixtrans-60.3-44.6175.7-67.6167.4000110.9L29 A54 P55 I56 G62L29-I58 HydrophobicContact CB-CG2 4.25Å; L29-I58 HydrophobicContact CD2-CG2 4.26Å; L29-I58 WeakPolarHBondContact O-CG2 3.35Å; A54-I58 WeakPolarHBondContact O-CG1 3.31Å; A54-I58 PolarHBondContact O-N 2.89Å; P55-I58 PolarHBondContact O-N 3.37Å; I56-I58 VanDerWaalsContact C-N 3.34Å; I56-I58 PolarHBondContact O-N 3.13Å; I58-G62 PolarHBondContact O-N 3.42Å
59I96.6Very high89.4Confident42 Ų4253.7 Ų53.722%0.21531%0.307CS..Hα-helixtrans-62.6-48.3177.6-65.4166.1000110.4A34 E37 P55 I56 A57 V61 G62 V63A34-I59 HydrophobicContact CB-CD1 4.47Å; E37-I59 HydrophobicContact CB-CD1 4.5Å; P55-I59 VanDerWaalsContact O-CG1 3.31Å; P55-I59 WeakPolarHBondContact O-CG1 3.28Å; P55-I59 PolarHBondContact O-N 2.84Å; I56-I59 PolarHBondContact O-N 2.78Å; A57-I59 PolarHBondContact O-N 3.33Å; I59-V61 PolarHBondContact O-N 3.3Å; I59-G62 PolarHBondContact O-N 3.31Å; I59-V63 HydrophobicContact CG2-CG2 4.31Å; I59-V63 WeakPolarHBondContact O-CG2 3.44Å; I59-V63 PolarHBondContact O-N 3.4Å
60V96.7Very high90.9Very high75 Ų7552.1 Ų52.146%0.45530%0.3SS..Hα-helixtrans-60.1-48-179.2170.10000110.8I56 A57 G62 V63 I64I56-V60 HydrophobicContact CG2-CG2 4.2Å; I56-V60 VanDerWaalsContact O-CG2 3.3Å; I56-V60 WeakPolarHBondContact O-CG2 3.49Å; I56-V60 PolarHBondContact O-N 3.14Å; A57-V60 PolarHBondContact O-N 2.89Å; V60-G62 VanDerWaalsContact C-N 3.34Å; V60-G62 PolarHBondContact O-N 2.92Å; V60-V63 PolarHBondContact O-N 2.96Å; V60-I64 HydrophobicContact CG1-CD1 3.91Å; V60-I64 VanDerWaalsContact O-CG1 3.31Å; V60-I64 WeakPolarHBondContact O-CG1 3.38Å; V60-I64 PolarHBondContact O-N 3.49Å
61V96.3Very high92.6Very high76 Ų7649.9 Ų49.946%0.46129%0.286SS..Hα-helixtrans-60-45.7175.9170.80000110.6A57 I59 V63 I64 I65A57-V61 WeakPolarHBondContact O-CB 3.37Å; A57-V61 VanDerWaalsContact O-CG2 3.3Å; A57-V61 WeakPolarHBondContact O-CG2 3.39Å; A57-V61 PolarHBondContact O-N 3.47Å; I59-V61 PolarHBondContact O-N 3.3Å; V61-V63 PolarHBondContact O-N 3.02Å; V61-I64 PolarHBondContact O-N 3.27Å; V61-I65 HydrophobicContact CG1-CD1 3.71Å; V61-I65 HydrophobicContact CG1-CG1 4.41Å; V61-I65 VanDerWaalsContact O-CG1 3.29Å; V61-I65 WeakPolarHBondContact O-CG1 3.43Å; V61-I65 PolarHBondContact O-N 2.87Å
62G98.3Very high93.8Very high0 Ų049.1 Ų49.10%028%0.283CS..Hα-helixtrans-58-45.8176.300000112.8S26 I58 I59 V60 I64 I65 L66S26-G62 WeakPolarHBondContact CB-O 3.39Å; I58-G62 PolarHBondContact O-N 3.42Å; I59-G62 PolarHBondContact O-N 3.31Å; V60-G62 VanDerWaalsContact C-N 3.34Å; V60-G62 PolarHBondContact O-N 2.92Å; G62-I64 PolarHBondContact O-N 3.31Å; G62-I65 PolarHBondContact O-N 2.91Å; G62-L66 WeakPolarHBondContact O-CB 3.27Å; G62-L66 PolarHBondContact O-N 3.49Å
63V98.4Very high94.7Very high59 Ų5947 Ų4736%0.35828%0.275SS..Hα-helixtrans-62.8-42.5177.81700000111.6I30 I59 V60 V61 L66 I67I30-V63 HydrophobicContact CD1-CG2 3.92Å; I30-V63 HydrophobicContact CG1-CG2 4.15Å; I59-V63 HydrophobicContact CG2-CG2 4.31Å; I59-V63 WeakPolarHBondContact O-CG2 3.44Å; I59-V63 PolarHBondContact O-N 3.4Å; V60-V63 PolarHBondContact O-N 2.96Å; V61-V63 PolarHBondContact O-N 3.02Å; V63-L66 WeakPolarHBondContact O-CB 3.33Å; V63-L66 PolarHBondContact O-N 2.99Å; V63-I67 HydrophobicContact CG1-CD1 3.92Å; V63-I67 WeakPolarHBondContact O-CG1 3.31Å; V63-I67 PolarHBondContact O-N 3.37Å
64I97.9Very high95.3Very high69 Ų6944.6 Ų44.635%0.35425%0.254SS..Hα-helixtrans-62.4-47.2177.5-65.6163.8000110.4V60 V61 G62 L66 I67 V68 L94V60-I64 HydrophobicContact CG1-CD1 3.91Å; V60-I64 VanDerWaalsContact O-CG1 3.31Å; V60-I64 WeakPolarHBondContact O-CG1 3.38Å; V60-I64 PolarHBondContact O-N 3.49Å; V61-I64 PolarHBondContact O-N 3.27Å; G62-I64 PolarHBondContact O-N 3.31Å; I64-L66 VanDerWaalsContact C-N 3.3Å; I64-L66 PolarHBondContact O-N 3.17Å; I64-I67 PolarHBondContact O-N 2.82Å; I64-V68 HydrophobicContact CG2-CG2 4.46Å; I64-V68 WeakPolarHBondContact O-CG2 3.31Å; I64-V68 PolarHBondContact O-N 3.5Å; I64-L94 HydrophobicContact CG2-CD1 4.19Å; I64-L94 HydrophobicContact CG2-CD2 3.87Å; I64-L94 HydrophobicContact CG2-CG 4.41Å
65I97.8Very high95.8Very high54 Ų5442.2 Ų42.228%0.27723%0.234SC..Hα-helixtrans-61.3-40.5177.4-63.8167.3000110.7C22 L29 V61 G62 V68 S69C22-I65 HydrophobicContact CB-CG2 4.14Å; L29-I65 HydrophobicContact CD1-CD1 4.25Å; V61-I65 HydrophobicContact CG1-CD1 3.71Å; V61-I65 HydrophobicContact CG1-CG1 4.41Å; V61-I65 VanDerWaalsContact O-CG1 3.29Å; V61-I65 WeakPolarHBondContact O-CG1 3.43Å; V61-I65 PolarHBondContact O-N 2.87Å; G62-I65 PolarHBondContact O-N 2.91Å; I65-V68 PolarHBondContact O-N 2.95Å; I65-S69 WeakPolarHBondContact O-CB 3.44Å; I65-S69 PolarHBondContact O-N 3.3Å; I65-S69 PolarHBondContact O-OG 3.03Å
66L98.2Very high95.9Very high50 Ų5042.5 Ų42.526%0.26224%0.237SC..Hα-helixtrans-60.2-49.4178.1179.463000111.5L23 S26 L27 I30 G62 V63 I64 S69 F70L23-L66 HydrophobicContact CG-CD1 4.06Å; S26-L66 WeakPolarHBondContact OG-CA 3.2Å; S26-L66 WeakPolarHBondContact OG-CB 3.29Å; S26-L66 WeakPolarHBondContact OG-CD1 3.35Å; L27-L66 HydrophobicContact CD2-CD1 3.96Å; L27-L66 HydrophobicContact CD2-CD2 4.23Å; L27-L66 HydrophobicContact CG-CD1 4.37Å; I30-L66 HydrophobicContact CD1-CB 4.3Å; I30-L66 HydrophobicContact CD1-CD2 3.86Å; G62-L66 WeakPolarHBondContact O-CB 3.27Å; G62-L66 PolarHBondContact O-N 3.49Å; V63-L66 WeakPolarHBondContact O-CB 3.33Å; V63-L66 PolarHBondContact O-N 2.99Å; I64-L66 VanDerWaalsContact C-N 3.3Å; I64-L66 PolarHBondContact O-N 3.17Å; L66-S69 PolarHBondContact O-N 3.48Å; L66-F70 WeakPolarHBondContact O-CB 3.46Å; L66-F70 PolarHBondContact O-N 3.44Å
67I97.7Very high95.9Very high85 Ų8544.3 Ų44.344%0.43625%0.246SC..Hα-helixtrans-61.9-49.3179.8-67.1167.3000110.4V63 I64 F70 L71V63-I67 HydrophobicContact CG1-CD1 3.92Å; V63-I67 WeakPolarHBondContact O-CG1 3.31Å; V63-I67 PolarHBondContact O-N 3.37Å; I64-I67 PolarHBondContact O-N 2.82Å; I67-F70 PolarHBondContact O-N 3.4Å; I67-L71 HydrophobicContact CG2-CD1 4.07Å; I67-L71 VanDerWaalsContact O-CG 3.32Å; I67-L71 WeakPolarHBondContact O-CG 3.48Å; I67-L71 PolarHBondContact O-N 3.34Å
68V97.8Very high95.9Very high9 Ų948.8 Ų48.86%0.05526%0.256CS..Hα-helixtrans-62.2-46.6-179.4170.90000110.9I64 I65 F70 L71 G72 Y87 F90 L91 L94I64-V68 HydrophobicContact CG2-CG2 4.46Å; I64-V68 WeakPolarHBondContact O-CG2 3.31Å; I64-V68 PolarHBondContact O-N 3.5Å; I65-V68 PolarHBondContact O-N 2.95Å; V68-F70 VanDerWaalsContact C-N 3.34Å; V68-F70 PolarHBondContact O-N 2.9Å; V68-L71 PolarHBondContact O-N 2.85Å; V68-G72 PolarHBondContact O-N 3.02Å; V68-Y87 HydrophobicContact CG1-CD2 3.74Å; V68-Y87 HydrophobicContact CG1-CE2 3.6Å; V68-Y87 WeakPolarHBondContact O-CD2 3.45Å; V68-F90 HydrophobicContact CG2-CB 3.74Å; V68-F90 HydrophobicContact CG2-CG 4.41Å; V68-L91 HydrophobicContact CG1-CD2 3.72Å; V68-L91 HydrophobicContact CG1-CG 4.27Å; V68-L94 HydrophobicContact CG2-CD1 4.06Å
69S97.5Very high95.8Very high3 Ų350.1 Ų50.12%0.02126%0.26CS..Hα-helixtrans-65.4-37.7-180-56.40000112N19 C22 I65 L66 G72 C73N19-S69 WeakPolarHBondContact O-CB 3.37Å; C22-S69 VanDerWaalsContact CB-OG 3.31Å; C22-S69 WeakPolarHBondContact CB-OG 3.16Å; I65-S69 WeakPolarHBondContact O-CB 3.44Å; I65-S69 PolarHBondContact O-N 3.3Å; I65-S69 PolarHBondContact O-OG 3.03Å; L66-S69 PolarHBondContact O-N 3.48Å; S69-G72 PolarHBondContact O-N 3.36Å; S69-C73 WeakPolarHBondContact O-CB 3.25Å; S69-C73 PolarHBondContact O-N 2.86Å
70F96.2Very high95.7Very high107 Ų10751.2 Ų51.247%0.46927%0.267SS..Hα-helixtrans-63.7-45.3174.9177.9-98.1000111.9L66 I67 V68 C74 M83L66-F70 WeakPolarHBondContact O-CB 3.46Å; L66-F70 PolarHBondContact O-N 3.44Å; I67-F70 PolarHBondContact O-N 3.4Å; V68-F70 VanDerWaalsContact C-N 3.34Å; V68-F70 PolarHBondContact O-N 2.9Å; F70-C74 WeakPolarHBondContact CE2-SG 3.36Å; F70-C74 WeakPolarHBondContact CZ-SG 3.48Å; F70-C74 VanDerWaalsContact O-CB 3.25Å; F70-C74 WeakPolarHBondContact O-CB 3.42Å; F70-C74 PolarHBondContact O-N 2.92Å; F70-C74 PolarHBondContact O-SG 3.49Å; F70-M83 HydrophobicContact CE1-CE 4.12Å
71L96.7Very high95.6Very high25 Ų2548.5 Ų48.513%0.13125%0.25CS..Hα-helixtrans-63.2-44.5176.7-69.8172.4000111.7I67 V68 G75 M83 M86 F90I67-L71 HydrophobicContact CG2-CD1 4.07Å; I67-L71 VanDerWaalsContact O-CG 3.32Å; I67-L71 WeakPolarHBondContact O-CG 3.48Å; I67-L71 PolarHBondContact O-N 3.34Å; V68-L71 PolarHBondContact O-N 2.85Å; L71-G75 WeakPolarHBondContact O-CA 3.48Å; L71-G75 PolarHBondContact O-N 2.84Å; L71-M83 HydrophobicContact CD2-CE 3.88Å; L71-M86 HydrophobicContact CD1-CB 4.24Å; L71-F90 HydrophobicContact CD1-CD2 3.53Å; L71-F90 HydrophobicContact CD1-CE2 3.59Å
72G95.7Very high95.6Very high2 Ų249 Ų492%0.02126%0.257CS..Hα-helixtrans-62.4-46.8177.300000112.4V68 S69 A76V68-G72 PolarHBondContact O-N 3.02Å; S69-G72 PolarHBondContact O-N 3.36Å; G72-A76 VanDerWaalsContact O-CB 3.27Å; G72-A76 WeakPolarHBondContact O-CB 3.37Å; G72-A76 PolarHBondContact O-N 3.21Å; G72-A76 VanDerWaalsContact O-N 3.07Å
73C95Very high95.5Very high11 Ų1150.8 Ų50.87%0.07427%0.265CS..Hα-helixtrans-63.3-55.6177.2175.50000112.3F16 I20 S69 G75 A76 I77F16-C73 HydrophobicContact CE2-CB 4.4Å; F16-C73 VanDerWaalsContact CE2-SG 3.52Å; I20-C73 HydrophobicContact CD1-CB 4.42Å; I20-C73 WeakPolarHBondContact CD1-SG 3.22Å; S69-C73 WeakPolarHBondContact O-CB 3.25Å; S69-C73 PolarHBondContact O-N 2.86Å; C73-G75 PolarHBondContact O-N 3.35Å; C73-A76 PolarHBondContact O-N 3.42Å; C73-I77 WeakPolarHBondContact O-CG1 3.39Å; C73-I77 PolarHBondContact O-N 2.84Å
74C94.8Very high95.3Very high16 Ų1648.2 Ų48.211%0.10825%0.249CC..Hα-helixtrans-65.2-39.4-178.7-73.70000112.3F70 A76 K78 M83F70-C74 WeakPolarHBondContact CE2-SG 3.36Å; F70-C74 WeakPolarHBondContact CZ-SG 3.48Å; F70-C74 VanDerWaalsContact O-CB 3.25Å; F70-C74 WeakPolarHBondContact O-CB 3.42Å; F70-C74 PolarHBondContact O-N 2.92Å; F70-C74 PolarHBondContact O-SG 3.49Å; C74-A76 VanDerWaalsContact C-N 3.32Å; C74-A76 PolarHBondContact O-N 3.45Å; C74-K78 VanDerWaalsContact O-CB 3.25Å; C74-K78 WeakPolarHBondContact O-CB 3.32Å; C74-K78 WeakPolarHBondContact O-CG 3.5Å; C74-K78 PolarHBondContact O-N 2.91Å; C74-M83 HydrophobicContact CB-CE 3.64Å; C74-M83 HydrophobicContact CB-SD 4.02Å
75G93.9Very high95.3Very high0 Ų048.7 Ų48.70%025%0.247CC..Hα-helixtrans-61-40.8175.500000112.1L71 C73 E79 N80L71-G75 WeakPolarHBondContact O-CA 3.48Å; L71-G75 PolarHBondContact O-N 2.84Å; C73-G75 PolarHBondContact O-N 3.35Å; G75-E79 WeakPolarHBondContact O-CA 3.29Å; G75-E79 PolarHBondContact O-N 3.37Å; G75-E79 VanDerWaalsContact O-N 3.16Å; G75-N80 PolarHBondContact O-N 3.06Å
76A91.7Very high95.3Very high13 Ų1349.8 Ų49.811%0.10725%0.252CS..Hα-helixtrans-72.5-39.8178.400000113.9K12 F16 G72 C73 C74K12-A76 WeakPolarHBondContact CE-O 3.29Å; K12-A76 PolarHBondContact NZ-O 3.36Å; F16-A76 HydrophobicContact CD2-CB 4.27Å; G72-A76 VanDerWaalsContact O-CB 3.27Å; G72-A76 WeakPolarHBondContact O-CB 3.37Å; G72-A76 PolarHBondContact O-N 3.21Å; G72-A76 VanDerWaalsContact O-N 3.07Å; C73-A76 PolarHBondContact O-N 3.42Å; C74-A76 VanDerWaalsContact C-N 3.32Å; C74-A76 PolarHBondContact O-N 3.45Å
77I91.5Very high95.3Very high107 Ų10747.7 Ų47.755%0.54924%0.241SC..Hα-helixtrans-72.2-50.9178.7-66170.2000111F16 C73 E79F16-I77 HydrophobicContact CD2-CG1 4.21Å; F16-I77 HydrophobicContact CE2-CD1 3.48Å; F16-I77 VanDerWaalsContact CE2-CD1 3.48Å; F16-I77 HydrophobicContact CE2-CG1 3.36Å; F16-I77 HydrophobicContact CZ-CD1 3.69Å; F16-I77 HydrophobicContact CZ-CG1 3.82Å; C73-I77 WeakPolarHBondContact O-CG1 3.39Å; C73-I77 PolarHBondContact O-N 2.84Å; I77-E79 PolarHBondContact O-N 2.89Å
78K92.2Very high95.3Very high146 Ų14644 Ų4464%0.63522%0.222SC*.THydrogen-bonded Turntrans-80.6-2.5-174.6-61.9-176.4177-179.30112.7C74 N80C74-K78 VanDerWaalsContact O-CB 3.25Å; C74-K78 WeakPolarHBondContact O-CB 3.32Å; C74-K78 WeakPolarHBondContact O-CG 3.5Å; C74-K78 PolarHBondContact O-N 2.91Å; K78-N80 HydrophobicContact CB-CB 4.27Å; K78-N80 PolarHBondContact O-N 3.18Å; K78-N80 VanDerWaalsContact O-N 3.09Å
79E90.4Very high95.3Very high103 Ų10349 Ų4948%0.48124%0.244SC..THydrogen-bonded Turntrans49.236.5-172.9-54.9-163.2149.200111.4K12 G75 I77 V81 I212K12-E79 IonicContact NZ-OE1 3.43Å; K12-E79 PolarHBondContact NZ-OE1 3.26Å; G75-E79 WeakPolarHBondContact O-CA 3.29Å; G75-E79 PolarHBondContact O-N 3.37Å; G75-E79 VanDerWaalsContact O-N 3.16Å; I77-E79 PolarHBondContact O-N 2.89Å; E79-V81 PolarHBondContact O-N 3.46Å; E79-I212 HydrophobicContact CB-CD1 3.86Å; E79-I212 HydrophobicContact CB-CG1 4.39Å; E79-I212 HydrophobicContact CG-CD1 4.47Å; E79-I212 WeakPolarHBondContact O-CG2 3.46Å
80N94.4Very high95.3Very high66 Ų6652.1 Ų52.135%0.35326%0.257SS..  trans-87.6104.8-177.7-175.6-33.1000109.8G75 K78 C82 M83 L84G75-N80 PolarHBondContact O-N 3.06Å; K78-N80 HydrophobicContact CB-CB 4.27Å; K78-N80 PolarHBondContact O-N 3.18Å; K78-N80 VanDerWaalsContact O-N 3.09Å; N80-C82 VanDerWaalsContact C-N 3.28Å; N80-C82 PolarHBondContact O-N 3.41Å; N80-C82 WeakPolarHBondContact OD1-CB 3.34Å; N80-C82 PolarHBondContact OD1-N 2.89Å; N80-M83 HydrophobicContact CB-CB 4.2Å; N80-M83 HydrophobicContact CB-CG 4.09Å; N80-M83 HydrophobicContact CB-SD 4.24Å; N80-M83 PolarHBondContact O-N 3.34Å; N80-M83 PolarHBondContact OD1-N 3.38Å; N80-L84 PolarHBondContact O-N 3.17Å; N80-L84 VanDerWaalsContact O-N 3.08Å
81V95.5Very high95.4Very high18 Ų1847.5 Ų47.511%0.10924%0.237CC..Hα-helixtrans-53.8-42.8-178.7178.30000112.4E79 L84 Y85 I212 K213E79-V81 PolarHBondContact O-N 3.46Å; V81-L84 PolarHBondContact O-N 3.3Å; V81-Y85 HydrophobicContact CG1-CD2 3.6Å; V81-Y85 HydrophobicContact CG1-CE2 3.16Å; V81-Y85 VanDerWaalsContact O-CD2 3.29Å; V81-Y85 WeakPolarHBondContact O-CD2 3.41Å; V81-Y85 PolarHBondContact O-N 3.3Å; V81-I212 HydrophobicContact CG2-CB 3.68Å; V81-I212 HydrophobicContact CG2-CG2 3.41Å; V81-I212 VanDerWaalsContact CG2-CG2 3.41Å; V81-K213 HydrophobicContact CG1-CB 4.41Å; V81-K213 HydrophobicContact CG2-CB 4.39Å
82C96.1Very high95.5Very high87 Ų8749.2 Ų49.259%0.58825%0.249SC*.Hα-helixtrans-64.5-45.9-179.4-175.50000111.4N80 L84 Y85 M86N80-C82 VanDerWaalsContact C-N 3.28Å; N80-C82 PolarHBondContact O-N 3.41Å; N80-C82 WeakPolarHBondContact OD1-CB 3.34Å; N80-C82 PolarHBondContact OD1-N 2.89Å; C82-L84 VanDerWaalsContact C-N 3.28Å; C82-L84 PolarHBondContact O-N 2.93Å; C82-Y85 PolarHBondContact O-N 3.42Å; C82-M86 WeakPolarHBondContact O-CG 3.34Å; C82-M86 PolarHBondContact O-N 3.21Å
83M96Very high95.6Very high36 Ų3652.4 Ų52.418%0.17727%0.268CS..Hα-helixtrans-62.4-37177.1-66.7-172.689.500112F70 L71 C74 N80 M86 Y87F70-M83 HydrophobicContact CE1-CE 4.12Å; L71-M83 HydrophobicContact CD2-CE 3.88Å; C74-M83 HydrophobicContact CB-CE 3.64Å; C74-M83 HydrophobicContact CB-SD 4.02Å; N80-M83 HydrophobicContact CB-CB 4.2Å; N80-M83 HydrophobicContact CB-CG 4.09Å; N80-M83 HydrophobicContact CB-SD 4.24Å; N80-M83 PolarHBondContact O-N 3.34Å; N80-M83 PolarHBondContact OD1-N 3.38Å; M83-M86 PolarHBondContact O-N 2.95Å; M83-Y87 WeakPolarHBondContact O-CB 3.47Å; M83-Y87 PolarHBondContact O-N 3.45Å
84L95.5Very high95.7Very high6 Ų653.9 Ų53.93%0.03128%0.275CS..Hα-helixtrans-70.3-37.3179.7-16761.3000112.6N80 V81 C82 Y87 A88 A205 L208N80-L84 PolarHBondContact O-N 3.17Å; N80-L84 VanDerWaalsContact O-N 3.08Å; V81-L84 PolarHBondContact O-N 3.3Å; C82-L84 VanDerWaalsContact C-N 3.28Å; C82-L84 PolarHBondContact O-N 2.93Å; L84-Y87 HydrophobicContact CD1-CD1 4.23Å; L84-Y87 WeakPolarHBondContact O-CB 3.26Å; L84-Y87 PolarHBondContact O-N 2.69Å; L84-A88 PolarHBondContact O-N 2.87Å; L84-A205 HydrophobicContact CD1-CB 3.66Å; L84-A205 WeakPolarHBondContact CD2-O 3.11Å; L84-A205 HydrophobicContact CG-CB 3.88Å; L84-A205 WeakPolarHBondContact CG-O 3.26Å; L84-L208 HydrophobicContact CD2-CB 3.65Å
85Y97.1Very high95.9Very high79 Ų7954.4 Ų54.431%0.3128%0.276SS..Hα-helixtrans-69.6-35.7171.3-70.8-44.5000112.6V81 C82 A88 F89 R210V81-Y85 HydrophobicContact CG1-CD2 3.6Å; V81-Y85 HydrophobicContact CG1-CE2 3.16Å; V81-Y85 VanDerWaalsContact O-CD2 3.29Å; V81-Y85 WeakPolarHBondContact O-CD2 3.41Å; V81-Y85 PolarHBondContact O-N 3.3Å; C82-Y85 PolarHBondContact O-N 3.42Å; Y85-A88 PolarHBondContact O-N 3.47Å; Y85-F89 WeakPolarHBondContact O-CB 3.48Å; Y85-F89 PolarHBondContact O-N 3.06Å; Y85-R210 PolarHBondContact OH-N 2.93Å
86M97.7Very high96.1Very high77 Ų7759.5 Ų59.538%0.37930%0.302SS..Hα-helixtrans-63.2-42.3171.9-72-59.2-60.400111.6L71 C82 M83 F89 F90L71-M86 HydrophobicContact CD1-CB 4.24Å; C82-M86 WeakPolarHBondContact O-CG 3.34Å; C82-M86 PolarHBondContact O-N 3.21Å; M83-M86 PolarHBondContact O-N 2.95Å; M86-F89 PolarHBondContact O-N 2.94Å; M86-F90 HydrophobicContact CE-CD2 4.46Å; M86-F90 HydrophobicContact CE-CE2 3.62Å; M86-F90 HydrophobicContact CE-CZ 3.98Å; M86-F90 WeakPolarHBondContact O-CD2 3.31Å; M86-F90 PolarHBondContact O-N 3.22Å
87Y97.6Very high96.4Very high6 Ų661.3 Ų61.32%0.02432%0.317CS..Hα-helixtrans-56.3-51172.1169.6-112.2000111.7N19 V68 M83 L84 F89 F90 L91 S201 A205N19-Y87 PolarHBondContact ND2-OH 3.42Å; N19-Y87 PolarHBondContact OD1-OH 3.23Å; V68-Y87 HydrophobicContact CG1-CD2 3.74Å; V68-Y87 HydrophobicContact CG1-CE2 3.6Å; V68-Y87 WeakPolarHBondContact O-CD2 3.45Å; M83-Y87 WeakPolarHBondContact O-CB 3.47Å; M83-Y87 PolarHBondContact O-N 3.45Å; L84-Y87 HydrophobicContact CD1-CD1 4.23Å; L84-Y87 WeakPolarHBondContact O-CB 3.26Å; L84-Y87 PolarHBondContact O-N 2.69Å; Y87-F89 VanDerWaalsContact C-N 3.33Å; Y87-F89 PolarHBondContact O-N 3.46Å; Y87-F90 PolarHBondContact O-N 3.44Å; Y87-L91 HydrophobicContact CD1-CD1 4.27Å; Y87-L91 HydrophobicContact CD2-CD1 4.44Å; Y87-L91 HydrophobicContact CD2-CG 4.4Å; Y87-L91 HydrophobicContact CE1-CD1 3.67Å; Y87-L91 HydrophobicContact CE2-CD1 3.88Å; Y87-L91 HydrophobicContact CE2-CD2 4.37Å; Y87-L91 HydrophobicContact CE2-CG 4.08Å; Y87-L91 VanDerWaalsContact CZ-CD1 3.47Å; Y87-L91 WeakPolarHBondContact O-CG 3.47Å; Y87-L91 PolarHBondContact O-N 3.29Å; Y87-S201 WeakPolarHBondContact OH-CB 3.34Å; Y87-A205 HydrophobicContact CD1-CB 3.71Å; Y87-A205 HydrophobicContact CE1-CB 4.03Å
88A97.6Very high96.6Very high6 Ų659 Ų595%0.0530%0.304CS..Hα-helixtrans-61-41177.500000112.4L84 Y85 L91 V92 A205L84-A88 PolarHBondContact O-N 2.87Å; Y85-A88 PolarHBondContact O-N 3.47Å; A88-L91 PolarHBondContact O-N 3.32Å; A88-V92 WeakPolarHBondContact O-CG2 3.3Å; A88-V92 PolarHBondContact O-N 3.5Å; A88-A205 HydrophobicContact CB-CB 4.08Å
89F98.1Very high96.8Very high115 Ų11556.7 Ų56.750%0.50430%0.298SS..Hα-helixtrans-59.1-49.7176.5170.8-99000111.9Y85 M86 Y87 L91 V92 V93Y85-F89 WeakPolarHBondContact O-CB 3.48Å; Y85-F89 PolarHBondContact O-N 3.06Å; M86-F89 PolarHBondContact O-N 2.94Å; Y87-F89 VanDerWaalsContact C-N 3.33Å; Y87-F89 PolarHBondContact O-N 3.46Å; F89-L91 VanDerWaalsContact C-N 3.33Å; F89-L91 PolarHBondContact O-N 2.87Å; F89-V92 WeakPolarHBondContact O-CB 3.33Å; F89-V92 PolarHBondContact O-N 3.48Å; F89-V93 HydrophobicContact CE1-CG2 4.13Å; F89-V93 HydrophobicContact CE2-CG2 4.33Å; F89-V93 HydrophobicContact CZ-CG2 4Å; F89-V93 WeakPolarHBondContact O-CG2 3.29Å; F89-V93 PolarHBondContact O-N 3.39Å
90F98.1Very high97.1Very high69 Ų6954.1 Ų54.130%0.30329%0.294SS..Hα-helixtrans-65.1-35.6178.2-74.6-62.8000112.7V68 L71 M86 Y87 V92 V93 L94V68-F90 HydrophobicContact CG2-CB 3.74Å; V68-F90 HydrophobicContact CG2-CG 4.41Å; L71-F90 HydrophobicContact CD1-CD2 3.53Å; L71-F90 HydrophobicContact CD1-CE2 3.59Å; M86-F90 HydrophobicContact CE-CD2 4.46Å; M86-F90 HydrophobicContact CE-CE2 3.62Å; M86-F90 HydrophobicContact CE-CZ 3.98Å; M86-F90 WeakPolarHBondContact O-CD2 3.31Å; M86-F90 PolarHBondContact O-N 3.22Å; Y87-F90 PolarHBondContact O-N 3.44Å; F90-V92 VanDerWaalsContact C-N 3.33Å; F90-V92 PolarHBondContact O-N 2.9Å; F90-V93 PolarHBondContact O-N 3.32Å; F90-L94 WeakPolarHBondContact O-CG 3.42Å; F90-L94 PolarHBondContact O-N 2.99Å
91L98.1Very high97.2Very high10 Ų1053.8 Ų53.85%0.05230%0.301CS..Hα-helixtrans-63.5-38.1173.1-72.7-175.6000112.5V68 Y87 A88 F89 V93 L94 L95 Q198 S201 I202V68-L91 HydrophobicContact CG1-CD2 3.72Å; V68-L91 HydrophobicContact CG1-CG 4.27Å; Y87-L91 HydrophobicContact CD1-CD1 4.27Å; Y87-L91 HydrophobicContact CD2-CD1 4.44Å; Y87-L91 HydrophobicContact CD2-CG 4.4Å; Y87-L91 HydrophobicContact CE1-CD1 3.67Å; Y87-L91 HydrophobicContact CE2-CD1 3.88Å; Y87-L91 HydrophobicContact CE2-CD2 4.37Å; Y87-L91 HydrophobicContact CE2-CG 4.08Å; Y87-L91 VanDerWaalsContact CZ-CD1 3.47Å; Y87-L91 WeakPolarHBondContact O-CG 3.47Å; Y87-L91 PolarHBondContact O-N 3.29Å; A88-L91 PolarHBondContact O-N 3.32Å; F89-L91 VanDerWaalsContact C-N 3.33Å; F89-L91 PolarHBondContact O-N 2.87Å; L91-V93 VanDerWaalsContact C-N 3.35Å; L91-L94 HydrophobicContact CD2-CD1 4.44Å; L91-L94 PolarHBondContact O-N 2.94Å; L91-L95 WeakPolarHBondContact O-CB 3.31Å; L91-L95 PolarHBondContact O-N 3.48Å; L91-Q198 HydrophobicContact CD2-CG 4.31Å; L91-S201 VanDerWaalsContact CD1-CB 3.5Å; L91-I202 HydrophobicContact CB-CD1 3.85Å; L91-I202 HydrophobicContact CB-CG1 3.52Å; L91-I202 HydrophobicContact CD1-CG1 3.93Å; L91-I202 HydrophobicContact CG-CG1 4.42Å
92V98.4Very high97.2Very high61 Ų6155.6 Ų55.637%0.3732%0.318SS..Hα-helixtrans-63.6-42.6173.6170.90000110.8A88 F89 F90 L94 L95 I96 I202A88-V92 WeakPolarHBondContact O-CG2 3.3Å; A88-V92 PolarHBondContact O-N 3.5Å; F89-V92 WeakPolarHBondContact O-CB 3.33Å; F89-V92 PolarHBondContact O-N 3.48Å; F90-V92 VanDerWaalsContact C-N 3.33Å; F90-V92 PolarHBondContact O-N 2.9Å; V92-L94 VanDerWaalsContact C-N 3.35Å; V92-L95 PolarHBondContact O-N 3.07Å; V92-I96 HydrophobicContact CG1-CD1 4.03Å; V92-I96 WeakPolarHBondContact O-CG1 3.44Å; V92-I96 PolarHBondContact O-N 3.41Å; V92-I202 HydrophobicContact CG2-CD1 3.77Å; V92-I202 HydrophobicContact CG2-CG1 4.27Å; V92-I202 HydrophobicContact CG2-CG2 4.3Å
93V98.3Very high97.1Very high69 Ų6956.7 Ų56.742%0.41832%0.316SS..Hα-helixtrans-61.4-44175.8173.70000111.1F89 F90 L91 I96 A97F89-V93 HydrophobicContact CE1-CG2 4.13Å; F89-V93 HydrophobicContact CE2-CG2 4.33Å; F89-V93 HydrophobicContact CZ-CG2 4Å; F89-V93 WeakPolarHBondContact O-CG2 3.29Å; F89-V93 PolarHBondContact O-N 3.39Å; F90-V93 PolarHBondContact O-N 3.32Å; L91-V93 VanDerWaalsContact C-N 3.35Å; V93-I96 PolarHBondContact O-N 3.02Å; V93-A97 WeakPolarHBondContact O-CB 3.24Å; V93-A97 PolarHBondContact O-N 3.47Å
94L97.7Very high97.2Very high42 Ų4258.6 Ų58.622%0.2233%0.33CS..Hα-helixtrans-62.7-42.8176.1-77.7174.7000112.4I64 V68 F90 L91 V92 I96 A97 E98I64-L94 HydrophobicContact CG2-CD1 4.19Å; I64-L94 HydrophobicContact CG2-CD2 3.87Å; I64-L94 HydrophobicContact CG2-CG 4.41Å; V68-L94 HydrophobicContact CG2-CD1 4.06Å; F90-L94 WeakPolarHBondContact O-CG 3.42Å; F90-L94 PolarHBondContact O-N 2.99Å; L91-L94 HydrophobicContact CD2-CD1 4.44Å; L91-L94 PolarHBondContact O-N 2.94Å; V92-L94 VanDerWaalsContact C-N 3.35Å; L94-I96 VanDerWaalsContact C-N 3.32Å; L94-I96 PolarHBondContact O-N 3.48Å; L94-A97 WeakPolarHBondContact O-CB 3.3Å; L94-A97 PolarHBondContact O-N 2.9Å; L94-A97 VanDerWaalsContact O-N 3.15Å; L94-E98 WeakPolarHBondContact O-CG 3.17Å; L94-E98 PolarHBondContact O-N 3.45Å
95L98.2Very high97Very high27 Ų2760.5 Ų60.514%0.14135%0.346CS..Hα-helixtrans-59.3-43.8175.7-175.272.5000111.4L91 V92 E98 L99 C195 L199L91-L95 WeakPolarHBondContact O-CB 3.31Å; L91-L95 PolarHBondContact O-N 3.48Å; V92-L95 PolarHBondContact O-N 3.07Å; L95-E98 PolarHBondContact O-N 3.29Å; L95-L99 VanDerWaalsContact O-CG 3.31Å; L95-L99 WeakPolarHBondContact O-CG 3.39Å; L95-L99 PolarHBondContact O-N 2.88Å; L95-L99 VanDerWaalsContact O-N 3.09Å; L95-C195 HydrophobicContact CD1-CB 3.73Å; L95-L199 HydrophobicContact CD2-CD2 3.68Å; L95-L199 HydrophobicContact CD2-CG 4.21Å
96I98.2Very high96.8Very high106 Ų10662.4 Ų62.454%0.54437%0.366SS..Hα-helixtrans-64.4-42.5175.7-66.4167.5000110.6V92 V93 L94 L99 A100V92-I96 HydrophobicContact CG1-CD1 4.03Å; V92-I96 WeakPolarHBondContact O-CG1 3.44Å; V92-I96 PolarHBondContact O-N 3.41Å; V93-I96 PolarHBondContact O-N 3.02Å; L94-I96 VanDerWaalsContact C-N 3.32Å; L94-I96 PolarHBondContact O-N 3.48Å; I96-L99 PolarHBondContact O-N 3.3Å; I96-A100 WeakPolarHBondContact O-CB 3.4Å; I96-A100 PolarHBondContact O-N 2.7Å
97A97.4Very high96.8Very high51 Ų5163.4 Ų63.442%0.42138%0.377SS..Hα-helixtrans-63.8-39.5178.400000112.3V93 L94 A100 A101V93-A97 WeakPolarHBondContact O-CB 3.24Å; V93-A97 PolarHBondContact O-N 3.47Å; L94-A97 WeakPolarHBondContact O-CB 3.3Å; L94-A97 PolarHBondContact O-N 2.9Å; L94-A97 VanDerWaalsContact O-N 3.15Å; A97-A100 PolarHBondContact O-N 3.34Å; A97-A101 VanDerWaalsContact O-CB 3.28Å; A97-A101 WeakPolarHBondContact O-CB 3.35Å; A97-A101 PolarHBondContact O-N 3.22Å
98E96.5Very high96.7Very high60 Ų6069.6 Ų69.628%0.2840%0.401SS..Hα-helixtrans-64.3-45.1175.3-75.9173.2-169.500111.9L94 L95 A100 A101 A102 V194 C195 Q198L94-E98 WeakPolarHBondContact O-CG 3.17Å; L94-E98 PolarHBondContact O-N 3.45Å; L95-E98 PolarHBondContact O-N 3.29Å; E98-A100 VanDerWaalsContact C-N 3.35Å; E98-A100 PolarHBondContact O-N 2.87Å; E98-A101 PolarHBondContact O-N 2.98Å; E98-A102 WeakPolarHBondContact O-CB 3.4Å; E98-A102 PolarHBondContact O-N 3.35Å; E98-V194 VanDerWaalsContact OE1-CG1 3.26Å; E98-V194 WeakPolarHBondContact OE1-CG1 3.37Å; E98-C195 PolarHBondContact OE2-SG 2.67Å; E98-Q198 PolarHBondContact OE1-NE2 3.3Å; E98-Q198 PolarHBondContact OE2-OE1 2.86Å; E98-Q198 VanDerWaalsContact OE2-OE1 3.13Å
99L96.4Very high96.5Very high97 Ų9773.9 Ų73.951%0.50842%0.418SS..Hα-helixtrans-62.4-42.8175.3-68.2173.4000111.4L95 I96 A102 I103L95-L99 VanDerWaalsContact O-CG 3.31Å; L95-L99 WeakPolarHBondContact O-CG 3.39Å; L95-L99 PolarHBondContact O-N 2.88Å; L95-L99 VanDerWaalsContact O-N 3.09Å; I96-L99 PolarHBondContact O-N 3.3Å; L99-A102 PolarHBondContact O-N 3.3Å; L99-I103 VanDerWaalsContact O-CG1 3.3Å; L99-I103 WeakPolarHBondContact O-CG1 3.11Å; L99-I103 PolarHBondContact O-N 2.63Å
100A97.4Very high96.3Very high48 Ų4874.8 Ų74.840%0.39743%0.428SS..Hα-helixtrans-63.7-44.5175.800000111.7I96 A97 E98 A102 I103 V104I96-A100 WeakPolarHBondContact O-CB 3.4Å; I96-A100 PolarHBondContact O-N 2.7Å; A97-A100 PolarHBondContact O-N 3.34Å; E98-A100 VanDerWaalsContact C-N 3.35Å; E98-A100 PolarHBondContact O-N 2.87Å; A100-A102 VanDerWaalsContact C-N 3.34Å; A100-A102 PolarHBondContact O-N 2.88Å; A100-I103 PolarHBondContact O-N 3.41Å; A100-V104 WeakPolarHBondContact O-CG2 3.4Å; A100-V104 PolarHBondContact O-N 3.41Å
101A95.2Very high96.1Very high59 Ų5980 Ų8049%0.48845%0.446SS..Hα-helixtrans-62-40.6176.800000111.7A97 E98 V104 A105A97-A101 VanDerWaalsContact O-CB 3.28Å; A97-A101 WeakPolarHBondContact O-CB 3.35Å; A97-A101 PolarHBondContact O-N 3.22Å; E98-A101 PolarHBondContact O-N 2.98Å; A101-V104 PolarHBondContact O-N 3.22Å; A101-A105 VanDerWaalsContact O-CB 3.29Å; A101-A105 WeakPolarHBondContact O-CB 3.42Å; A101-A105 PolarHBondContact O-N 2.92Å
102A94.8Very high95.7Very high56 Ų5682.9 Ų82.946%0.46346%0.461SS..Hα-helixtrans-62-43.517500000112E98 L99 A100 A105 V106E98-A102 WeakPolarHBondContact O-CB 3.4Å; E98-A102 PolarHBondContact O-N 3.35Å; L99-A102 PolarHBondContact O-N 3.3Å; A100-A102 VanDerWaalsContact C-N 3.34Å; A100-A102 PolarHBondContact O-N 2.88Å; A102-A105 PolarHBondContact O-N 3.2Å; A102-V106 WeakPolarHBondContact O-CG2 3.49Å; A102-V106 PolarHBondContact O-N 2.84Å
103I95.9Very high95.3Very high110 Ų11082.9 Ų82.956%0.56446%0.459SS*.Hα-helixtrans-62.9-48.4175.4-66163.7000110.4L99 A100 A105 V106 V107L99-I103 VanDerWaalsContact O-CG1 3.3Å; L99-I103 WeakPolarHBondContact O-CG1 3.11Å; L99-I103 PolarHBondContact O-N 2.63Å; A100-I103 PolarHBondContact O-N 3.41Å; I103-A105 VanDerWaalsContact C-N 3.33Å; I103-A105 PolarHBondContact O-N 2.87Å; I103-V106 PolarHBondContact O-N 3.26Å; I103-V107 HydrophobicContact CG2-CG2 4.13Å; I103-V107 WeakPolarHBondContact O-CB 3.07Å; I103-V107 VanDerWaalsContact O-CG2 3.32Å; I103-V107 WeakPolarHBondContact O-CG2 3.39Å; I103-V107 PolarHBondContact O-N 2.9Å
104V96.3Very high95Very high76 Ų7682.4 Ų82.446%0.46146%0.459SS..Hα-helixtrans-59.9-43178.7168.60000111A100 A101 V106 V107 Y108A100-V104 WeakPolarHBondContact O-CG2 3.4Å; A100-V104 PolarHBondContact O-N 3.41Å; A101-V104 PolarHBondContact O-N 3.22Å; V104-V106 VanDerWaalsContact C-N 3.28Å; V104-V106 PolarHBondContact O-N 3.37Å; V104-V107 PolarHBondContact O-N 3.02Å; V104-Y108 HydrophobicContact CB-CD2 4.41Å; V104-Y108 HydrophobicContact CG1-CD2 3.89Å; V104-Y108 WeakPolarHBondContact O-CB 3.49Å; V104-Y108 WeakPolarHBondContact O-CD2 3.41Å; V104-Y108 PolarHBondContact O-N 2.98Å
105A92.8Very high94.6Very high46 Ų4686.8 Ų86.838%0.3848%0.478SS..Hα-helixtrans-61.8-35.8178.700000112.7A101 A102 I103 K109 I112A101-A105 VanDerWaalsContact O-CB 3.29Å; A101-A105 WeakPolarHBondContact O-CB 3.42Å; A101-A105 PolarHBondContact O-N 2.92Å; A102-A105 PolarHBondContact O-N 3.2Å; I103-A105 VanDerWaalsContact C-N 3.33Å; I103-A105 PolarHBondContact O-N 2.87Å; A105-K109 WeakPolarHBondContact O-CA 3.46Å; A105-K109 PolarHBondContact O-N 3.03Å; A105-I112 HydrophobicContact CB-CD1 4.3Å
106V92.7Very high94.1Very high120 Ų12087.2 Ų87.273%0.72748%0.48SS*.Hα-helixtrans-76.6-44.21771740000111.5A102 I103 V104A102-V106 WeakPolarHBondContact O-CG2 3.49Å; A102-V106 PolarHBondContact O-N 2.84Å; I103-V106 PolarHBondContact O-N 3.26Å; V104-V106 VanDerWaalsContact C-N 3.28Å; V104-V106 PolarHBondContact O-N 3.37Å
107V97.5Very high93.8Very high98 Ų9884.3 Ų84.359%0.59447%0.466SS*.Hα-helixtrans-71.9-38.2-176.71730000112I103 V104I103-V107 HydrophobicContact CG2-CG2 4.13Å; I103-V107 WeakPolarHBondContact O-CB 3.07Å; I103-V107 VanDerWaalsContact O-CG2 3.32Å; I103-V107 WeakPolarHBondContact O-CG2 3.39Å; I103-V107 PolarHBondContact O-N 2.9Å; V104-V107 PolarHBondContact O-N 3.02Å
108Y95.9Very high93.4Very high136 Ų13684.5 Ų84.553%0.53347%0.467SS..THydrogen-bonded Turntrans-106.925.7-175.2-64.2-83.2000113V104 D110 R111 I112V104-Y108 HydrophobicContact CB-CD2 4.41Å; V104-Y108 HydrophobicContact CG1-CD2 3.89Å; V104-Y108 WeakPolarHBondContact O-CB 3.49Å; V104-Y108 WeakPolarHBondContact O-CD2 3.41Å; V104-Y108 PolarHBondContact O-N 2.98Å; Y108-D110 VanDerWaalsContact C-N 3.35Å; Y108-D110 PolarHBondContact O-N 3Å; Y108-R111 HydrophobicContact CD1-CG 4.38Å; Y108-R111 WeakPolarHBondContact O-CB 3.42Å; Y108-R111 PolarHBondContact O-N 3.42Å; Y108-I112 PolarHBondContact O-N 3.35Å
109K92.9Very high92.9Very high95 Ų9584.3 Ų84.341%0.41347%0.468SS..Hα-helixtrans-50.7-50.1-177.9-178.5-179.3177.6173.30113.3A105 R111 I112 D113A105-K109 WeakPolarHBondContact O-CA 3.46Å; A105-K109 PolarHBondContact O-N 3.03Å; K109-R111 PolarHBondContact O-N 3.02Å; K109-I112 PolarHBondContact O-N 3.2Å; K109-I112 VanDerWaalsContact O-N 3.14Å; K109-D113 PolarHBondContact O-N 3Å
110D93.6Very high92.5Very high134 Ų13480.6 Ų80.672%0.71745%0.448SS*.Hα-helixtrans-63.1-31.9-178.2-60.5-33.3000112.2Y108 S114Y108-D110 VanDerWaalsContact C-N 3.35Å; Y108-D110 PolarHBondContact O-N 3Å; D110-S114 PolarHBondContact O-N 2.86Å; D110-S114 VanDerWaalsContact O-N 3.08Å; D110-S114 PolarHBondContact O-OG 3.03Å
111R93.6Very high92.2Very high179 Ų17980.9 Ų80.968%0.67545%0.445SS*.Hα-helixtrans-70.1-45.2175.2-65.2-66.1-172.1151.8-0.2110.9Y108 K109 D113 S114 E115Y108-R111 HydrophobicContact CD1-CG 4.38Å; Y108-R111 WeakPolarHBondContact O-CB 3.42Å; Y108-R111 PolarHBondContact O-N 3.42Å; K109-R111 PolarHBondContact O-N 3.02Å; R111-D113 VanDerWaalsContact C-N 3.33Å; R111-D113 PolarHBondContact O-N 3.22Å; R111-S114 WeakPolarHBondContact CA-OG 3.27Å; R111-S114 PolarHBondContact O-N 3.42Å; R111-S114 PolarHBondContact O-OG 3.11Å; R111-E115 WeakPolarHBondContact O-CG 3.17Å; R111-E115 PolarHBondContact O-N 3.47Å
112I89.3Confident91.7Very high70 Ų7079.2 Ų79.236%0.35943%0.433SS..Hα-helixtrans-60.1-45.1176.5-66.5168.8000110.5A105 Y108 K109 S114 E115 I116A105-I112 HydrophobicContact CB-CD1 4.3Å; Y108-I112 PolarHBondContact O-N 3.35Å; K109-I112 PolarHBondContact O-N 3.2Å; K109-I112 VanDerWaalsContact O-N 3.14Å; I112-S114 VanDerWaalsContact C-N 3.29Å; I112-S114 PolarHBondContact O-N 2.91Å; I112-E115 PolarHBondContact O-N 3.24Å; I112-I116 HydrophobicContact CG2-CD1 3.9Å; I112-I116 HydrophobicContact CG2-CG1 4.5Å; I112-I116 WeakPolarHBondContact O-CG1 3.46Å; I112-I116 PolarHBondContact O-N 3.46Å
113D91Very high91.2Very high61 Ų6176.6 Ų76.633%0.32641%0.412SS..Hα-helixtrans-59.2-41.3176.6-74.1-16.6000111K109 R111 I116 D117K109-D113 PolarHBondContact O-N 3Å; R111-D113 VanDerWaalsContact C-N 3.33Å; R111-D113 PolarHBondContact O-N 3.22Å; D113-I116 PolarHBondContact O-N 3.36Å; D113-D117 PolarHBondContact O-N 3.26Å; D113-D117 VanDerWaalsContact O-N 3.11Å
114S92.1Very high90.8Very high60 Ų6073 Ų7342%0.4239%0.393SS..Hα-helixtrans-68.9-33.9176.570.20000114.4D110 R111 I112 D117 A118D110-S114 PolarHBondContact O-N 2.86Å; D110-S114 VanDerWaalsContact O-N 3.08Å; D110-S114 PolarHBondContact O-OG 3.03Å; R111-S114 WeakPolarHBondContact CA-OG 3.27Å; R111-S114 PolarHBondContact O-N 3.42Å; R111-S114 PolarHBondContact O-OG 3.11Å; I112-S114 VanDerWaalsContact C-N 3.29Å; I112-S114 PolarHBondContact O-N 2.91Å; S114-D117 PolarHBondContact O-N 3.32Å; S114-A118 WeakPolarHBondContact O-CB 3.45Å; S114-A118 PolarHBondContact O-N 3.16Å
115E88.1Confident90.3Very high134 Ų13475.1 Ų75.163%0.62640%0.402SS*.Hα-helixtrans-70.9-37.6176.2-70.3-68.9163.800111.1R111 I112 D117 A118 L119R111-E115 WeakPolarHBondContact O-CG 3.17Å; R111-E115 PolarHBondContact O-N 3.47Å; I112-E115 PolarHBondContact O-N 3.24Å; E115-D117 VanDerWaalsContact C-N 3.34Å; E115-A118 PolarHBondContact O-N 3.45Å; E115-L119 VanDerWaalsContact O-CB 3.27Å; E115-L119 WeakPolarHBondContact O-CB 3.38Å; E115-L119 PolarHBondContact O-N 3.03Å
116I88.6Confident89.6Confident36 Ų3677.2 Ų77.219%0.18540%0.403CS..Hα-helixtrans-63.3-42.6173.5-66.6166000110.4I112 D113 L119 M120 V173 F176I112-I116 HydrophobicContact CG2-CD1 3.9Å; I112-I116 HydrophobicContact CG2-CG1 4.5Å; I112-I116 WeakPolarHBondContact O-CG1 3.46Å; I112-I116 PolarHBondContact O-N 3.46Å; D113-I116 PolarHBondContact O-N 3.36Å; I116-L119 PolarHBondContact O-N 3.29Å; I116-M120 HydrophobicContact CG2-CE 4.07Å; I116-M120 WeakPolarHBondContact O-CG 3.37Å; I116-M120 PolarHBondContact O-N 3.22Å; I116-V173 HydrophobicContact CG2-CG1 4.46Å; I116-F176 HydrophobicContact CD1-CD1 4.39Å; I116-F176 HydrophobicContact CD1-CE1 4.08Å; I116-F176 HydrophobicContact CG2-CD1 4.44Å
117D91.5Very high88.9Confident45 Ų4575.4 Ų75.424%0.24139%0.393CS..Hα-helixtrans-59.1-49174.9-173.3-66.3000111.7D113 S114 E115 L119 M120 T121 K148 V173D113-D117 PolarHBondContact O-N 3.26Å; D113-D117 VanDerWaalsContact O-N 3.11Å; S114-D117 PolarHBondContact O-N 3.32Å; E115-D117 VanDerWaalsContact C-N 3.34Å; D117-L119 VanDerWaalsContact C-N 3.35Å; D117-L119 PolarHBondContact O-N 2.96Å; D117-M120 PolarHBondContact O-N 2.97Å; D117-T121 VanDerWaalsContact O-CB 3.28Å; D117-T121 WeakPolarHBondContact O-CB 3.43Å; D117-T121 PolarHBondContact O-N 2.88Å; D117-T121 PolarHBondContact O-OG1 3.41Å; D117-T121 PolarHBondContact OD1-OG1 3.5Å; D117-K148 WeakPolarHBondContact OD1-CE 3.35Å; D117-K148 IonicContact OD1-NZ 3.88Å; D117-K148 PolarHBondContact OD1-NZ 3.48Å; D117-K148 WeakPolarHBondContact OD2-CE 3.45Å; D117-K148 IonicContact OD2-NZ 2.86Å; D117-K148 PolarHBondContact OD2-NZ 3.22Å; D117-V173 HydrophobicContact CB-CG1 4.25Å
118A88.9Confident88.1Confident55 Ų5571.5 Ų71.546%0.45537%0.37SS..Hα-helixtrans-62.9-41178.800000111.9S114 E115 G122S114-A118 WeakPolarHBondContact O-CB 3.45Å; S114-A118 PolarHBondContact O-N 3.16Å; E115-A118 PolarHBondContact O-N 3.45Å; A118-G122 PolarHBondContact O-N 3.25Å
119L85.9Confident87.5Confident56 Ų5671.6 Ų71.629%0.29337%0.373SS..Hα-helixtrans-61.9-52.8176.7-17962.9000111.1V50 W51 E115 I116 D117 T121 G122 A123V50-L119 HydrophobicContact CG1-CD1 3.9Å; W51-L119 HydrophobicContact CD2-CD1 3.81Å; W51-L119 HydrophobicContact CE3-CD1 3.93Å; W51-L119 HydrophobicContact CG-CD1 4.43Å; W51-L119 HydrophobicContact CH2-CD1 3.9Å; W51-L119 HydrophobicContact CH2-CD2 4.45Å; W51-L119 HydrophobicContact CH2-CG 3.81Å; W51-L119 HydrophobicContact CZ2-CD1 3.73Å; W51-L119 HydrophobicContact CZ2-CG 3.97Å; W51-L119 WeakPolarHBondContact CZ2-O 3.1Å; W51-L119 HydrophobicContact CZ3-CD1 4Å; W51-L119 HydrophobicContact CZ3-CD2 4.38Å; W51-L119 HydrophobicContact CZ3-CG 4.12Å; E115-L119 VanDerWaalsContact O-CB 3.27Å; E115-L119 WeakPolarHBondContact O-CB 3.38Å; E115-L119 PolarHBondContact O-N 3.03Å; I116-L119 PolarHBondContact O-N 3.29Å; D117-L119 VanDerWaalsContact C-N 3.35Å; D117-L119 PolarHBondContact O-N 2.96Å; L119-T121 PolarHBondContact O-N 3.29Å; L119-G122 PolarHBondContact O-N 2.83Å; L119-A123 PolarHBondContact O-N 3.26Å
120M88.5Confident86.8Confident19 Ų1968.4 Ų68.49%0.09436%0.36CS..Hα-helixtrans-66.3-38.7-179-70-165.4-176.300112.4I116 D117 G122 A123 A147 C172 V173 F176I116-M120 HydrophobicContact CG2-CE 4.07Å; I116-M120 WeakPolarHBondContact O-CG 3.37Å; I116-M120 PolarHBondContact O-N 3.22Å; D117-M120 PolarHBondContact O-N 2.97Å; M120-G122 VanDerWaalsContact C-N 3.35Å; M120-A123 WeakPolarHBondContact O-CB 3.47Å; M120-A123 PolarHBondContact O-N 3.46Å; M120-A147 HydrophobicContact CB-CB 3.68Å; M120-C172 HydrophobicContact CE-CB 4.48Å; M120-C172 HydrophobicContact SD-CB 3.8Å; M120-V173 HydrophobicContact CB-CG2 3.85Å; M120-V173 HydrophobicContact CG-CG2 4.03Å; M120-V173 HydrophobicContact SD-CB 4.3Å; M120-V173 HydrophobicContact SD-CG2 3.46Å; M120-V173 WeakPolarHBondContact SD-CG2 3.32Å; M120-F176 HydrophobicContact CE-CB 4.44Å
121T90.4Very high86.2Confident53 Ų5362.1 Ų62.133%0.32533%0.326SS..Hα-helixtrans-67.2-39.2176.1-57.60000110.8D117 L119 A123 L124 D125D117-T121 VanDerWaalsContact O-CB 3.28Å; D117-T121 WeakPolarHBondContact O-CB 3.43Å; D117-T121 PolarHBondContact O-N 2.88Å; D117-T121 PolarHBondContact O-OG1 3.41Å; D117-T121 PolarHBondContact OD1-OG1 3.5Å; L119-T121 PolarHBondContact O-N 3.29Å; T121-A123 VanDerWaalsContact C-N 3.26Å; T121-A123 PolarHBondContact O-N 3.25Å; T121-L124 PolarHBondContact O-N 3.32Å; T121-L124 VanDerWaalsContact O-N 3.09Å; T121-D125 PolarHBondContact O-N 2.95Å; T121-D125 VanDerWaalsContact O-N 3.08Å
122G85.2Confident85.9Confident24 Ų2456.1 Ų56.125%0.24731%0.309CS..Hα-helixtrans-62.1-29.7173.300000113.7A118 L119 M120 L124 K126A118-G122 PolarHBondContact O-N 3.25Å; L119-G122 PolarHBondContact O-N 2.83Å; M120-G122 VanDerWaalsContact C-N 3.35Å; G122-L124 VanDerWaalsContact C-N 3.27Å; G122-L124 PolarHBondContact O-N 3.39Å; G122-K126 PolarHBondContact O-N 3.1Å
123A84.1Confident85.8Confident1 Ų157.9 Ų57.91%0.00832%0.316CS..Hα-helixtrans-59.6-39.1171.700000112.4W51 L119 M120 T121 I131 M135W51-A123 HydrophobicContact CH2-CB 3.92Å; W51-A123 HydrophobicContact CZ2-CB 3.22Å; L119-A123 PolarHBondContact O-N 3.26Å; M120-A123 WeakPolarHBondContact O-CB 3.47Å; M120-A123 PolarHBondContact O-N 3.46Å; T121-A123 VanDerWaalsContact C-N 3.26Å; T121-A123 PolarHBondContact O-N 3.25Å; A123-I131 HydrophobicContact CB-CG2 3.65Å; A123-M135 HydrophobicContact CB-CG 3.82Å; A123-M135 HydrophobicContact CB-SD 3.79Å
124L87.5Confident85.6Confident35 Ų3559.8 Ų59.818%0.18332%0.321CS..Hα-helixtrans-85.3-32-173.6-61.6179.3000112.5T121 G122 K126 P127 M135 A147 D152 Y153T121-L124 PolarHBondContact O-N 3.32Å; T121-L124 VanDerWaalsContact O-N 3.09Å; G122-L124 VanDerWaalsContact C-N 3.27Å; G122-L124 PolarHBondContact O-N 3.39Å; L124-K126 VanDerWaalsContact C-N 3.32Å; L124-P127 WeakPolarHBondContact O-CD 3.1Å; L124-M135 HydrophobicContact CD2-CE 4.19Å; L124-A147 HydrophobicContact CD1-CB 4.06Å; L124-D152 HydrophobicContact CD1-CB 3.62Å; L124-Y153 HydrophobicContact CD2-CE1 3.67Å; L124-Y153 HydrophobicContact CD2-CE2 4.37Å; L124-Y153 VanDerWaalsContact CD2-OH 3.23Å; L124-Y153 WeakPolarHBondContact CD2-OH 3.18Å
125D85.8Confident85.5Confident121 Ų12157 Ų5765%0.64730%0.302SS*.Hα-helixtrans-66.8-34.3176-175.860.1000112T121T121-D125 PolarHBondContact O-N 2.95Å; T121-D125 VanDerWaalsContact O-N 3.08Å
126K78.3Confident85.7Confident89 Ų8952.9 Ų52.939%0.38728%0.284SS..SBendtrans-131.469.5-178.1-58.7-174.3-172.4173.50112L47 G122 L124 T128L47-K126 HydrophobicContact CD1-CB 3.91Å; L47-K126 HydrophobicContact CD1-CD 3.55Å; L47-K126 HydrophobicContact CD1-CG 4.29Å; L47-K126 HydrophobicContact CD2-CB 3.9Å; L47-K126 WeakPolarHBondContact CD2-O 3.32Å; L47-K126 HydrophobicContact CG-CB 3.8Å; L47-K126 HydrophobicContact CG-CD 4.08Å; G122-K126 PolarHBondContact O-N 3.1Å; L124-K126 VanDerWaalsContact C-N 3.32Å; K126-T128 PolarHBondContact O-N 2.94Å
127P77.9Confident85.9Confident82 Ų8256.5 Ų56.553%0.53230%0.303SS..  trans-72123.2-175.428.9-32.8000111.1L124L124-P127 WeakPolarHBondContact O-CD 3.1Å
128T80.3Confident86Confident16 Ų1655.5 Ų55.510%0.09830%0.298CS..  trans-99.1170.2161.168.70000109.9Y43 L47 K126 E130 I131 T132Y43-T128 HydrophobicContact CD1-CG2 4.1Å; Y43-T128 HydrophobicContact CG-CG2 3.91Å; L47-T128 HydrophobicContact CD2-CG2 3.32Å; K126-T128 PolarHBondContact O-N 2.94Å; T128-E130 VanDerWaalsContact C-N 3.29Å; T128-E130 PolarHBondContact O-N 2.89Å; T128-I131 HydrophobicContact CG2-CD1 4.09Å; T128-I131 PolarHBondContact O-N 3.47Å; T128-I131 WeakPolarHBondContact OG1-CB 3.39Å; T128-I131 VanDerWaalsContact OG1-CG1 3.3Å; T128-I131 WeakPolarHBondContact OG1-CG1 3.02Å; T128-I131 PolarHBondContact OG1-N 3.36Å; T128-I131 VanDerWaalsContact OG1-N 3.1Å; T128-T132 WeakPolarHBondContact O-CB 3.43Å; T128-T132 PolarHBondContact O-N 3.44Å; T128-T132 PolarHBondContact O-OG1 2.88Å
129K83.3Confident86.4Confident138 Ų13852.9 Ų52.960%0.628%0.276SS*.Hα-helixtrans-57.3-45.2176-174.4-179.3174.7-175.10111.2T132 E133K129-T132 PolarHBondContact O-N 3.18Å; K129-E133 WeakPolarHBondContact CE-OE1 3.38Å; K129-E133 WeakPolarHBondContact O-CB 3.31Å; K129-E133 VanDerWaalsContact O-CG 3.32Å; K129-E133 WeakPolarHBondContact O-CG 3.25Å; K129-E133 PolarHBondContact O-N 2.92Å
130E79.2Confident86.8Confident29 Ų2953.4 Ų53.414%0.13629%0.285CS..Hα-helixtrans-72.1-42.3-177.5-62.477.9-174.200112.2K39 Y43 T128 T132 E133 F134K39-E130 HydrophobicContact CB-CG 4.33Å; Y43-E130 WeakPolarHBondContact CE2-OE1 3.49Å; Y43-E130 WeakPolarHBondContact CE2-OE2 3.49Å; Y43-E130 VanDerWaalsContact CZ-OE1 3.31Å; Y43-E130 PolarHBondContact OH-OE1 2.87Å; Y43-E130 PolarHBondContact OH-OE2 3.24Å; T128-E130 VanDerWaalsContact C-N 3.29Å; T128-E130 PolarHBondContact O-N 2.89Å; E130-T132 VanDerWaalsContact C-N 3.29Å; E130-T132 PolarHBondContact O-N 3.3Å; E130-E133 PolarHBondContact O-N 3.14Å; E130-F134 WeakPolarHBondContact O-CB 3.25Å; E130-F134 PolarHBondContact O-N 3.27Å
131I80.6Confident87.1Confident2 Ų256.2 Ų56.21%0.0131%0.306CS..Hα-helixtrans-62.4-41.8173.6-68171.1000109.6F40 L47 W51 A123 T128 F134 M135F40-I131 HydrophobicContact CE1-CD1 3.81Å; F40-I131 HydrophobicContact CE1-CG1 3.46Å; F40-I131 VanDerWaalsContact CE1-CG1 3.46Å; F40-I131 HydrophobicContact CZ-CG1 3.8Å; L47-I131 HydrophobicContact CD2-CD1 4.19Å; W51-I131 HydrophobicContact CG-CD1 4.35Å; A123-I131 HydrophobicContact CB-CG2 3.65Å; T128-I131 HydrophobicContact CG2-CD1 4.09Å; T128-I131 PolarHBondContact O-N 3.47Å; T128-I131 WeakPolarHBondContact OG1-CB 3.39Å; T128-I131 VanDerWaalsContact OG1-CG1 3.3Å; T128-I131 WeakPolarHBondContact OG1-CG1 3.02Å; T128-I131 PolarHBondContact OG1-N 3.36Å; T128-I131 VanDerWaalsContact OG1-N 3.1Å; I131-F134 PolarHBondContact O-N 3.35Å; I131-M135 HydrophobicContact CG2-CG 4.29Å; I131-M135 WeakPolarHBondContact O-CB 3.35Å; I131-M135 VanDerWaalsContact O-CG 3.31Å; I131-M135 WeakPolarHBondContact O-CG 3.37Å; I131-M135 PolarHBondContact O-N 2.69Å
132T87.7Confident87.3Confident52 Ų5256.6 Ų56.632%0.31930%0.303SS..Hα-helixtrans-66-41.8178.2-56.60000111.2T128 K129 E130 M135 N136T128-T132 WeakPolarHBondContact O-CB 3.43Å; T128-T132 PolarHBondContact O-N 3.44Å; T128-T132 PolarHBondContact O-OG1 2.88Å; K129-T132 PolarHBondContact O-N 3.18Å; E130-T132 VanDerWaalsContact C-N 3.29Å; E130-T132 PolarHBondContact O-N 3.3Å; T132-M135 PolarHBondContact O-N 3.42Å; T132-N136 VanDerWaalsContact O-CB 3.26Å; T132-N136 WeakPolarHBondContact O-CB 3.34Å; T132-N136 PolarHBondContact O-N 3.17Å; T132-N136 PolarHBondContact O-ND2 3.38Å; T132-N136 VanDerWaalsContact O-ND2 3.13Å
133E87.2Confident87.8Confident107 Ų10760 Ų6050%0.531%0.313SS..Hα-helixtrans-62-42.5173.9-78.4175-170.700111.8K129 E130 N136 L137K129-E133 WeakPolarHBondContact CE-OE1 3.38Å; K129-E133 WeakPolarHBondContact O-CB 3.31Å; K129-E133 VanDerWaalsContact O-CG 3.32Å; K129-E133 WeakPolarHBondContact O-CG 3.25Å; K129-E133 PolarHBondContact O-N 2.92Å; E130-E133 PolarHBondContact O-N 3.14Å; E133-N136 WeakPolarHBondContact O-CB 3.34Å; E133-N136 PolarHBondContact O-N 3.08Å; E133-L137 PolarHBondContact O-N 2.92Å
134F86.1Confident88.5Confident101 Ų10160 Ų6044%0.44331%0.312SS..Hα-helixtrans-66.2-45.1176.2-176.2-112.3000112.3W51 E130 I131 N136 L137 I138W51-F134 HydrophobicContact CZ3-CD1 4.21Å; W51-F134 HydrophobicContact CZ3-CE1 4.06Å; E130-F134 WeakPolarHBondContact O-CB 3.25Å; E130-F134 PolarHBondContact O-N 3.27Å; I131-F134 PolarHBondContact O-N 3.35Å; F134-N136 VanDerWaalsContact C-N 3.3Å; F134-N136 PolarHBondContact O-N 2.93Å; F134-L137 WeakPolarHBondContact O-CB 3.33Å; F134-L137 PolarHBondContact O-N 3.44Å; F134-L137 VanDerWaalsContact O-N 3.13Å; F134-I138 HydrophobicContact CD1-CD1 3.79Å; F134-I138 HydrophobicContact CE1-CD1 3.32Å; F134-I138 HydrophobicContact CE1-CG1 4.28Å; F134-I138 HydrophobicContact CE2-CD1 4.39Å; F134-I138 HydrophobicContact CZ-CD1 3.66Å; F134-I138 HydrophobicContact CZ-CG1 4.26Å; F134-I138 PolarHBondContact O-N 3.07Å
135M89.7Confident88.9Confident3 Ų358.3 Ų58.32%0.01530%0.303CS..Hα-helixtrans-60.8-40.5173.3-75.1-58.3-6300111.3A123 L124 I131 T132 L137 I138 Q139A123-M135 HydrophobicContact CB-CG 3.82Å; A123-M135 HydrophobicContact CB-SD 3.79Å; L124-M135 HydrophobicContact CD2-CE 4.19Å; I131-M135 HydrophobicContact CG2-CG 4.29Å; I131-M135 WeakPolarHBondContact O-CB 3.35Å; I131-M135 VanDerWaalsContact O-CG 3.31Å; I131-M135 WeakPolarHBondContact O-CG 3.37Å; I131-M135 PolarHBondContact O-N 2.69Å; T132-M135 PolarHBondContact O-N 3.42Å; M135-L137 VanDerWaalsContact C-N 3.3Å; M135-L137 PolarHBondContact O-N 3.46Å; M135-I138 PolarHBondContact O-N 2.98Å; M135-I138 HydrophobicContact SD-CD1 4.48Å; M135-Q139 WeakPolarHBondContact O-CB 2.96Å; M135-Q139 WeakPolarHBondContact O-CG 3.32Å; M135-Q139 PolarHBondContact O-N 3.01Å
136N94Very high89.4Confident47 Ų4752.6 Ų52.625%0.25127%0.273SS..Hα-helixtrans-61.3-38.9174.6-73.8-26.3000112T132 E133 F134 S140 S160T132-N136 VanDerWaalsContact O-CB 3.26Å; T132-N136 WeakPolarHBondContact O-CB 3.34Å; T132-N136 PolarHBondContact O-N 3.17Å; T132-N136 PolarHBondContact O-ND2 3.38Å; T132-N136 VanDerWaalsContact O-ND2 3.13Å; E133-N136 WeakPolarHBondContact O-CB 3.34Å; E133-N136 PolarHBondContact O-N 3.08Å; F134-N136 VanDerWaalsContact C-N 3.3Å; F134-N136 PolarHBondContact O-N 2.93Å; N136-S140 VanDerWaalsContact O-CB 3.27Å; N136-S140 WeakPolarHBondContact O-CB 3.46Å; N136-S140 PolarHBondContact O-N 3.28Å; N136-S160 WeakPolarHBondContact O-CB 3.27Å; N136-S160 WeakPolarHBondContact OD1-CB 2.88Å; N136-S160 PolarHBondContact OD1-OG 3.48Å
137L92.8Very high90.2Very high112 Ų11248.3 Ų48.359%0.58625%0.254SS*.Hα-helixtrans-67.1-44.3176.2-171.3147.7000111.4E133 F134 M135 S141E133-L137 PolarHBondContact O-N 2.92Å; F134-L137 WeakPolarHBondContact O-CB 3.33Å; F134-L137 PolarHBondContact O-N 3.44Å; F134-L137 VanDerWaalsContact O-N 3.13Å; M135-L137 VanDerWaalsContact C-N 3.3Å; M135-L137 PolarHBondContact O-N 3.46Å; L137-S141 WeakPolarHBondContact O-CB 3.49Å; L137-S141 PolarHBondContact O-N 3.28Å
138I93Very high91.1Very high23 Ų2350.5 Ų50.512%0.11826%0.255CS..Hα-helixtrans-60.4-49.8175.3-69.7172.2000110.5F134 M135 S140 S141 F142 C172F134-I138 HydrophobicContact CD1-CD1 3.79Å; F134-I138 HydrophobicContact CE1-CD1 3.32Å; F134-I138 HydrophobicContact CE1-CG1 4.28Å; F134-I138 HydrophobicContact CE2-CD1 4.39Å; F134-I138 HydrophobicContact CZ-CD1 3.66Å; F134-I138 HydrophobicContact CZ-CG1 4.26Å; F134-I138 PolarHBondContact O-N 3.07Å; M135-I138 PolarHBondContact O-N 2.98Å; M135-I138 HydrophobicContact SD-CD1 4.48Å; I138-S140 PolarHBondContact O-N 3.21Å; I138-S141 PolarHBondContact O-N 3.39Å; I138-F142 HydrophobicContact CG2-CD2 4.08Å; I138-F142 WeakPolarHBondContact O-CB 3.37Å; I138-F142 PolarHBondContact O-N 2.86Å; I138-C172 HydrophobicContact CG2-CB 4.21Å
139Q96.8Very high91.9Very high0 Ų050 Ų500%025%0.253CS..Hα-helixtrans-60.9-45.1-176.9-72.9173.9161.500112.1M135 H143 C144 Y153 S160 C161M135-Q139 WeakPolarHBondContact O-CB 2.96Å; M135-Q139 WeakPolarHBondContact O-CG 3.32Å; M135-Q139 PolarHBondContact O-N 3.01Å; Q139-H143 WeakPolarHBondContact O-CA 3.3Å; Q139-H143 PolarHBondContact O-N 3.39Å; Q139-C144 WeakPolarHBondContact CA-O 3.42Å; Q139-C144 VanDerWaalsContact CB-O 3.23Å; Q139-C144 WeakPolarHBondContact CB-O 3.33Å; Q139-C144 WeakPolarHBondContact CG-O 3.29Å; Q139-C144 PolarHBondContact O-N 3.46Å; Q139-Y153 PolarHBondContact NE2-OH 3.32Å; Q139-Y153 PolarHBondContact OE1-OH 3.01Å; Q139-S160 CarbonylContact C-O 3.54Å; Q139-S160 PolarHBondContact NE2-OG 3.45Å; Q139-C161 PolarHBondContact NE2-SG 3.2Å; Q139-C161 VanDerWaalsContact NE2-SG 3.36Å
140S95.2Very high92.5Very high68 Ų6844.7 Ų44.748%0.47623%0.233SC..Hα-helixtrans-68-40.9176.3-175.20000112N136 I138 S160N136-S140 VanDerWaalsContact O-CB 3.27Å; N136-S140 WeakPolarHBondContact O-CB 3.46Å; N136-S140 PolarHBondContact O-N 3.28Å; I138-S140 PolarHBondContact O-N 3.21Å; S140-S160 PolarHBondContact N-O 2.78Å
141S94.5Very high93.2Very high77 Ų7749.7 Ų49.754%0.53826%0.261SS..Hα-helixtrans-76-29.8-176.4-172.20000114L137 I138L137-S141 WeakPolarHBondContact O-CB 3.49Å; L137-S141 PolarHBondContact O-N 3.28Å; I138-S141 PolarHBondContact O-N 3.39Å
142F94.7Very high93.9Very high62 Ų6252.4 Ų52.427%0.27228%0.275SS..Hα-helixtrans-108.33.6-178.1-73.2-82.8000113.1I138 C144 V175 F176 F179I138-F142 HydrophobicContact CG2-CD2 4.08Å; I138-F142 WeakPolarHBondContact O-CB 3.37Å; I138-F142 PolarHBondContact O-N 2.86Å; F142-C144 VanDerWaalsContact C-N 3.28Å; F142-C144 PolarHBondContact O-N 3.39Å; F142-V175 HydrophobicContact CB-CG1 4.21Å; F142-V175 WeakPolarHBondContact O-CG1 3.46Å; F142-F176 HydrophobicContact CZ-CD2 4.48Å; F142-F179 HydrophobicContact CE1-CD1 4.26Å; F142-F179 HydrophobicContact CE1-CD2 4.17Å; F142-F179 HydrophobicContact CE1-CE2 4.46Å; F142-F179 HydrophobicContact CE1-CG 4.07Å
143H96.2Very high94.2Very high96 Ų9652.3 Ų52.344%0.44427%0.269SS..THydrogen-bonded Turntrans5147.9-178.3-57.5-87.6000112.5Q139 E163 Y168Q139-H143 WeakPolarHBondContact O-CA 3.3Å; Q139-H143 PolarHBondContact O-N 3.39Å; H143-E163 IonicContact CE1-OE1 3.1Å; H143-E163 IonicContact CE1-OE2 3.76Å; H143-E163 IonicContact ND1-OE2 3.41Å; H143-E163 PolarHBondContact ND1-OE2 2.86Å; H143-Y168 VanDerWaalsContact C-CD2 3.49Å; H143-Y168 VanDerWaalsContact C-CG 3.48Å; H143-Y168 HydrophobicContact CB-CD1 4.01Å; H143-Y168 HydrophobicContact CB-CE1 3.65Å; H143-Y168 HydrophobicContact CB-CE2 4.3Å; H143-Y168 HydrophobicContact CB-CG 4.48Å; H143-Y168 AromaticContact CG-CZ 3.95Å; H143-Y168 AromaticContact ND1-CE1 3.59Å; H143-Y168 AromaticContact ND1-CZ 3.39Å; H143-Y168 PolarHBondContact ND1-OH 2.93Å
144C97.2Very high94.5Very high0 Ų054.7 Ų54.70%029%0.285CS..  trans-128.8163.8-17862.60000110.3Q139 F142 Y168 E170 C172 V175Q139-C144 WeakPolarHBondContact CA-O 3.42Å; Q139-C144 VanDerWaalsContact CB-O 3.23Å; Q139-C144 WeakPolarHBondContact CB-O 3.33Å; Q139-C144 WeakPolarHBondContact CG-O 3.29Å; Q139-C144 PolarHBondContact O-N 3.46Å; F142-C144 VanDerWaalsContact C-N 3.28Å; F142-C144 PolarHBondContact O-N 3.39Å; C144-Y168 WeakPolarHBondContact O-CD2 3.3Å; C144-E170 CarbonylContact C-O 3.51Å; C144-E170 WeakPolarHBondContact CA-O 3.49Å; C144-E170 WeakPolarHBondContact CB-O 3Å; C144-C172 HydrophobicContact CB-CB 3.9Å; C144-C172 WeakPolarHBondContact CB-SG 3.42Å; C144-C172 WeakPolarHBondContact SG-CA 3.27Å; C144-C172 WeakPolarHBondContact SG-CB 3.36Å; C144-C172 CovalentContact SG-SG 2.04Å; C144-C172 PolarHBondContact SG-SG 3.49Å; C144-V175 HydrophobicContact CB-CB 4.09Å; C144-V175 HydrophobicContact CB-CG2 3.83Å
145C97.3Very high94.5Very high0 Ų052.9 Ų52.90%030%0.295CS..  trans-138.6130.1176.8-1660000113G149 P150 V157 C161 Y168 E170C145-G149 CarbonylContact O-C 3.56Å; C145-G149 WeakPolarHBondContact O-CA 3.41Å; C145-G149 PolarHBondContact O-N 3.13Å; C145-P150 HydrophobicContact CB-CB 4.28Å; C145-V157 WeakPolarHBondContact SG-CG1 3.31Å; C145-C161 WeakPolarHBondContact CA-SG 3.34Å; C145-C161 HydrophobicContact CB-CB 3.62Å; C145-C161 WeakPolarHBondContact CB-SG 3.37Å; C145-C161 WeakPolarHBondContact SG-CB 3.47Å; C145-C161 CovalentContact SG-SG 2.05Å; C145-C161 PolarHBondContact SG-SG 3.17Å; C145-Y168 WeakPolarHBondContact CB-O 3.36Å; C145-E170 PolarHBondContact N-O 3.05Å
146G95.9Very high94.6Very high0 Ų059.5 Ų59.50%033%0.33CS..SBendtrans66.6-177.5-176.200000112.2C172G146-C172 VanDerWaalsContact O-CB 3.24Å; G146-C172 WeakPolarHBondContact O-CB 3.21Å; G146-C172 PolarHBondContact O-N 3.47Å; G146-C172 PolarHBondContact O-SG 2.9Å
147A95.2Very high94.6Very high0 Ų058.5 Ų58.50%033%0.326CS..SBendtrans-74.6-50.6174.700000110M120 L124 D152 G171 C172 V173M120-A147 HydrophobicContact CB-CB 3.68Å; L124-A147 HydrophobicContact CD1-CB 4.06Å; A147-D152 WeakPolarHBondContact CA-OD2 3.31Å; A147-D152 PolarHBondContact N-OD2 2.85Å; A147-G171 CarbonylContact O-C 3Å; A147-G171 VanDerWaalsContact O-C 3.3Å; A147-G171 WeakPolarHBondContact O-CA 3.22Å; A147-C172 PolarHBondContact O-N 3.36Å; A147-V173 HydrophobicContact CB-CG2 4.18Å; A147-V173 WeakPolarHBondContact O-CB 3.16Å; A147-V173 VanDerWaalsContact O-CG2 3.3Å; A147-V173 WeakPolarHBondContact O-CG2 3.3Å; A147-V173 PolarHBondContact O-N 3.33Å
148K96.3Very high94.7Very high127 Ų12754.5 Ų54.555%0.55231%0.307SS*.SBendtrans-107.6-20.2-176.6-65.7178.5177.7168.30112.9D117 D152 G171D117-K148 WeakPolarHBondContact OD1-CE 3.35Å; D117-K148 IonicContact OD1-NZ 3.88Å; D117-K148 PolarHBondContact OD1-NZ 3.48Å; D117-K148 WeakPolarHBondContact OD2-CE 3.45Å; D117-K148 IonicContact OD2-NZ 2.86Å; D117-K148 PolarHBondContact OD2-NZ 3.22Å; K148-D152 PolarHBondContact N-OD2 3.11Å; K148-G171 VanDerWaalsContact C-CA 3.45Å
149G96.7Very high94.7Very high6 Ų657.5 Ų57.56%0.06234%0.335CS..  trans162179.6174.300000112.6C145 N151 D152C145-G149 CarbonylContact O-C 3.56Å; C145-G149 WeakPolarHBondContact O-CA 3.41Å; C145-G149 PolarHBondContact O-N 3.13Å; G149-N151 PolarHBondContact O-N 3.15Å; G149-N151 VanDerWaalsContact O-N 3.08Å; G149-D152 PolarHBondContact N-OD2 3.05Å; G149-D152 WeakPolarHBondContact O-CB 3.48Å; G149-D152 VanDerWaalsContact O-CG 3.27Å; G149-D152 PolarHBondContact O-N 2.97Å
150P95.6Very high94.7Very high27 Ų2758.4 Ų58.418%0.17534%0.341CS..G310 helixtrans-62-20.9-177.924.5-34.7000113.8C145 D152 Y153 V157 T167 T169C145-P150 HydrophobicContact CB-CB 4.28Å; P150-D152 PolarHBondContact O-N 3.12Å; P150-Y153 PolarHBondContact O-N 3.37Å; P150-V157 HydrophobicContact CB-CG2 3.94Å; P150-T167 HydrophobicContact CB-CG2 4.07Å; P150-T169 VanDerWaalsContact CD-O 3.3Å; P150-T169 WeakPolarHBondContact CD-O 3.24Å
151N95.4Very high94.8Very high134 Ų13455.2 Ų55.272%0.71732%0.318SS*.G310 helixtrans-66.4-18.5176-70.7-31.8000113.4G149 Y153 L154G149-N151 PolarHBondContact O-N 3.15Å; G149-N151 VanDerWaalsContact O-N 3.08Å; N151-Y153 PolarHBondContact O-N 3.4Å; N151-Y153 VanDerWaalsContact O-N 3.14Å; N151-L154 PolarHBondContact O-N 3.29Å
152D95.1Very high94.8Very high59 Ų5956.3 Ų56.332%0.31631%0.314SS..G310 helixtrans-61-22.9174.9-63.2-18.5000111.9L124 A147 K148 G149 P150L124-D152 HydrophobicContact CD1-CB 3.62Å; A147-D152 WeakPolarHBondContact CA-OD2 3.31Å; A147-D152 PolarHBondContact N-OD2 2.85Å; K148-D152 PolarHBondContact N-OD2 3.11Å; G149-D152 PolarHBondContact N-OD2 3.05Å; G149-D152 WeakPolarHBondContact O-CB 3.48Å; G149-D152 VanDerWaalsContact O-CG 3.27Å; G149-D152 PolarHBondContact O-N 2.97Å; P150-D152 PolarHBondContact O-N 3.12Å
153Y94.2Very high94.6Very high49 Ų4958 Ų5819%0.19232%0.322CS..G310 helixtrans-92.85.3176.2-69.3-69.7000114.5L124 Q139 P150 N151 G155 N156 V157 P158L124-Y153 HydrophobicContact CD2-CE1 3.67Å; L124-Y153 HydrophobicContact CD2-CE2 4.37Å; L124-Y153 VanDerWaalsContact CD2-OH 3.23Å; L124-Y153 WeakPolarHBondContact CD2-OH 3.18Å; Q139-Y153 PolarHBondContact NE2-OH 3.32Å; Q139-Y153 PolarHBondContact OE1-OH 3.01Å; P150-Y153 PolarHBondContact O-N 3.37Å; N151-Y153 PolarHBondContact O-N 3.4Å; N151-Y153 VanDerWaalsContact O-N 3.14Å; Y153-G155 PolarHBondContact O-N 3.04Å; Y153-G155 VanDerWaalsContact O-N 3.11Å; Y153-N156 PolarHBondContact O-N 2.89Å; Y153-V157 HydrophobicContact CD2-CG2 4.5Å; Y153-P158 HydrophobicContact CD2-CG 4.45Å; Y153-P158 HydrophobicContact CE1-CG 4.23Å; Y153-P158 HydrophobicContact CE2-CG 3.9Å
154L91.8Very high94.1Very high157 Ų15762 Ų6282%0.82234%0.341SS*.THydrogen-bonded Turntrans50.639.3177.1-55.6176.1000113.6N151N151-L154 PolarHBondContact O-N 3.29Å
155G87.6Confident93.4Very high63 Ų6369.2 Ų69.265%0.64938%0.38SS*.THydrogen-bonded Turntrans91.8-15.5179.200000115.5Y153 V157Y153-G155 PolarHBondContact O-N 3.04Å; Y153-G155 VanDerWaalsContact O-N 3.11Å; G155-V157 PolarHBondContact O-N 3.49Å
156N91.9Very high93.2Very high143 Ų14375.6 Ų75.677%0.76541%0.413SS*.  trans-97.560.1179.3-68.2-44.1000111.9Y153Y153-N156 PolarHBondContact O-N 2.89Å
157V93.2Very high93.1Very high26 Ų2678.3 Ų78.316%0.15843%0.43CS..  trans-69.9132-175.2174.30000111.5C145 P150 Y153 G155 C161 T167C145-V157 WeakPolarHBondContact SG-CG1 3.31Å; P150-V157 HydrophobicContact CB-CG2 3.94Å; Y153-V157 HydrophobicContact CD2-CG2 4.5Å; G155-V157 PolarHBondContact O-N 3.49Å; V157-C161 HydrophobicContact CG1-CB 3.23Å; V157-T167 HydrophobicContact CB-CG2 4.45Å; V157-T167 HydrophobicContact CG1-CG2 3.75Å; V157-T167 HydrophobicContact CG2-CG2 4.42Å
158P94.4Very high93.1Very high28 Ų2879.9 Ų79.918%0.18244%0.436CS..  trans-67.1158.8-179.927.9-36.5000112.7Y153 S160 C161Y153-P158 HydrophobicContact CD2-CG 4.45Å; Y153-P158 HydrophobicContact CE1-CG 4.23Å; Y153-P158 HydrophobicContact CE2-CG 3.9Å; P158-S160 PolarHBondContact O-N 3.34Å; P158-C161 HydrophobicContact CG-CB 4.48Å; P158-C161 WeakPolarHBondContact O-CB 3.44Å; P158-C161 PolarHBondContact O-N 2.93Å
159A94.7Very high93.1Very high86 Ų8678.8 Ų78.871%0.71144%0.44SS*.G310 helixtrans-60.7-27.9178.100000113.2C161 K162A159-C161 PolarHBondContact O-N 3.36Å; A159-K162 PolarHBondContact O-N 3.05Å
160S95.8Very high93.1Very high19 Ų1983.7 Ų83.713%0.13346%0.461CS..G310 helixtrans-63.3-19.2175.456.80000114.3N136 Q139 S140 P158 K162N136-S160 WeakPolarHBondContact O-CB 3.27Å; N136-S160 WeakPolarHBondContact OD1-CB 2.88Å; N136-S160 PolarHBondContact OD1-OG 3.48Å; Q139-S160 CarbonylContact C-O 3.54Å; Q139-S160 PolarHBondContact NE2-OG 3.45Å; S140-S160 PolarHBondContact N-O 2.78Å; P158-S160 PolarHBondContact O-N 3.34Å; S160-K162 VanDerWaalsContact C-N 3.32Å
161C96.5Very high93.1Very high0 Ų082.5 Ų82.50%045%0.454CS..G310 helixtrans-88.55.2174.6-75.20000113.4Q139 C145 V157 P158 A159 T167 Y168Q139-C161 PolarHBondContact NE2-SG 3.2Å; Q139-C161 VanDerWaalsContact NE2-SG 3.36Å; C145-C161 WeakPolarHBondContact CA-SG 3.34Å; C145-C161 HydrophobicContact CB-CB 3.62Å; C145-C161 WeakPolarHBondContact CB-SG 3.37Å; C145-C161 WeakPolarHBondContact SG-CB 3.47Å; C145-C161 CovalentContact SG-SG 2.05Å; C145-C161 PolarHBondContact SG-SG 3.17Å; V157-C161 HydrophobicContact CG1-CB 3.23Å; P158-C161 HydrophobicContact CG-CB 4.48Å; P158-C161 WeakPolarHBondContact O-CB 3.44Å; P158-C161 PolarHBondContact O-N 2.93Å; A159-C161 PolarHBondContact O-N 3.36Å; C161-T167 WeakPolarHBondContact O-CA 3.02Å; C161-Y168 WeakPolarHBondContact O-CD2 3.28Å; C161-Y168 PolarHBondContact O-N 3.16Å
162K94.8Very high93.2Very high100 Ų10076.1 Ų76.144%0.43542%0.42SS..EExtended strand (participates in β ladder)trans-120.3137.9-173.4-59.9-176.3-176.9179.20111.7A159 S160 L166A159-K162 PolarHBondContact O-N 3.05Å; S160-K162 VanDerWaalsContact C-N 3.32Å; K162-L166 CarbonylContact C-O 3.3Å; K162-L166 WeakPolarHBondContact CA-O 3.18Å
163E91.6Very high93.2Very high98 Ų9874.5 Ų74.546%0.45841%0.412SS..EExtended strand (participates in β ladder)trans-124121.7169.2-170.3165.1-154.700108.4H143 N165 L166 Y168H143-E163 IonicContact CE1-OE1 3.1Å; H143-E163 IonicContact CE1-OE2 3.76Å; H143-E163 IonicContact ND1-OE2 3.41Å; H143-E163 PolarHBondContact ND1-OE2 2.86Å; E163-N165 PolarHBondContact O-N 2.95Å; E163-L166 PolarHBondContact N-O 3.49Å; E163-L166 WeakPolarHBondContact O-CB 3.5Å; E163-L166 PolarHBondContact O-N 3.33Å; E163-Y168 HydrophobicContact CB-CE1 3.83Å; E163-Y168 WeakPolarHBondContact CB-OH 3.3Å
164E86.3Confident93.2Very high180 Ų18075 Ų7584%0.84142%0.423SS*.THydrogen-bonded Turntrans49.635.4-179.3-57-171.6160.100114.5L166E164-L166 VanDerWaalsContact C-N 3.31Å; E164-L166 PolarHBondContact O-N 3.43Å
165N82.3Confident93.4Very high151 Ų15169.1 Ų69.181%0.80739%0.393SS*.THydrogen-bonded Turntrans75-2-174-54.2-56.3000117E163E163-N165 PolarHBondContact O-N 2.95Å
166L92.2Very high93.7Very high134 Ų13469.2 Ų69.270%0.70238%0.376SS*.EExtended strand (participates in β ladder)trans-84.5133170.3-64.5171.1000109.7K162 E163 E164K162-L166 CarbonylContact C-O 3.3Å; K162-L166 WeakPolarHBondContact CA-O 3.18Å; E163-L166 PolarHBondContact N-O 3.49Å; E163-L166 WeakPolarHBondContact O-CB 3.5Å; E163-L166 PolarHBondContact O-N 3.33Å; E164-L166 VanDerWaalsContact C-N 3.31Å; E164-L166 PolarHBondContact O-N 3.43Å
167T94.2Very high93.8Very high58 Ų5863.2 Ų63.236%0.35635%0.348SS..EExtended strand (participates in β ladder)trans-91.5131.9178.6-58.40000109.8P150 V157 C161 T169P150-T167 HydrophobicContact CB-CG2 4.07Å; V157-T167 HydrophobicContact CB-CG2 4.45Å; V157-T167 HydrophobicContact CG1-CG2 3.75Å; V157-T167 HydrophobicContact CG2-CG2 4.42Å; C161-T167 WeakPolarHBondContact O-CA 3.02Å; T167-T169 PolarHBondContact O-N 2.9Å
168Y95.7Very high93.8Very high33 Ų3364.6 Ų64.613%0.12936%0.362CS..PPolyproline II helixtrans-61.9136174.3-51.5-55.3000110.8H143 C144 C145 C161 E163H143-Y168 VanDerWaalsContact C-CD2 3.49Å; H143-Y168 VanDerWaalsContact C-CG 3.48Å; H143-Y168 HydrophobicContact CB-CD1 4.01Å; H143-Y168 HydrophobicContact CB-CE1 3.65Å; H143-Y168 HydrophobicContact CB-CE2 4.3Å; H143-Y168 HydrophobicContact CB-CG 4.48Å; H143-Y168 AromaticContact CG-CZ 3.95Å; H143-Y168 AromaticContact ND1-CE1 3.59Å; H143-Y168 AromaticContact ND1-CZ 3.39Å; H143-Y168 PolarHBondContact ND1-OH 2.93Å; C144-Y168 WeakPolarHBondContact O-CD2 3.3Å; C145-Y168 WeakPolarHBondContact CB-O 3.36Å; C161-Y168 WeakPolarHBondContact O-CD2 3.28Å; C161-Y168 PolarHBondContact O-N 3.16Å; E163-Y168 HydrophobicContact CB-CE1 3.83Å; E163-Y168 WeakPolarHBondContact CB-OH 3.3Å
169T95.2Very high93.7Very high104 Ų10467.6 Ų67.664%0.63837%0.373SS*.  trans-94.4-22.9-175.7530000113.4P150 T167P150-T169 VanDerWaalsContact CD-O 3.3Å; P150-T169 WeakPolarHBondContact CD-O 3.24Å; T167-T169 PolarHBondContact O-N 2.9Å
170E96.4Very high93.6Very high108 Ų10866.6 Ų66.651%0.50536%0.355SS..SBendtrans-88.7137.1-174.5-60.4-58.6140.600112C144 C145 V175C144-E170 CarbonylContact C-O 3.51Å; C144-E170 WeakPolarHBondContact CA-O 3.49Å; C144-E170 WeakPolarHBondContact CB-O 3Å; C145-E170 PolarHBondContact N-O 3.05Å; E170-V175 HydrophobicContact CB-CG2 3.56Å; E170-V175 HydrophobicContact CG-CG2 4.47Å
171G96.8Very high93.4Very high2 Ų272.2 Ų72.22%0.02138%0.377CS..  trans-71.8142.2174.100000112.7A147 K148 V173 S174 V175A147-G171 CarbonylContact O-C 3Å; A147-G171 VanDerWaalsContact O-C 3.3Å; A147-G171 WeakPolarHBondContact O-CA 3.22Å; K148-G171 VanDerWaalsContact C-CA 3.45Å; G171-V173 VanDerWaalsContact C-N 3.25Å; G171-V173 PolarHBondContact O-N 3.34Å; G171-S174 PolarHBondContact O-N 2.87Å; G171-S174 VanDerWaalsContact O-N 3.07Å; G171-S174 PolarHBondContact O-OG 3.47Å; G171-V175 PolarHBondContact O-N 2.98Å; G171-V175 VanDerWaalsContact O-N 3.13Å
172C96.2Very high93.4Very high1 Ų182.5 Ų82.51%0.00742%0.416CS..Hα-helixtrans-61.7-28.7-176.3-66.80000114.1M120 I138 C144 G146 A147 F176M120-C172 HydrophobicContact CE-CB 4.48Å; M120-C172 HydrophobicContact SD-CB 3.8Å; I138-C172 HydrophobicContact CG2-CB 4.21Å; C144-C172 HydrophobicContact CB-CB 3.9Å; C144-C172 WeakPolarHBondContact CB-SG 3.42Å; C144-C172 WeakPolarHBondContact SG-CA 3.27Å; C144-C172 WeakPolarHBondContact SG-CB 3.36Å; C144-C172 CovalentContact SG-SG 2.04Å; C144-C172 PolarHBondContact SG-SG 3.49Å; G146-C172 VanDerWaalsContact O-CB 3.24Å; G146-C172 WeakPolarHBondContact O-CB 3.21Å; G146-C172 PolarHBondContact O-N 3.47Å; G146-C172 PolarHBondContact O-SG 2.9Å; A147-C172 PolarHBondContact O-N 3.36Å; C172-F176 WeakPolarHBondContact O-CB 3.24Å; C172-F176 PolarHBondContact O-N 2.95Å
173V95.2Very high93.3Very high25 Ų2579.4 Ų79.415%0.15240%0.404CS..Hα-helixtrans-62.4-46.2174.5177.60000110.3I116 D117 M120 A147 G171 G177I116-V173 HydrophobicContact CG2-CG1 4.46Å; D117-V173 HydrophobicContact CB-CG1 4.25Å; M120-V173 HydrophobicContact CB-CG2 3.85Å; M120-V173 HydrophobicContact CG-CG2 4.03Å; M120-V173 HydrophobicContact SD-CB 4.3Å; M120-V173 HydrophobicContact SD-CG2 3.46Å; M120-V173 WeakPolarHBondContact SD-CG2 3.32Å; A147-V173 HydrophobicContact CB-CG2 4.18Å; A147-V173 WeakPolarHBondContact O-CB 3.16Å; A147-V173 VanDerWaalsContact O-CG2 3.3Å; A147-V173 WeakPolarHBondContact O-CG2 3.3Å; A147-V173 PolarHBondContact O-N 3.33Å; G171-V173 VanDerWaalsContact C-N 3.25Å; G171-V173 PolarHBondContact O-N 3.34Å; V173-G177 PolarHBondContact O-N 2.86Å
174S95.5Very high93.4Very high60 Ų6080.1 Ų80.142%0.4241%0.41SS..Hα-helixtrans-68.5-42.5-178.373.50000112.1G171 G177 A178G171-S174 PolarHBondContact O-N 2.87Å; G171-S174 VanDerWaalsContact O-N 3.07Å; G171-S174 PolarHBondContact O-OG 3.47Å; S174-G177 PolarHBondContact O-N 3.43Å; S174-A178 WeakPolarHBondContact O-CB 3.46Å; S174-A178 PolarHBondContact O-N 3.11Å
175V96Very high93.9Very high32 Ų3276.6 Ų76.619%0.19440%0.401CS..Hα-helixtrans-66.3-43178.3176.60000110.7F142 C144 E170 G171 A178 F179F142-V175 HydrophobicContact CB-CG1 4.21Å; F142-V175 WeakPolarHBondContact O-CG1 3.46Å; C144-V175 HydrophobicContact CB-CB 4.09Å; C144-V175 HydrophobicContact CB-CG2 3.83Å; E170-V175 HydrophobicContact CB-CG2 3.56Å; E170-V175 HydrophobicContact CG-CG2 4.47Å; G171-V175 PolarHBondContact O-N 2.98Å; G171-V175 VanDerWaalsContact O-N 3.13Å; V175-A178 PolarHBondContact O-N 3.44Å; V175-F179 WeakPolarHBondContact O-CB 3.03Å; V175-F179 PolarHBondContact O-N 2.91Å
176F92.6Very high94.5Very high65 Ų6574.3 Ų74.329%0.28539%0.387SS..Hα-helixtrans-61.9-45.7175.6-176.3-105.8000111.6I116 M120 F142 C172 A178 F179 L180I116-F176 HydrophobicContact CD1-CD1 4.39Å; I116-F176 HydrophobicContact CD1-CE1 4.08Å; I116-F176 HydrophobicContact CG2-CD1 4.44Å; M120-F176 HydrophobicContact CE-CB 4.44Å; F142-F176 HydrophobicContact CZ-CD2 4.48Å; C172-F176 WeakPolarHBondContact O-CB 3.24Å; C172-F176 PolarHBondContact O-N 2.95Å; F176-A178 PolarHBondContact O-N 2.86Å; F176-F179 WeakPolarHBondContact O-CB 3.24Å; F176-F179 PolarHBondContact O-N 3.47Å; F176-L180 HydrophobicContact CD1-CD1 4.06Å; F176-L180 HydrophobicContact CD1-CG 4.5Å; F176-L180 HydrophobicContact CE1-CD1 3.52Å; F176-L180 HydrophobicContact CE1-CG 4.15Å; F176-L180 HydrophobicContact CZ-CD1 3.92Å; F176-L180 HydrophobicContact CZ-CD2 4.31Å; F176-L180 HydrophobicContact CZ-CG 4.19Å; F176-L180 WeakPolarHBondContact O-CG 3.37Å; F176-L180 PolarHBondContact O-N 2.97Å
177G93.4Very high94.6Very high17 Ų1771.4 Ų71.418%0.17538%0.375CS..Hα-helixtrans-61.4-40.517500000113V173 S174 L180 K181V173-G177 PolarHBondContact O-N 2.86Å; S174-G177 PolarHBondContact O-N 3.43Å; G177-L180 PolarHBondContact O-N 3.4Å; G177-K181 WeakPolarHBondContact O-CG 3.31Å; G177-K181 PolarHBondContact O-N 3.28Å
178A94.3Very high94.6Very high55 Ų5570.4 Ų70.446%0.45537%0.373SS..Hα-helixtrans-66.7-39.917500000111.9S174 V175 F176 K181 R182S174-A178 WeakPolarHBondContact O-CB 3.46Å; S174-A178 PolarHBondContact O-N 3.11Å; V175-A178 PolarHBondContact O-N 3.44Å; F176-A178 PolarHBondContact O-N 2.86Å; A178-K181 PolarHBondContact O-N 2.85Å; A178-R182 VanDerWaalsContact O-CB 3.27Å; A178-R182 WeakPolarHBondContact O-CB 3.45Å; A178-R182 PolarHBondContact O-N 3.04Å
179F92Very high94.6Very high92 Ų9272.7 Ų72.740%0.40439%0.393SS..Hα-helixtrans-60.3-46.1174.9178.4-90.3000111.2F142 V175 F176 R182 N183F142-F179 HydrophobicContact CE1-CD1 4.26Å; F142-F179 HydrophobicContact CE1-CD2 4.17Å; F142-F179 HydrophobicContact CE1-CE2 4.46Å; F142-F179 HydrophobicContact CE1-CG 4.07Å; V175-F179 WeakPolarHBondContact O-CB 3.03Å; V175-F179 PolarHBondContact O-N 2.91Å; F176-F179 WeakPolarHBondContact O-CB 3.24Å; F176-F179 PolarHBondContact O-N 3.47Å; F179-R182 PolarHBondContact O-N 3.4Å; F179-N183 WeakPolarHBondContact CD2-ND2 3.39Å; F179-N183 WeakPolarHBondContact CE2-ND2 3.18Å; F179-N183 VanDerWaalsContact O-CB 3.31Å; F179-N183 WeakPolarHBondContact O-CB 3.47Å; F179-N183 PolarHBondContact O-N 3.44Å; F179-N183 PolarHBondContact O-ND2 3.44Å
180L92.1Very high94.6Very high64 Ų6472.1 Ų72.134%0.33539%0.389SS..Hα-helixtrans-63.1-43.4176.3-70.5-178.7000112.2F176 G177 N183 L184F176-L180 HydrophobicContact CD1-CD1 4.06Å; F176-L180 HydrophobicContact CD1-CG 4.5Å; F176-L180 HydrophobicContact CE1-CD1 3.52Å; F176-L180 HydrophobicContact CE1-CG 4.15Å; F176-L180 HydrophobicContact CZ-CD1 3.92Å; F176-L180 HydrophobicContact CZ-CD2 4.31Å; F176-L180 HydrophobicContact CZ-CG 4.19Å; F176-L180 WeakPolarHBondContact O-CG 3.37Å; F176-L180 PolarHBondContact O-N 2.97Å; G177-L180 PolarHBondContact O-N 3.4Å; L180-N183 CarbonylContact O-C 3.59Å; L180-N183 PolarHBondContact O-N 3.38Å; L180-L184 VanDerWaalsContact O-CA 3.31Å; L180-L184 WeakPolarHBondContact O-CA 3.32Å; L180-L184 PolarHBondContact O-N 2.87Å
181K93.1Very high94.6Very high137 Ų13769.5 Ų69.560%0.59639%0.385SS*.Hα-helixtrans-63.7-43.9177.3-73.5173.1-176173.90111.9G177 A178 L184G177-K181 WeakPolarHBondContact O-CG 3.31Å; G177-K181 PolarHBondContact O-N 3.28Å; A178-K181 PolarHBondContact O-N 2.85Å; K181-L184 WeakPolarHBondContact O-CB 3.21Å; K181-L184 PolarHBondContact O-N 3.48Å
182R94.9Very high94.5Very high217 Ų21776.9 Ų76.982%0.81942%0.417SS*.Hα-helixtrans-66.8-40.2179.4-176.4-179.7177.2-151.7-1.4112A178 F179A178-R182 VanDerWaalsContact O-CB 3.27Å; A178-R182 WeakPolarHBondContact O-CB 3.45Å; A178-R182 PolarHBondContact O-N 3.04Å; F179-R182 PolarHBondContact O-N 3.4Å
183N94.2Very high94.5Very high34 Ų3477.9 Ų77.918%0.18243%0.428CS..THydrogen-bonded Turntrans-97.517.6-178.2-61.7-71.8000112.8F179 L180 V185 I186 V187F179-N183 WeakPolarHBondContact CD2-ND2 3.39Å; F179-N183 WeakPolarHBondContact CE2-ND2 3.18Å; F179-N183 VanDerWaalsContact O-CB 3.31Å; F179-N183 WeakPolarHBondContact O-CB 3.47Å; F179-N183 PolarHBondContact O-N 3.44Å; F179-N183 PolarHBondContact O-ND2 3.44Å; L180-N183 CarbonylContact O-C 3.59Å; L180-N183 PolarHBondContact O-N 3.38Å; N183-V185 PolarHBondContact O-N 3.44Å; N183-V185 VanDerWaalsContact O-N 3.16Å; N183-I186 HydrophobicContact CB-CB 4.48Å; N183-I186 HydrophobicContact CB-CD1 4.27Å; N183-I186 WeakPolarHBondContact O-CA 3.36Å; N183-I186 WeakPolarHBondContact O-CB 3.46Å; N183-I186 PolarHBondContact O-N 2.91Å; N183-V187 PolarHBondContact O-N 2.75Å; N183-V187 VanDerWaalsContact O-N 3.07Å
184L93.8Very high94.5Very high113 Ų11379.7 Ų79.759%0.59244%0.439SS*.Hα-helixtrans-55.8-37.4-177-17865.5000111.9L180 K181 I186 V187 A188L180-L184 VanDerWaalsContact O-CA 3.31Å; L180-L184 WeakPolarHBondContact O-CA 3.32Å; L180-L184 PolarHBondContact O-N 2.87Å; K181-L184 WeakPolarHBondContact O-CB 3.21Å; K181-L184 PolarHBondContact O-N 3.48Å; L184-I186 VanDerWaalsContact C-N 3.33Å; L184-I186 PolarHBondContact O-N 2.8Å; L184-V187 PolarHBondContact O-N 3.24Å; L184-A188 WeakPolarHBondContact O-CB 3.44Å; L184-A188 PolarHBondContact O-N 3.3Å
185V95.6Very high94.6Very high107 Ų10778 Ų7865%0.64843%0.427SS*.Hα-helixtrans-61.1-42175.7177.80000111.3N183 A188 C189N183-V185 PolarHBondContact O-N 3.44Å; N183-V185 VanDerWaalsContact O-N 3.16Å; V185-A188 PolarHBondContact O-N 3.13Å; V185-C189 WeakPolarHBondContact O-CB 3.36Å; V185-C189 PolarHBondContact O-N 3.09Å; V185-C189 PolarHBondContact O-SG 3.07Å
186I96.1Very high94.6Very high102 Ų10282 Ų8252%0.52344%0.442SS..Hα-helixtrans-65.8-46.6178.8-59.4177.3000109.8N183 L184 A188 C189 V190N183-I186 HydrophobicContact CB-CB 4.48Å; N183-I186 HydrophobicContact CB-CD1 4.27Å; N183-I186 WeakPolarHBondContact O-CA 3.36Å; N183-I186 WeakPolarHBondContact O-CB 3.46Å; N183-I186 PolarHBondContact O-N 2.91Å; L184-I186 VanDerWaalsContact C-N 3.33Å; L184-I186 PolarHBondContact O-N 2.8Å; I186-A188 VanDerWaalsContact C-N 3.33Å; I186-A188 PolarHBondContact O-N 3.19Å; I186-C189 PolarHBondContact O-N 3.35Å; I186-V190 WeakPolarHBondContact O-CG2 3.5Å; I186-V190 PolarHBondContact O-N 3.25Å
187V93Very high94.7Very high74 Ų7484.6 Ų84.645%0.44845%0.453SS..Hα-helixtrans-59.3-45.6177.7177.90000110.8N183 L184 V190 A191N183-V187 PolarHBondContact O-N 2.75Å; N183-V187 VanDerWaalsContact O-N 3.07Å; L184-V187 PolarHBondContact O-N 3.24Å; V187-V190 PolarHBondContact O-N 2.94Å; V187-A191 PolarHBondContact O-N 3.13Å
188A94.1Very high94.8Very high37 Ų3784.7 Ų84.731%0.30645%0.449SS..Hα-helixtrans-62-45.8176.500000111.7L184 V185 I186 V190 A191 F192L184-A188 WeakPolarHBondContact O-CB 3.44Å; L184-A188 PolarHBondContact O-N 3.3Å; V185-A188 PolarHBondContact O-N 3.13Å; I186-A188 VanDerWaalsContact C-N 3.33Å; I186-A188 PolarHBondContact O-N 3.19Å; A188-V190 VanDerWaalsContact C-N 3.33Å; A188-V190 PolarHBondContact O-N 3.05Å; A188-A191 PolarHBondContact O-N 2.77Å; A188-F192 HydrophobicContact CB-CD2 4.4Å; A188-F192 HydrophobicContact CB-CE2 4.4Å; A188-F192 WeakPolarHBondContact O-CB 3.42Å; A188-F192 WeakPolarHBondContact O-CD2 3.38Å; A188-F192 PolarHBondContact O-N 3.08Å
189C96.4Very high94.9Very high80 Ų8086.1 Ų86.154%0.54145%0.449SS..Hα-helixtrans-59.6-41.8176.9-74.60000112.4V185 I186 G193V185-C189 WeakPolarHBondContact O-CB 3.36Å; V185-C189 PolarHBondContact O-N 3.09Å; V185-C189 PolarHBondContact O-SG 3.07Å; I186-C189 PolarHBondContact O-N 3.35Å; C189-G193 PolarHBondContact O-N 3.47Å
190V95.9Very high95Very high93 Ų9385 Ų8556%0.56445%0.447SS*.Hα-helixtrans-63.5-48.2175.7172.40000110.4I186 V187 A188 G193 V194I186-V190 WeakPolarHBondContact O-CG2 3.5Å; I186-V190 PolarHBondContact O-N 3.25Å; V187-V190 PolarHBondContact O-N 2.94Å; A188-V190 VanDerWaalsContact C-N 3.33Å; A188-V190 PolarHBondContact O-N 3.05Å; V190-G193 PolarHBondContact O-N 3.41Å; V190-V194 WeakPolarHBondContact O-CG2 3.39Å; V190-V194 PolarHBondContact O-N 2.8Å
191A94.9Very high95.1Very high52 Ų5282.8 Ų82.843%0.4344%0.436SS..Hα-helixtrans-60.3-49178.900000112.2V187 A188 G193 V194 C195V187-A191 PolarHBondContact O-N 3.13Å; A188-A191 PolarHBondContact O-N 2.77Å; A191-G193 VanDerWaalsContact C-N 3.29Å; A191-G193 PolarHBondContact O-N 3.44Å; A191-V194 PolarHBondContact O-N 2.85Å; A191-C195 PolarHBondContact O-N 2.88Å; A191-C195 PolarHBondContact O-SG 3.48Å; A191-C195 VanDerWaalsContact O-SG 3.38Å
192F96Very high95.3Very high157 Ų15777.4 Ų77.469%0.68941%0.414SS*.Hα-helixtrans-61-38.4175.3-78.4-62.4000112.3A188 C195 F196A188-F192 HydrophobicContact CB-CD2 4.4Å; A188-F192 HydrophobicContact CB-CE2 4.4Å; A188-F192 WeakPolarHBondContact O-CB 3.42Å; A188-F192 WeakPolarHBondContact O-CD2 3.38Å; A188-F192 PolarHBondContact O-N 3.08Å; F192-C195 PolarHBondContact O-N 3.35Å; F192-F196 VanDerWaalsContact O-CB 3.31Å; F192-F196 WeakPolarHBondContact O-CB 3.38Å; F192-F196 PolarHBondContact O-N 3.39Å
193G96.2Very high95.3Very high23 Ų2371.1 Ų71.124%0.23740%0.4CS..Hα-helixtrans-60.3-46.8174.900000112.1C189 V190 A191 F196 F197C189-G193 PolarHBondContact O-N 3.47Å; V190-G193 PolarHBondContact O-N 3.41Å; A191-G193 VanDerWaalsContact C-N 3.29Å; A191-G193 PolarHBondContact O-N 3.44Å; G193-F196 PolarHBondContact O-N 3.21Å; G193-F197 WeakPolarHBondContact O-CD2 3.09Å; G193-F197 PolarHBondContact O-N 3.21Å
194V95.5Very high95.3Very high62 Ų6270 Ų7038%0.37639%0.393SS..Hα-helixtrans-59.3-51.4176.6174.30000110.7E98 V190 A191 F196 F197 Q198E98-V194 VanDerWaalsContact OE1-CG1 3.26Å; E98-V194 WeakPolarHBondContact OE1-CG1 3.37Å; V190-V194 WeakPolarHBondContact O-CG2 3.39Å; V190-V194 PolarHBondContact O-N 2.8Å; A191-V194 PolarHBondContact O-N 2.85Å; V194-F196 VanDerWaalsContact C-N 3.29Å; V194-F196 PolarHBondContact O-N 2.7Å; V194-F197 PolarHBondContact O-N 3.46Å; V194-Q198 HydrophobicContact CG1-CG 4.44Å; V194-Q198 WeakPolarHBondContact O-CG 3.09Å; V194-Q198 PolarHBondContact O-N 3.33Å
195C96.9Very high95.3Very high24 Ų2464.7 Ų64.716%0.16237%0.366CS..Hα-helixtrans-59.6-39.4178.4-60.90000112.2L95 E98 A191 F192 Q198 L199L95-C195 HydrophobicContact CD1-CB 3.73Å; E98-C195 PolarHBondContact OE2-SG 2.67Å; A191-C195 PolarHBondContact O-N 2.88Å; A191-C195 PolarHBondContact O-SG 3.48Å; A191-C195 VanDerWaalsContact O-SG 3.38Å; F192-C195 PolarHBondContact O-N 3.35Å; C195-Q198 PolarHBondContact O-N 3.1Å; C195-L199 WeakPolarHBondContact O-CG 3.38Å; C195-L199 PolarHBondContact O-N 3.34Å
196F95.7Very high95.2Very high117 Ų11761.5 Ų61.551%0.51335%0.348SS..Hα-helixtrans-63.9-46.5176.9177.1-101.1000112.2F192 G193 V194 Q198 L199 L200F192-F196 VanDerWaalsContact O-CB 3.31Å; F192-F196 WeakPolarHBondContact O-CB 3.38Å; F192-F196 PolarHBondContact O-N 3.39Å; G193-F196 PolarHBondContact O-N 3.21Å; V194-F196 VanDerWaalsContact C-N 3.29Å; V194-F196 PolarHBondContact O-N 2.7Å; F196-Q198 VanDerWaalsContact C-N 3.32Å; F196-Q198 PolarHBondContact O-N 2.71Å; F196-L199 PolarHBondContact O-N 3.34Å; F196-L200 HydrophobicContact CD1-CD1 3.96Å; F196-L200 HydrophobicContact CD1-CG 4.45Å; F196-L200 HydrophobicContact CE1-CD1 3.34Å; F196-L200 HydrophobicContact CE1-CG 4.05Å; F196-L200 HydrophobicContact CE2-CD1 4.49Å; F196-L200 HydrophobicContact CE2-CG 4.43Å; F196-L200 HydrophobicContact CZ-CD1 3.65Å; F196-L200 HydrophobicContact CZ-CD2 4.3Å; F196-L200 HydrophobicContact CZ-CG 4.04Å; F196-L200 WeakPolarHBondContact O-CG 3.23Å; F196-L200 PolarHBondContact O-N 3.46Å
197F93.8Very high95.1Very high120 Ų12058.8 Ų58.853%0.52634%0.337SS..Hα-helixtrans-66.1-33.5177-75.9-62000112.7G193 V194 L200 S201G193-F197 WeakPolarHBondContact O-CD2 3.09Å; G193-F197 PolarHBondContact O-N 3.21Å; V194-F197 PolarHBondContact O-N 3.46Å; F197-L200 HydrophobicContact CD1-CD1 4.48Å; F197-S201 WeakPolarHBondContact O-CB 3.41Å; F197-S201 PolarHBondContact O-N 2.87Å; F197-S201 PolarHBondContact O-OG 3Å
198Q96.4Very high95Very high18 Ų1855.9 Ų55.98%0.08432%0.319CS..Hα-helixtrans-63.4-49171.8-72.6177.6-13.200111.3L91 E98 V194 C195 F196 L200 S201 I202L91-Q198 HydrophobicContact CD2-CG 4.31Å; E98-Q198 PolarHBondContact OE1-NE2 3.3Å; E98-Q198 PolarHBondContact OE2-OE1 2.86Å; E98-Q198 VanDerWaalsContact OE2-OE1 3.13Å; V194-Q198 HydrophobicContact CG1-CG 4.44Å; V194-Q198 WeakPolarHBondContact O-CG 3.09Å; V194-Q198 PolarHBondContact O-N 3.33Å; C195-Q198 PolarHBondContact O-N 3.1Å; F196-Q198 VanDerWaalsContact C-N 3.32Å; F196-Q198 PolarHBondContact O-N 2.71Å; Q198-L200 VanDerWaalsContact C-N 3.34Å; Q198-L200 PolarHBondContact O-N 3.3Å; Q198-S201 PolarHBondContact O-N 3.18Å; Q198-S201 VanDerWaalsContact O-N 3.14Å; Q198-I202 WeakPolarHBondContact O-CD1 3.08Å; Q198-I202 VanDerWaalsContact O-CG1 3.25Å; Q198-I202 WeakPolarHBondContact O-CG1 3.35Å; Q198-I202 PolarHBondContact O-N 3.44Å
199L96.3Very high95Very high86 Ų8654.1 Ų54.145%0.4530%0.304SS..Hα-helixtrans-58.4-45177.1-75.4172.1000111.9L95 C195 F196 S201 I202 V203L95-L199 HydrophobicContact CD2-CD2 3.68Å; L95-L199 HydrophobicContact CD2-CG 4.21Å; C195-L199 WeakPolarHBondContact O-CG 3.38Å; C195-L199 PolarHBondContact O-N 3.34Å; F196-L199 PolarHBondContact O-N 3.34Å; L199-S201 VanDerWaalsContact C-N 3.34Å; L199-S201 PolarHBondContact O-N 3.08Å; L199-I202 PolarHBondContact O-N 3.04Å; L199-V203 WeakPolarHBondContact O-CG2 3.23Å; L199-V203 PolarHBondContact O-N 2.87Å
200L93.9Very high94.8Very high69 Ų6958.4 Ų58.436%0.36131%0.309SS..Hα-helixtrans-59.1-46.1174.5-74.3-176.7000111.7F196 F197 Q198 I202 V203 I204F196-L200 HydrophobicContact CD1-CD1 3.96Å; F196-L200 HydrophobicContact CD1-CG 4.45Å; F196-L200 HydrophobicContact CE1-CD1 3.34Å; F196-L200 HydrophobicContact CE1-CG 4.05Å; F196-L200 HydrophobicContact CE2-CD1 4.49Å; F196-L200 HydrophobicContact CE2-CG 4.43Å; F196-L200 HydrophobicContact CZ-CD1 3.65Å; F196-L200 HydrophobicContact CZ-CD2 4.3Å; F196-L200 HydrophobicContact CZ-CG 4.04Å; F196-L200 WeakPolarHBondContact O-CG 3.23Å; F196-L200 PolarHBondContact O-N 3.46Å; F197-L200 HydrophobicContact CD1-CD1 4.48Å; Q198-L200 VanDerWaalsContact C-N 3.34Å; Q198-L200 PolarHBondContact O-N 3.3Å; L200-I202 VanDerWaalsContact C-N 3.35Å; L200-I202 PolarHBondContact O-N 2.04Å; L200-V203 PolarHBondContact O-N 3.29Å; L200-I204 WeakPolarHBondContact O-CB 3.48Å; L200-I204 WeakPolarHBondContact O-CD1 3.27Å; L200-I204 VanDerWaalsContact O-CG1 3.24Å; L200-I204 WeakPolarHBondContact O-CG1 3.35Å; L200-I204 PolarHBondContact O-N 3.43Å
201S95.1Very high94.5Very high17 Ų1757 Ų5712%0.11930%0.297CS..Hα-helixtrans-64.6-38.1179.9-60.10000112.2Y87 L91 F197 Q198 L199 A205Y87-S201 WeakPolarHBondContact OH-CB 3.34Å; L91-S201 VanDerWaalsContact CD1-CB 3.5Å; F197-S201 WeakPolarHBondContact O-CB 3.41Å; F197-S201 PolarHBondContact O-N 2.87Å; F197-S201 PolarHBondContact O-OG 3Å; Q198-S201 PolarHBondContact O-N 3.18Å; Q198-S201 VanDerWaalsContact O-N 3.14Å; L199-S201 VanDerWaalsContact C-N 3.34Å; L199-S201 PolarHBondContact O-N 3.08Å; S201-A205 WeakPolarHBondContact O-CB 3.47Å; S201-A205 PolarHBondContact O-N 3.02Å
202I96.4Very high94.3Very high23 Ų2355.8 Ų55.812%0.11828%0.283CS..Hα-helixtrans-62.2-49.3173.7-68.5159.8000110.4L91 V92 Q198 L199 L200 I204 A205 C206L91-I202 HydrophobicContact CB-CD1 3.85Å; L91-I202 HydrophobicContact CB-CG1 3.52Å; L91-I202 HydrophobicContact CD1-CG1 3.93Å; L91-I202 HydrophobicContact CG-CG1 4.42Å; V92-I202 HydrophobicContact CG2-CD1 3.77Å; V92-I202 HydrophobicContact CG2-CG1 4.27Å; V92-I202 HydrophobicContact CG2-CG2 4.3Å; Q198-I202 WeakPolarHBondContact O-CD1 3.08Å; Q198-I202 VanDerWaalsContact O-CG1 3.25Å; Q198-I202 WeakPolarHBondContact O-CG1 3.35Å; Q198-I202 PolarHBondContact O-N 3.44Å; L199-I202 PolarHBondContact O-N 3.04Å; L200-I202 VanDerWaalsContact C-N 3.35Å; L200-I202 PolarHBondContact O-N 2.04Å; I202-I204 PolarHBondContact O-N 3.36Å; I202-A205 PolarHBondContact O-N 2.83Å; I202-C206 WeakPolarHBondContact O-CB 3.3Å; I202-C206 PolarHBondContact O-N 3.23Å; I202-C206 PolarHBondContact O-SG 2.86Å
203V94.9Very high94.2Very high86 Ų8653.5 Ų53.552%0.52127%0.273SS..Hα-helixtrans-60.9-47.7179.8171.70000110.4L199 L200 A205 C206 C207L199-V203 WeakPolarHBondContact O-CG2 3.23Å; L199-V203 PolarHBondContact O-N 2.87Å; L200-V203 PolarHBondContact O-N 3.29Å; V203-A205 PolarHBondContact O-N 3.24Å; V203-C206 PolarHBondContact O-N 3.14Å; V203-C207 WeakPolarHBondContact O-CB 3.46Å; V203-C207 PolarHBondContact O-N 2.86Å; V203-C207 PolarHBondContact O-SG 3.4Å
204I93.4Very high94Very high10 Ų1058.5 Ų58.55%0.05129%0.29CS..Hα-helixtrans-62.5-45.5179.5-67.8161.5000110.8L11 V15 L200 I202 C206 C207 L208L11-I204 HydrophobicContact CB-CD1 3.82Å; L11-I204 HydrophobicContact CB-CG1 4.25Å; L11-I204 HydrophobicContact CD1-CD1 4.32Å; L11-I204 HydrophobicContact CD1-CG1 4.4Å; L11-I204 HydrophobicContact CD2-CD1 4.16Å; L11-I204 HydrophobicContact CG-CD1 4.32Å; V15-I204 HydrophobicContact CG2-CB 4.43Å; V15-I204 HydrophobicContact CG2-CD1 3.52Å; V15-I204 HydrophobicContact CG2-CG2 4.19Å; L200-I204 WeakPolarHBondContact O-CB 3.48Å; L200-I204 WeakPolarHBondContact O-CD1 3.27Å; L200-I204 VanDerWaalsContact O-CG1 3.24Å; L200-I204 WeakPolarHBondContact O-CG1 3.35Å; L200-I204 PolarHBondContact O-N 3.43Å; I202-I204 PolarHBondContact O-N 3.36Å; I204-C206 PolarHBondContact O-N 3.4Å; I204-C207 PolarHBondContact O-N 3.29Å; I204-L208 HydrophobicContact CG2-CD1 3.71Å; I204-L208 HydrophobicContact CG2-CG 4.23Å; I204-L208 VanDerWaalsContact O-CB 3.31Å; I204-L208 WeakPolarHBondContact O-CB 3.14Å; I204-L208 VanDerWaalsContact O-CG 3.29Å; I204-L208 WeakPolarHBondContact O-CG 3.33Å; I204-L208 PolarHBondContact O-N 2.93Å
205A94.7Very high93.5Very high1 Ų162.8 Ų62.81%0.00830%0.3CS..Hα-helixtrans-60.4-46.3177.300000111.9L84 Y87 A88 S201 I202 V203 G209L84-A205 HydrophobicContact CD1-CB 3.66Å; L84-A205 WeakPolarHBondContact CD2-O 3.11Å; L84-A205 HydrophobicContact CG-CB 3.88Å; L84-A205 WeakPolarHBondContact CG-O 3.26Å; Y87-A205 HydrophobicContact CD1-CB 3.71Å; Y87-A205 HydrophobicContact CE1-CB 4.03Å; A88-A205 HydrophobicContact CB-CB 4.08Å; S201-A205 WeakPolarHBondContact O-CB 3.47Å; S201-A205 PolarHBondContact O-N 3.02Å; I202-A205 PolarHBondContact O-N 2.83Å; V203-A205 PolarHBondContact O-N 3.24Å; A205-G209 PolarHBondContact O-N 2.97Å
206C94.6Very high93.1Very high41 Ų4167.6 Ų67.628%0.27732%0.32SS..Hα-helixtrans-63.8-43.3176.9-730000112.3I202 V203 I204 G209 R210I202-C206 WeakPolarHBondContact O-CB 3.3Å; I202-C206 PolarHBondContact O-N 3.23Å; I202-C206 PolarHBondContact O-SG 2.86Å; V203-C206 PolarHBondContact O-N 3.14Å; I204-C206 PolarHBondContact O-N 3.4Å; C206-G209 PolarHBondContact O-N 3.13Å; C206-R210 WeakPolarHBondContact O-CG 3.47Å; C206-R210 PolarHBondContact O-N 3.35Å
207C92.7Very high92.7Very high45 Ų4568 Ų6830%0.30433%0.328SS..Hα-helixtrans-63.4-49.1177.8-74.20000111.9M8 V203 I204 G209 R210 Q211M8-C207 HydrophobicContact CE-CB 3.86Å; V203-C207 WeakPolarHBondContact O-CB 3.46Å; V203-C207 PolarHBondContact O-N 2.86Å; V203-C207 PolarHBondContact O-SG 3.4Å; I204-C207 PolarHBondContact O-N 3.29Å; C207-G209 VanDerWaalsContact C-N 3.34Å; C207-G209 PolarHBondContact O-N 3.36Å; C207-R210 PolarHBondContact O-N 2.86Å; C207-Q211 WeakPolarHBondContact O-CG 3.41Å; C207-Q211 PolarHBondContact O-N 3.11Å; C207-Q211 VanDerWaalsContact O-N 3.07Å
208L91.4Very high91.9Very high12 Ų1270.8 Ų70.86%0.06335%0.354CS..Hα-helixtrans-62.1-42.2177.4-73.8175.6000111.2L4 M8 K12 L84 I204 R210 Q211 I212L4-L208 HydrophobicContact CD2-CD2 4.04Å; M8-L208 HydrophobicContact CG-CD2 4.24Å; M8-L208 HydrophobicContact SD-CD2 4.49Å; K12-L208 HydrophobicContact CB-CD1 4.06Å; K12-L208 HydrophobicContact CB-CD2 4.5Å; K12-L208 HydrophobicContact CD-CD1 4.15Å; K12-L208 HydrophobicContact CD-CD2 4.13Å; K12-L208 HydrophobicContact CG-CD1 3.84Å; L84-L208 HydrophobicContact CD2-CB 3.65Å; I204-L208 HydrophobicContact CG2-CD1 3.71Å; I204-L208 HydrophobicContact CG2-CG 4.23Å; I204-L208 VanDerWaalsContact O-CB 3.31Å; I204-L208 WeakPolarHBondContact O-CB 3.14Å; I204-L208 VanDerWaalsContact O-CG 3.29Å; I204-L208 WeakPolarHBondContact O-CG 3.33Å; I204-L208 PolarHBondContact O-N 2.93Å; L208-R210 PolarHBondContact O-N 3.49Å; L208-Q211 PolarHBondContact O-N 2.97Å; L208-I212 WeakPolarHBondContact O-CD1 3.12Å; L208-I212 VanDerWaalsContact O-CG1 3.29Å; L208-I212 WeakPolarHBondContact O-CG1 3.43Å; L208-I212 PolarHBondContact O-N 2.05Å
209G92.9Very high91.7Very high0 Ų073.5 Ų73.50%037%0.368CS..Hα-helixtrans-63.7-38.9178.600000113.1A205 C206 C207 K213A205-G209 PolarHBondContact O-N 2.97Å; C206-G209 PolarHBondContact O-N 3.13Å; C207-G209 VanDerWaalsContact C-N 3.34Å; C207-G209 PolarHBondContact O-N 3.36Å; G209-K213 WeakPolarHBondContact O-CB 3Å; G209-K213 PolarHBondContact O-N 2.82Å; G209-K213 VanDerWaalsContact O-N 3.16Å
210R92.7Very high91.5Very high170 Ų17072.8 Ų72.864%0.64236%0.363SS*.Hα-helixtrans-65-46.1173.9-75.2179.8-179.6-175.11.2112Y85 C206 C207 L208 I212 K213 E214Y85-R210 PolarHBondContact OH-N 2.93Å; C206-R210 WeakPolarHBondContact O-CG 3.47Å; C206-R210 PolarHBondContact O-N 3.35Å; C207-R210 PolarHBondContact O-N 2.86Å; L208-R210 PolarHBondContact O-N 3.49Å; R210-I212 PolarHBondContact O-N 2.94Å; R210-K213 PolarHBondContact O-N 2.83Å; R210-E214 WeakPolarHBondContact O-CG 3.41Å; R210-E214 PolarHBondContact O-N 2.62Å
211Q90.3Very high91.3Very high64 Ų6473 Ų7330%0.29936%0.364SS..Hα-helixtrans-63-42.5-179.1-74.9-177.9-13.900112.8C207 L208 E214 Y215C207-Q211 WeakPolarHBondContact O-CG 3.41Å; C207-Q211 PolarHBondContact O-N 3.11Å; C207-Q211 VanDerWaalsContact O-N 3.07Å; L208-Q211 PolarHBondContact O-N 2.97Å; Q211-E214 PolarHBondContact O-N 2.98Å; Q211-Y215 PolarHBondContact O-N 3.31Å
212I90.8Very high91.1Very high26 Ų2676.3 Ų76.313%0.13338%0.378CS..Hα-helixtrans-63.6-45.4177.1-64.5160.3000109.9E79 V81 L208 R210 E214 Y215 E216E79-I212 HydrophobicContact CB-CD1 3.86Å; E79-I212 HydrophobicContact CB-CG1 4.39Å; E79-I212 HydrophobicContact CG-CD1 4.47Å; E79-I212 WeakPolarHBondContact O-CG2 3.46Å; V81-I212 HydrophobicContact CG2-CB 3.68Å; V81-I212 HydrophobicContact CG2-CG2 3.41Å; V81-I212 VanDerWaalsContact CG2-CG2 3.41Å; L208-I212 WeakPolarHBondContact O-CD1 3.12Å; L208-I212 VanDerWaalsContact O-CG1 3.29Å; L208-I212 WeakPolarHBondContact O-CG1 3.43Å; L208-I212 PolarHBondContact O-N 2.05Å; R210-I212 PolarHBondContact O-N 2.94Å; I212-E214 VanDerWaalsContact C-N 3.35Å; I212-E214 PolarHBondContact O-N 3.41Å; I212-Y215 WeakPolarHBondContact O-CB 2.95Å; I212-Y215 PolarHBondContact O-N 3.03Å; I212-Y215 VanDerWaalsContact O-N 3.14Å; I212-E216 WeakPolarHBondContact O-CG 3.2Å; I212-E216 PolarHBondContact O-N 3.06Å
213K92.6Very high90.8Very high110 Ų11079.6 Ų79.648%0.47839%0.394SS..Hα-helixtrans-62.7-39178.2-171.5174.9-177.8177.30112.8V81 G209 R210 Y215 E216 N217V81-K213 HydrophobicContact CG1-CB 4.41Å; V81-K213 HydrophobicContact CG2-CB 4.39Å; G209-K213 WeakPolarHBondContact O-CB 3Å; G209-K213 PolarHBondContact O-N 2.82Å; G209-K213 VanDerWaalsContact O-N 3.16Å; R210-K213 PolarHBondContact O-N 2.83Å; K213-Y215 VanDerWaalsContact C-N 3.33Å; K213-E216 PolarHBondContact O-N 3.21Å; K213-N217 VanDerWaalsContact O-CG 3.28Å; K213-N217 PolarHBondContact O-N 3.23Å; K213-N217 PolarHBondContact O-ND2 3.48Å
214E92.2Very high90.5Very high127 Ų12779.2 Ų79.259%0.59339%0.386SS*.Hα-helixtrans-62.8-40.7174-77.5172.7-174.900111.5R210 Q211 I212 E216 N217 V218R210-E214 WeakPolarHBondContact O-CG 3.41Å; R210-E214 PolarHBondContact O-N 2.62Å; Q211-E214 PolarHBondContact O-N 2.98Å; I212-E214 VanDerWaalsContact C-N 3.35Å; I212-E214 PolarHBondContact O-N 3.41Å; E214-E216 VanDerWaalsContact C-N 3.34Å; E214-E216 PolarHBondContact O-N 2.9Å; E214-N217 PolarHBondContact O-N 2.82Å; E214-V218 WeakPolarHBondContact O-CG2 3.43Å
215Y86.2Confident90.3Very high153 Ų15384.1 Ų84.160%0.641%0.41SS*.Hα-helixtrans-65.7-34.5176.5-176.2-97.4000113.1Q211 I212 K213 N217Q211-Y215 PolarHBondContact O-N 3.31Å; I212-Y215 WeakPolarHBondContact O-CB 2.95Å; I212-Y215 PolarHBondContact O-N 3.03Å; I212-Y215 VanDerWaalsContact O-N 3.14Å; K213-Y215 VanDerWaalsContact C-N 3.33Å; Y215-N217 VanDerWaalsContact C-N 3.3Å; Y215-N217 PolarHBondContact O-N 3.05Å
216E88.1Confident90Very high125 Ų12590.5 Ų90.558%0.58444%0.441SS*.Hα-helixtrans-70.2-23.9175.2-70.8175.1159.500113.6I212 K213 E214I212-E216 WeakPolarHBondContact O-CG 3.2Å; I212-E216 PolarHBondContact O-N 3.06Å; K213-E216 PolarHBondContact O-N 3.21Å; E214-E216 VanDerWaalsContact C-N 3.34Å; E214-E216 PolarHBondContact O-N 2.9Å
217N86.6Confident89.6Confident125 Ų12594.7 Ų94.767%0.66845%0.454SS*.THydrogen-bonded Turntrans-89.1-1-178.9-66.5-41.2000113.8K213 E214 Y215K213-N217 VanDerWaalsContact O-CG 3.28Å; K213-N217 PolarHBondContact O-N 3.23Å; K213-N217 PolarHBondContact O-ND2 3.48Å; E214-N217 PolarHBondContact O-N 2.82Å; Y215-N217 VanDerWaalsContact C-N 3.3Å; Y215-N217 PolarHBondContact O-N 3.05Å
218V78.5Confident89.3Confident179 Ų17999.2 Ų99.2100%1.08547%0.468SS*.  trans-103.70177.4177.70000109.6E214E214-V218 WeakPolarHBondContact O-CG2 3.43Å

Retrieved 218 of 218 residues in 68.9 ms (Link to these results)

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