A0A5K4EZH9_SCHMA Loading...

Etoposide-induced protein 2.4

AlphaFold DB , UniProt , Accession A0A5K4EZH9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 426 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
1M61.3Low80.7Confident154 Ų15459.5 Ų59.576%0.75930%0.296SS*.  0-34.60-94172.315400114S3 L4 K5 D373M1-S3 PolarHBondContact O-N 3.05Å; M1-L4 PolarHBondContact O-N 3.14Å; M1-K5 PolarHBondContact O-N 3.41Å; M1-D373 PolarHBondContact N-O 2.88Å
2G74.8Confident81.3Confident18 Ų1863.4 Ų63.419%0.18631%0.313CS..Hα-helixtrans-56-44.8-176.500000114.5L4 K5 C6G2-L4 VanDerWaalsContact C-N 3.34Å; G2-L4 PolarHBondContact O-N 2.96Å; G2-K5 WeakPolarHBondContact O-CB 3.42Å; G2-K5 PolarHBondContact O-N 3.34Å; G2-C6 PolarHBondContact O-N 3.01Å
3S78.2Confident81.5Confident3 Ų359.9 Ų59.92%0.02130%0.295CS..Hα-helixtrans-59.4-40.8-179.2-147.60000113.3M1 C6 F7 T319 E374M1-S3 PolarHBondContact O-N 3.05Å; S3-C6 PolarHBondContact O-N 3.44Å; S3-F7 PolarHBondContact O-N 3.12Å; S3-T319 PolarHBondContact O-OG1 3.41Å; S3-T319 WeakPolarHBondContact OG-CG2 3.36Å; S3-E374 WeakPolarHBondContact CB-OE1 3.35Å; S3-E374 PolarHBondContact OG-OE1 3.1Å
4L81Confident81.8Confident75 Ų7558.3 Ų58.339%0.39329%0.286SS..Hα-helixtrans-67.2-38.4175.3-175.270.4000111.7M1 G2 F7 I8M1-L4 PolarHBondContact O-N 3.14Å; G2-L4 VanDerWaalsContact C-N 3.34Å; G2-L4 PolarHBondContact O-N 2.96Å; L4-F7 PolarHBondContact O-N 3.16Å; L4-I8 HydrophobicContact CD1-CD1 4.4Å; L4-I8 HydrophobicContact CD2-CD1 4.39Å; L4-I8 HydrophobicContact CG-CD1 3.91Å; L4-I8 HydrophobicContact CG-CG1 4.47Å; L4-I8 WeakPolarHBondContact O-CB 2.8Å; L4-I8 VanDerWaalsContact O-CG1 3.27Å; L4-I8 WeakPolarHBondContact O-CG1 3.32Å; L4-I8 PolarHBondContact O-N 3.29Å
5K82.9Confident82Confident138 Ų13861.3 Ų61.360%0.630%0.303SS*.Hα-helixtrans-61.9-45.1174.5-72.3-176.9175.8-178.80111M1 G2 F7 I8 L9M1-K5 PolarHBondContact O-N 3.41Å; G2-K5 WeakPolarHBondContact O-CB 3.42Å; G2-K5 PolarHBondContact O-N 3.34Å; K5-F7 VanDerWaalsContact C-N 3.34Å; K5-F7 PolarHBondContact O-N 2.91Å; K5-I8 PolarHBondContact O-N 3.35Å; K5-L9 WeakPolarHBondContact O-CB 3.31Å; K5-L9 VanDerWaalsContact O-CG 3.23Å; K5-L9 WeakPolarHBondContact O-CG 3.49Å; K5-L9 PolarHBondContact O-N 3.29Å
6C82.8Confident82.2Confident5 Ų560 Ų603%0.03430%0.299CS..Hα-helixtrans-62.8-40.5177.2-680000112.3G2 S3 L9 G10 T319 Y320 I369G2-C6 PolarHBondContact O-N 3.01Å; S3-C6 PolarHBondContact O-N 3.44Å; C6-L9 PolarHBondContact O-N 2.85Å; C6-G10 PolarHBondContact O-N 3.41Å; C6-T319 WeakPolarHBondContact CB-OG1 3.04Å; C6-Y320 WeakPolarHBondContact O-CA 3.43Å; C6-I369 HydrophobicContact CB-CD1 4.24Å
7F85.2Confident82.2Confident40 Ų4056.5 Ų56.518%0.17528%0.282CS..Hα-helixtrans-60.2-50172.8176.8-94.6000112.5S3 L4 K5 L9 G10 F11 T319 L322 L326S3-F7 PolarHBondContact O-N 3.12Å; L4-F7 PolarHBondContact O-N 3.16Å; K5-F7 VanDerWaalsContact C-N 3.34Å; K5-F7 PolarHBondContact O-N 2.91Å; F7-L9 VanDerWaalsContact C-N 3.3Å; F7-L9 PolarHBondContact O-N 3.32Å; F7-G10 PolarHBondContact O-N 3.05Å; F7-F11 PolarHBondContact O-N 3.38Å; F7-T319 WeakPolarHBondContact CA-O 3.19Å; F7-L322 HydrophobicContact CD2-CD2 4.41Å; F7-L322 HydrophobicContact CD2-CG 4.47Å; F7-L322 HydrophobicContact CE2-CD2 4.26Å; F7-L322 HydrophobicContact CE2-CG 4.18Å; F7-L326 HydrophobicContact CE2-CD1 4.02Å; F7-L326 HydrophobicContact CZ-CD1 3.87Å; F7-L326 HydrophobicContact CZ-CD2 3.92Å; F7-L326 HydrophobicContact CZ-CG 4.37Å
8I86.1Confident82.1Confident87 Ų8757.6 Ų57.645%0.44629%0.294SS..Hα-helixtrans-62.5-39178.5-68.2167.7000110.8L4 K5 F11 Q12L4-I8 HydrophobicContact CD1-CD1 4.4Å; L4-I8 HydrophobicContact CD2-CD1 4.39Å; L4-I8 HydrophobicContact CG-CD1 3.91Å; L4-I8 HydrophobicContact CG-CG1 4.47Å; L4-I8 WeakPolarHBondContact O-CB 2.8Å; L4-I8 VanDerWaalsContact O-CG1 3.27Å; L4-I8 WeakPolarHBondContact O-CG1 3.32Å; L4-I8 PolarHBondContact O-N 3.29Å; K5-I8 PolarHBondContact O-N 3.35Å; I8-F11 PolarHBondContact O-N 3.38Å; I8-Q12 VanDerWaalsContact O-CB 3.32Å; I8-Q12 WeakPolarHBondContact O-CB 3.5Å; I8-Q12 PolarHBondContact O-N 3.41Å
9L85.8Confident82.1Confident61 Ų6157.8 Ų57.832%0.31930%0.301SS..Hα-helixtrans-61.1-46.9175.3-75.8169.8000111.3K5 C6 F7 F11 Q12 E13 Y320 F365K5-L9 WeakPolarHBondContact O-CB 3.31Å; K5-L9 VanDerWaalsContact O-CG 3.23Å; K5-L9 WeakPolarHBondContact O-CG 3.49Å; K5-L9 PolarHBondContact O-N 3.29Å; C6-L9 PolarHBondContact O-N 2.85Å; F7-L9 VanDerWaalsContact C-N 3.3Å; F7-L9 PolarHBondContact O-N 3.32Å; L9-F11 VanDerWaalsContact C-N 3.32Å; L9-F11 PolarHBondContact O-N 3.09Å; L9-Q12 PolarHBondContact O-N 2.78Å; L9-E13 WeakPolarHBondContact O-CB 3.39Å; L9-E13 VanDerWaalsContact O-CG 3.26Å; L9-E13 WeakPolarHBondContact O-CG 3.46Å; L9-E13 PolarHBondContact O-N 3.37Å; L9-Y320 HydrophobicContact CB-CD2 4.46Å; L9-F365 HydrophobicContact CD1-CZ 4.48Å
10G83Confident81.9Confident0 Ų057.5 Ų57.50%030%0.296CS..Hα-helixtrans-56.8-47174.900000111.7C6 F7 Q12 E13 F14 Y320 Y324C6-G10 PolarHBondContact O-N 3.41Å; F7-G10 PolarHBondContact O-N 3.05Å; G10-Q12 PolarHBondContact O-N 3.05Å; G10-E13 PolarHBondContact O-N 3.31Å; G10-F14 PolarHBondContact O-N 3.47Å; G10-Y320 VanDerWaalsContact CA-CD2 3.48Å; G10-Y324 WeakPolarHBondContact O-CA 3.37Å; G10-Y324 WeakPolarHBondContact O-CD2 3.36Å
11F86.9Confident81.7Confident73 Ų7355.6 Ų55.632%0.3229%0.286SS..Hα-helixtrans-63.3-43177.9-176.2-105.9000113F7 I8 L9 E13 F14 L15 G323 L326 P327F7-F11 PolarHBondContact O-N 3.38Å; I8-F11 PolarHBondContact O-N 3.38Å; L9-F11 VanDerWaalsContact C-N 3.32Å; L9-F11 PolarHBondContact O-N 3.09Å; F11-E13 VanDerWaalsContact C-N 3.31Å; F11-E13 PolarHBondContact O-N 3.43Å; F11-F14 WeakPolarHBondContact O-CB 3.31Å; F11-F14 PolarHBondContact O-N 3.42Å; F11-L15 HydrophobicContact CD1-CD1 3.94Å; F11-L15 HydrophobicContact CD1-CG 4.43Å; F11-L15 HydrophobicContact CE1-CD1 3.45Å; F11-L15 VanDerWaalsContact CE1-CD1 3.45Å; F11-L15 HydrophobicContact CE1-CG 4.1Å; F11-L15 HydrophobicContact CZ-CD1 3.96Å; F11-L15 HydrophobicContact CZ-CD2 4.38Å; F11-L15 HydrophobicContact CZ-CG 4.26Å; F11-L15 PolarHBondContact O-N 3.15Å; F11-G323 WeakPolarHBondContact CA-O 3.49Å; F11-G323 PolarHBondContact N-O 2.77Å; F11-L326 HydrophobicContact CD2-CD2 4.08Å; F11-L326 HydrophobicContact CE2-CD2 4.13Å; F11-P327 HydrophobicContact CD2-CG 4.11Å; F11-P327 HydrophobicContact CE2-CG 3.83Å
12Q87.3Confident82.6Confident107 Ų10756.3 Ų56.350%0.528%0.281SS..Hα-helixtrans-63.3-37.9175.6-175.6-178.1-5.300111.7I8 L9 G10 F14 L15 T16I8-Q12 VanDerWaalsContact O-CB 3.32Å; I8-Q12 WeakPolarHBondContact O-CB 3.5Å; I8-Q12 PolarHBondContact O-N 3.41Å; L9-Q12 PolarHBondContact O-N 2.78Å; G10-Q12 PolarHBondContact O-N 3.05Å; Q12-F14 VanDerWaalsContact C-N 3.33Å; Q12-L15 PolarHBondContact O-N 2.9Å; Q12-T16 WeakPolarHBondContact O-CG2 3.29Å; Q12-T16 PolarHBondContact O-N 3.35Å; Q12-T16 PolarHBondContact O-OG1 3.14Å; Q12-T16 VanDerWaalsContact O-OG1 3.06Å
13E84.9Confident82.8Confident18 Ų1862.7 Ų62.78%0.08430%0.299CS..Hα-helixtrans-66.6-35.3175.3-69.7-136.2106.700112.3L9 G10 F11 T16 T17 R20 Y320 Y324 S360L9-E13 WeakPolarHBondContact O-CB 3.39Å; L9-E13 VanDerWaalsContact O-CG 3.26Å; L9-E13 WeakPolarHBondContact O-CG 3.46Å; L9-E13 PolarHBondContact O-N 3.37Å; G10-E13 PolarHBondContact O-N 3.31Å; F11-E13 VanDerWaalsContact C-N 3.31Å; F11-E13 PolarHBondContact O-N 3.43Å; E13-T16 WeakPolarHBondContact CA-OG1 3.42Å; E13-T16 PolarHBondContact O-OG1 2.91Å; E13-T16 VanDerWaalsContact O-OG1 3.14Å; E13-T17 PolarHBondContact O-N 3.32Å; E13-T17 PolarHBondContact O-OG1 3.38Å; E13-R20 IonicContact OE1-CZ 3.31Å; E13-R20 IonicContact OE1-NH1 3.35Å; E13-R20 PolarHBondContact OE1-NH1 3.22Å; E13-R20 IonicContact OE1-NH2 2.92Å; E13-R20 PolarHBondContact OE1-NH2 3.48Å; E13-Y320 HydrophobicContact CG-CE2 4.34Å; E13-Y320 WeakPolarHBondContact OE2-CE2 3.34Å; E13-Y320 PolarHBondContact OE2-OH 2.88Å; E13-Y324 HydrophobicContact CB-CD2 4.13Å; E13-Y324 HydrophobicContact CB-CE2 4.18Å; E13-S360 WeakPolarHBondContact OE2-CB 3.49Å
14F85Confident82.5Confident37 Ų3764.6 Ų64.616%0.16231%0.308CS..Hα-helixtrans-62.8-50.7169.9177.8-84.5000111.2G10 F11 Q12 T16 T17 Y324 P327 L328 L353G10-F14 PolarHBondContact O-N 3.47Å; F11-F14 WeakPolarHBondContact O-CB 3.31Å; F11-F14 PolarHBondContact O-N 3.42Å; Q12-F14 VanDerWaalsContact C-N 3.33Å; F14-T16 PolarHBondContact O-N 2.99Å; F14-T17 WeakPolarHBondContact O-CB 3.43Å; F14-T17 PolarHBondContact O-N 3.29Å; F14-T17 PolarHBondContact O-OG1 3.41Å; F14-Y324 HydrophobicContact CB-CD2 4.01Å; F14-Y324 HydrophobicContact CB-CE2 4.12Å; F14-Y324 VanDerWaalsContact CD2-O 3.24Å; F14-Y324 WeakPolarHBondContact CD2-O 3.31Å; F14-P327 HydrophobicContact CD1-CB 4.02Å; F14-P327 HydrophobicContact CD1-CG 3.44Å; F14-P327 VanDerWaalsContact CD1-CG 3.44Å; F14-P327 HydrophobicContact CD2-CG 4.34Å; F14-P327 HydrophobicContact CE1-CB 3.49Å; F14-P327 VanDerWaalsContact CE1-CB 3.49Å; F14-P327 HydrophobicContact CE1-CG 3.48Å; F14-P327 VanDerWaalsContact CE1-CG 3.48Å; F14-P327 HydrophobicContact CE2-CB 4.27Å; F14-P327 HydrophobicContact CE2-CG 4.38Å; F14-P327 HydrophobicContact CG-CG 3.89Å; F14-P327 HydrophobicContact CZ-CB 3.63Å; F14-P327 HydrophobicContact CZ-CG 3.97Å; F14-L328 HydrophobicContact CE2-CD1 4.46Å; F14-L353 HydrophobicContact CD2-CD1 3.96Å; F14-L353 HydrophobicContact CD2-CG 4.36Å; F14-L353 HydrophobicContact CE2-CD1 3.98Å; F14-L353 HydrophobicContact CE2-CG 4.45Å
15L85.5Confident82.3Confident104 Ų10462.7 Ų62.755%0.54530%0.297SS..Hα-helixtrans-61.9-29-178.3-69.6-179.4000113.3F11 Q12 T17F11-L15 HydrophobicContact CD1-CD1 3.94Å; F11-L15 HydrophobicContact CD1-CG 4.43Å; F11-L15 HydrophobicContact CE1-CD1 3.45Å; F11-L15 VanDerWaalsContact CE1-CD1 3.45Å; F11-L15 HydrophobicContact CE1-CG 4.1Å; F11-L15 HydrophobicContact CZ-CD1 3.96Å; F11-L15 HydrophobicContact CZ-CD2 4.38Å; F11-L15 HydrophobicContact CZ-CG 4.26Å; F11-L15 PolarHBondContact O-N 3.15Å; Q12-L15 PolarHBondContact O-N 2.9Å; L15-T17 VanDerWaalsContact C-N 3.29Å
16T84.8Confident82Confident40 Ų4062 Ų6225%0.24529%0.292CS..THydrogen-bonded Turntrans-83.6-3174.958.30000113.5Q12 E13 F14 S19 R20Q12-T16 WeakPolarHBondContact O-CG2 3.29Å; Q12-T16 PolarHBondContact O-N 3.35Å; Q12-T16 PolarHBondContact O-OG1 3.14Å; Q12-T16 VanDerWaalsContact O-OG1 3.06Å; E13-T16 WeakPolarHBondContact CA-OG1 3.42Å; E13-T16 PolarHBondContact O-OG1 2.91Å; E13-T16 VanDerWaalsContact O-OG1 3.14Å; F14-T16 PolarHBondContact O-N 2.99Å; T16-S19 PolarHBondContact O-N 2.87Å; T16-S19 PolarHBondContact O-OG 3.12Å; T16-R20 WeakPolarHBondContact O-CB 3.49Å; T16-R20 WeakPolarHBondContact O-CD 3.46Å; T16-R20 WeakPolarHBondContact O-CG 3.43Å; T16-R20 PolarHBondContact O-N 3.06Å; T16-R20 PolarHBondContact OG1-NE 3.38Å
17T82.8Confident81.6Confident1 Ų165 Ų651%0.00631%0.305CS..Hα-helixtrans-62.4-48.4-178.5-68.70000113E13 F14 L15 S19 R20 L21 Y324 V352E13-T17 PolarHBondContact O-N 3.32Å; E13-T17 PolarHBondContact O-OG1 3.38Å; F14-T17 WeakPolarHBondContact O-CB 3.43Å; F14-T17 PolarHBondContact O-N 3.29Å; F14-T17 PolarHBondContact O-OG1 3.41Å; L15-T17 VanDerWaalsContact C-N 3.29Å; T17-S19 VanDerWaalsContact C-N 3.33Å; T17-S19 PolarHBondContact O-N 2.93Å; T17-R20 WeakPolarHBondContact O-CB 3.08Å; T17-R20 PolarHBondContact O-N 2.88Å; T17-L21 WeakPolarHBondContact O-CB 3.09Å; T17-L21 PolarHBondContact O-N 3.38Å; T17-Y324 PolarHBondContact OG1-OH 2.88Å; T17-V352 HydrophobicContact CG2-CG1 3.63Å; T17-V352 WeakPolarHBondContact CG2-O 3.29Å
18P80.3Confident80.9Confident76 Ų7663.9 Ų63.949%0.49430%0.301SS..Hα-helixtrans-60.7-39.9178.3-25.235.5000113.2L21 W22P18-L21 WeakPolarHBondContact O-CB 3.36Å; P18-L21 PolarHBondContact O-N 2.89Å; P18-W22 WeakPolarHBondContact O-CB 3.1Å; P18-W22 PolarHBondContact O-N 2.8Å
19S81.3Confident80.3Confident62 Ų6262.8 Ų62.843%0.43430%0.298SS..Hα-helixtrans-70.4-34.8178.263.80000112.3T16 T17 R23T16-S19 PolarHBondContact O-N 2.87Å; T16-S19 PolarHBondContact O-OG 3.12Å; T17-S19 VanDerWaalsContact C-N 3.33Å; T17-S19 PolarHBondContact O-N 2.93Å; S19-R23 WeakPolarHBondContact O-CB 3.12Å; S19-R23 PolarHBondContact O-N 3.15Å
20R77.5Confident79.8Confident50 Ų5063.7 Ų63.719%0.18930%0.301CS..Hα-helixtrans-65.4-45.2171.4-73.9169.3179.2-175.5-4.5111.5E13 T16 T17 W22 R23 M24 S360E13-R20 IonicContact OE1-CZ 3.31Å; E13-R20 IonicContact OE1-NH1 3.35Å; E13-R20 PolarHBondContact OE1-NH1 3.22Å; E13-R20 IonicContact OE1-NH2 2.92Å; E13-R20 PolarHBondContact OE1-NH2 3.48Å; T16-R20 WeakPolarHBondContact O-CB 3.49Å; T16-R20 WeakPolarHBondContact O-CD 3.46Å; T16-R20 WeakPolarHBondContact O-CG 3.43Å; T16-R20 PolarHBondContact O-N 3.06Å; T16-R20 PolarHBondContact OG1-NE 3.38Å; T17-R20 WeakPolarHBondContact O-CB 3.08Å; T17-R20 PolarHBondContact O-N 2.88Å; R20-W22 VanDerWaalsContact C-N 3.34Å; R20-W22 PolarHBondContact O-N 3.22Å; R20-R23 PolarHBondContact O-N 3.16Å; R20-M24 WeakPolarHBondContact O-CG 3.49Å; R20-M24 PolarHBondContact O-N 3.01Å; R20-S360 VanDerWaalsContact NH1-CA 3.29Å
21L78.6Confident79Confident18 Ų1864.8 Ų64.89%0.09431%0.306CS..Hα-helixtrans-58.2-47.7176.6-178.671000110.8T17 P18 R23 M24 H25 L123 L127 I355T17-L21 WeakPolarHBondContact O-CB 3.09Å; T17-L21 PolarHBondContact O-N 3.38Å; P18-L21 WeakPolarHBondContact O-CB 3.36Å; P18-L21 PolarHBondContact O-N 2.89Å; L21-R23 VanDerWaalsContact C-N 3.34Å; L21-R23 PolarHBondContact O-N 2.86Å; L21-M24 PolarHBondContact O-N 3.45Å; L21-H25 WeakPolarHBondContact O-CB 3.29Å; L21-H25 PolarHBondContact O-N 3.26Å; L21-L123 HydrophobicContact CD1-CD2 3.37Å; L21-L127 HydrophobicContact CD2-CD2 4.04Å; L21-I355 HydrophobicContact CD1-CB 3.99Å; L21-I355 HydrophobicContact CD1-CD1 3.84Å; L21-I355 HydrophobicContact CD1-CG1 4.49Å; L21-I355 HydrophobicContact CD1-CG2 3.37Å
22W79Confident78.2Confident170 Ų17063 Ų6364%0.64430%0.301SS*.Hα-helixtrans-58.4-45.1175.9-176.5-105.9000112.1P18 R20 M24 H25 Y26P18-W22 WeakPolarHBondContact O-CB 3.1Å; P18-W22 PolarHBondContact O-N 2.8Å; R20-W22 VanDerWaalsContact C-N 3.34Å; R20-W22 PolarHBondContact O-N 3.22Å; W22-M24 PolarHBondContact O-N 2.81Å; W22-H25 PolarHBondContact O-N 3.29Å; W22-Y26 WeakPolarHBondContact O-CB 3.36Å; W22-Y26 PolarHBondContact O-N 2.87Å
23R79.4Confident77.4Confident151 Ų15161.2 Ų61.257%0.5730%0.301SS*.Hα-helixtrans-64.1-40.2177.7-167.2-175.1-63.8144.6-0.2112.4S19 R20 L21 H27S19-R23 WeakPolarHBondContact O-CB 3.12Å; S19-R23 PolarHBondContact O-N 3.15Å; R20-R23 PolarHBondContact O-N 3.16Å; L21-R23 VanDerWaalsContact C-N 3.34Å; L21-R23 PolarHBondContact O-N 2.86Å; R23-H27 PolarHBondContact O-CD2 3.23Å; R23-H27 PolarHBondContact O-N 3.38Å; R23-H27 VanDerWaalsContact O-N 3.07Å
24M72.9Confident76.5Confident44 Ų4462.8 Ų62.822%0.21731%0.314CS..Hα-helixtrans-64-46.1175.1-75.1-175.1173.600111.5R20 L21 W22 H27 L28 I355R20-M24 WeakPolarHBondContact O-CG 3.49Å; R20-M24 PolarHBondContact O-N 3.01Å; L21-M24 PolarHBondContact O-N 3.45Å; W22-M24 PolarHBondContact O-N 2.81Å; M24-H27 PolarHBondContact O-N 3.09Å; M24-L28 PolarHBondContact O-N 3.23Å; M24-I355 HydrophobicContact SD-CG2 4.36Å
25H76.7Confident75.6Confident34 Ų3465 Ų6516%0.15733%0.327CS..Hα-helixtrans-58.4-49176176.869.8000111.3L21 W22 H27 L28 T29L21-H25 WeakPolarHBondContact O-CB 3.29Å; L21-H25 PolarHBondContact O-N 3.26Å; W22-H25 PolarHBondContact O-N 3.29Å; H25-H27 VanDerWaalsContact C-N 3.34Å; H25-H27 PolarHBondContact O-N 2.92Å; H25-L28 WeakPolarHBondContact O-CB 3.39Å; H25-L28 PolarHBondContact O-N 3.28Å; H25-L28 VanDerWaalsContact O-N 3.12Å; H25-T29 PolarHBondContact NE2-OG1 3.24Å; H25-T29 PolarHBondContact O-N 3.21Å; H25-T29 PolarHBondContact O-OG1 3.36Å
26Y77.1Confident74.8Confident124 Ų12462.2 Ų62.249%0.48632%0.319SS..Hα-helixtrans-56.7-45.9178-176.5-103.2000112.3W22 L28 T29 Q30W22-Y26 WeakPolarHBondContact O-CB 3.36Å; W22-Y26 PolarHBondContact O-N 2.87Å; Y26-L28 PolarHBondContact O-N 3.37Å; Y26-T29 PolarHBondContact O-N 3.47Å; Y26-Q30 HydrophobicContact CD1-CG 4.44Å; Y26-Q30 HydrophobicContact CE1-CG 4.15Å; Y26-Q30 WeakPolarHBondContact O-CG 3.41Å; Y26-Q30 PolarHBondContact O-N 3.16Å; Y26-Q30 PolarHBondContact OH-NE2 3.05Å
27H72.4Confident74Confident67 Ų6766.1 Ų66.131%0.3134%0.335SS..Hα-helixtrans-64.4-37176.7-82.1-58.5000113.5R23 M24 H25 L31R23-H27 PolarHBondContact O-CD2 3.23Å; R23-H27 PolarHBondContact O-N 3.38Å; R23-H27 VanDerWaalsContact O-N 3.07Å; M24-H27 PolarHBondContact O-N 3.09Å; H25-H27 VanDerWaalsContact C-N 3.34Å; H25-H27 PolarHBondContact O-N 2.92Å; H27-L31 WeakPolarHBondContact O-CB 3.47Å; H27-L31 WeakPolarHBondContact O-CG 3.24Å; H27-L31 PolarHBondContact O-N 3.26Å
28L70.7Confident73.4Confident18 Ų1869.5 Ų69.59%0.09435%0.353CS..Hα-helixtrans-62.6-49.8173.9-91.8154.4000111M24 H25 Y26 Q30 L31 T32 L123 L204M24-L28 PolarHBondContact O-N 3.23Å; H25-L28 WeakPolarHBondContact O-CB 3.39Å; H25-L28 PolarHBondContact O-N 3.28Å; H25-L28 VanDerWaalsContact O-N 3.12Å; Y26-L28 PolarHBondContact O-N 3.37Å; L28-Q30 VanDerWaalsContact C-N 3.28Å; L28-Q30 PolarHBondContact O-N 3.46Å; L28-L31 PolarHBondContact O-N 3.24Å; L28-L31 VanDerWaalsContact O-N 3.14Å; L28-T32 WeakPolarHBondContact O-CB 3.47Å; L28-T32 PolarHBondContact O-N 3.36Å; L28-T32 PolarHBondContact O-OG1 3.49Å; L28-L123 HydrophobicContact CD1-CB 3.72Å; L28-L123 HydrophobicContact CD1-CD1 3.45Å; L28-L123 VanDerWaalsContact CD1-CD1 3.45Å; L28-L123 HydrophobicContact CD1-CG 4.22Å; L28-L204 HydrophobicContact CD1-CD1 3.68Å; L28-L204 HydrophobicContact CD2-CD1 3.75Å; L28-L204 HydrophobicContact CD2-CD2 3.66Å; L28-L204 HydrophobicContact CD2-CG 3.85Å; L28-L204 HydrophobicContact CG-CD1 3.41Å; L28-L204 VanDerWaalsContact CG-CD1 3.41Å; L28-L204 HydrophobicContact CG-CD2 3.82Å; L28-L204 HydrophobicContact CG-CG 4.01Å
29T73.9Confident73Confident63 Ų6370 Ų7039%0.38736%0.355SS..Hα-helixtrans-61.9-38.3-178.8-48.70000111.3H25 Y26 S33H25-T29 PolarHBondContact NE2-OG1 3.24Å; H25-T29 PolarHBondContact O-N 3.21Å; H25-T29 PolarHBondContact O-OG1 3.36Å; Y26-T29 PolarHBondContact O-N 3.47Å; T29-S33 PolarHBondContact O-N 2.84Å; T29-S33 PolarHBondContact O-OG 3.42Å
30Q75.3Confident72.7Confident81 Ų8174.3 Ų74.338%0.37937%0.365SS..Hα-helixtrans-67.7-39.9173.5-73.8-168.5-27.700113.7Y26 L28 S33 S34Y26-Q30 HydrophobicContact CD1-CG 4.44Å; Y26-Q30 HydrophobicContact CE1-CG 4.15Å; Y26-Q30 WeakPolarHBondContact O-CG 3.41Å; Y26-Q30 PolarHBondContact O-N 3.16Å; Y26-Q30 PolarHBondContact OH-NE2 3.05Å; L28-Q30 VanDerWaalsContact C-N 3.28Å; L28-Q30 PolarHBondContact O-N 3.46Å; Q30-S33 PolarHBondContact O-N 3.29Å; Q30-S33 PolarHBondContact O-OG 2.91Å; Q30-S34 WeakPolarHBondContact O-CB 3.5Å; Q30-S34 PolarHBondContact O-N 3.23Å
31L67.1Low72.6Confident22 Ų2275.6 Ų75.612%0.11538%0.375CS..Hα-helixtrans-68.9-38.6177.4-84.1165.2000111.5H27 L28 S34 N35 L204 T207H27-L31 WeakPolarHBondContact O-CB 3.47Å; H27-L31 WeakPolarHBondContact O-CG 3.24Å; H27-L31 PolarHBondContact O-N 3.26Å; L28-L31 PolarHBondContact O-N 3.24Å; L28-L31 VanDerWaalsContact O-N 3.14Å; L31-S34 PolarHBondContact O-N 3.35Å; L31-N35 VanDerWaalsContact O-CB 3.27Å; L31-N35 WeakPolarHBondContact O-CB 3.35Å; L31-N35 PolarHBondContact O-N 3.35Å; L31-L204 HydrophobicContact CD1-CD2 3.26Å; L31-T207 HydrophobicContact CD2-CG2 4.02Å
32T69.5Low72.3Confident35 Ų3580.7 Ų80.722%0.21540%0.399CS..Hα-helixtrans-63.5-44.5174.1-61.60000111.3L28 N35 A36 S120L28-T32 WeakPolarHBondContact O-CB 3.47Å; L28-T32 PolarHBondContact O-N 3.36Å; L28-T32 PolarHBondContact O-OG1 3.49Å; T32-N35 PolarHBondContact O-N 3Å; T32-A36 WeakPolarHBondContact O-CB 3.33Å; T32-A36 PolarHBondContact O-N 3.01Å; T32-S120 VanDerWaalsContact CG2-CA 3.43Å
33S70.2Confident72.3Confident71 Ų7178.6 Ų78.650%0.49740%0.396SS..Hα-helixtrans-65.8-41.1177.267.10000112T29 Q30 A36 Q37T29-S33 PolarHBondContact O-N 2.84Å; T29-S33 PolarHBondContact O-OG 3.42Å; Q30-S33 PolarHBondContact O-N 3.29Å; Q30-S33 PolarHBondContact O-OG 2.91Å; S33-A36 PolarHBondContact O-N 2.89Å; S33-Q37 WeakPolarHBondContact O-CB 3.25Å; S33-Q37 PolarHBondContact O-N 3.23Å
34S65.9Low72.4Confident50 Ų5075.7 Ų75.735%0.3539%0.389SS..Hα-helixtrans-64.1-42.3174.6-1800000112.2Q30 L31 Q37 N38Q30-S34 WeakPolarHBondContact O-CB 3.5Å; Q30-S34 PolarHBondContact O-N 3.23Å; L31-S34 PolarHBondContact O-N 3.35Å; S34-Q37 PolarHBondContact O-N 2.96Å; S34-N38 WeakPolarHBondContact O-CB 3.37Å; S34-N38 PolarHBondContact O-N 3.39Å; S34-N38 PolarHBondContact O-ND2 2.93Å
35N67.5Low72.7Confident84 Ų8478.5 Ų78.545%0.44940%0.401SS..Hα-helixtrans-65.4-41.7176-76.8-12.2000111.6L31 T32 Q37 N38 T39L31-N35 VanDerWaalsContact O-CB 3.27Å; L31-N35 WeakPolarHBondContact O-CB 3.35Å; L31-N35 PolarHBondContact O-N 3.35Å; T32-N35 PolarHBondContact O-N 3Å; N35-Q37 VanDerWaalsContact C-N 3.27Å; N35-Q37 PolarHBondContact O-N 3.39Å; N35-N38 PolarHBondContact O-N 2.85Å; N35-T39 WeakPolarHBondContact O-CG2 3.38Å; N35-T39 PolarHBondContact O-N 2.83Å; N35-T39 PolarHBondContact O-OG1 2.86Å
36A66.8Low72.9Confident45 Ų4584.2 Ų84.237%0.37242%0.421SS..Hα-helixtrans-64.2-32.6175.100000112.5T32 S33 T39 K40T32-A36 WeakPolarHBondContact O-CB 3.33Å; T32-A36 PolarHBondContact O-N 3.01Å; S33-A36 PolarHBondContact O-N 2.89Å; A36-T39 WeakPolarHBondContact CA-OG1 3.38Å; A36-T39 PolarHBondContact O-OG1 2.93Å; A36-K40 WeakPolarHBondContact O-CG 3.48Å; A36-K40 PolarHBondContact O-N 3.46Å
37Q70Confident73.1Confident123 Ų12382.4 Ų82.458%0.57542%0.417SS*.Hα-helixtrans-71.7-43.3172.3-172.2176-8.300111.3S33 S34 N35 T39 K40 I41S33-Q37 WeakPolarHBondContact O-CB 3.25Å; S33-Q37 PolarHBondContact O-N 3.23Å; S34-Q37 PolarHBondContact O-N 2.96Å; N35-Q37 VanDerWaalsContact C-N 3.27Å; N35-Q37 PolarHBondContact O-N 3.39Å; Q37-T39 PolarHBondContact O-N 3.45Å; Q37-K40 PolarHBondContact O-N 3.33Å; Q37-I41 HydrophobicContact CG-CD1 4.19Å; Q37-I41 WeakPolarHBondContact O-CG1 3.34Å; Q37-I41 PolarHBondContact O-N 3.26Å
38N69.7Low73.4Confident72 Ų7286.7 Ų86.739%0.38543%0.431SS..Hα-helixtrans-64.6-38.2177.9-71.4-20.6000112.3S34 N35 I41 H42S34-N38 WeakPolarHBondContact O-CB 3.37Å; S34-N38 PolarHBondContact O-N 3.39Å; S34-N38 PolarHBondContact O-ND2 2.93Å; N35-N38 PolarHBondContact O-N 2.85Å; N38-I41 PolarHBondContact O-N 3.33Å; N38-H42 WeakPolarHBondContact O-CB 3.32Å; N38-H42 PolarHBondContact O-CD2 3.23Å; N38-H42 VanDerWaalsContact O-CD2 3.26Å; N38-H42 PolarHBondContact O-N 2.75Å
39T71.7Confident73.8Confident87 Ų8792 Ų9253%0.53446%0.455SS..Hα-helixtrans-65-4217551.70000111.4N35 A36 Q37 I41 H42 E43N35-T39 WeakPolarHBondContact O-CG2 3.38Å; N35-T39 PolarHBondContact O-N 2.83Å; N35-T39 PolarHBondContact O-OG1 2.86Å; A36-T39 WeakPolarHBondContact CA-OG1 3.38Å; A36-T39 PolarHBondContact O-OG1 2.93Å; Q37-T39 PolarHBondContact O-N 3.45Å; T39-I41 VanDerWaalsContact C-N 3.32Å; T39-I41 PolarHBondContact O-N 3.44Å; T39-H42 PolarHBondContact O-N 2.96Å; T39-E43 WeakPolarHBondContact O-CB 3.25Å; T39-E43 PolarHBondContact O-N 2.81Å
40K75.6Confident74.3Confident151 Ų15194.2 Ų94.266%0.65746%0.459SS*.Hα-helixtrans-60.6-40.2172.6-74.5178.6179.3-174.90112.2A36 Q37 E43 H44A36-K40 WeakPolarHBondContact O-CG 3.48Å; A36-K40 PolarHBondContact O-N 3.46Å; Q37-K40 PolarHBondContact O-N 3.33Å; K40-E43 PolarHBondContact O-N 2.84Å; K40-H44 WeakPolarHBondContact O-CB 3.5Å; K40-H44 PolarHBondContact O-N 2.86Å
41I74Confident74.6Confident77 Ų7798.6 Ų98.640%0.39547%0.472SS..Hα-helixtrans-64.9-46.5175.9-68.2166.2000110.6Q37 N38 T39 E43 H44 Q45Q37-I41 HydrophobicContact CG-CD1 4.19Å; Q37-I41 WeakPolarHBondContact O-CG1 3.34Å; Q37-I41 PolarHBondContact O-N 3.26Å; N38-I41 PolarHBondContact O-N 3.33Å; T39-I41 VanDerWaalsContact C-N 3.32Å; T39-I41 PolarHBondContact O-N 3.44Å; I41-E43 VanDerWaalsContact C-N 3.33Å; I41-E43 PolarHBondContact O-N 3.1Å; I41-H44 PolarHBondContact O-N 3.28Å; I41-Q45 HydrophobicContact CG2-CG 4.48Å; I41-Q45 WeakPolarHBondContact O-CB 3.48Å; I41-Q45 WeakPolarHBondContact O-CG 3.32Å; I41-Q45 PolarHBondContact O-N 3.37Å
42H72.4Confident75Confident126 Ų126102.5 Ų102.558%0.58349%0.493SS*.Hα-helixtrans-63.2-38.3177.4-85.4-62.2000112.6N38 T39 Q45 R46N38-H42 WeakPolarHBondContact O-CB 3.32Å; N38-H42 PolarHBondContact O-CD2 3.23Å; N38-H42 VanDerWaalsContact O-CD2 3.26Å; N38-H42 PolarHBondContact O-N 2.75Å; T39-H42 PolarHBondContact O-N 2.96Å; H42-Q45 PolarHBondContact O-N 3Å; H42-R46 WeakPolarHBondContact O-CB 3.38Å; H42-R46 PolarHBondContact O-N 2.84Å
43E80.1Confident75.4Confident125 Ų125107.6 Ų107.658%0.58451%0.514SS*.Hα-helixtrans-65.6-44.4174.8-170.2167.4-155.400111T39 K40 I41 Q45 R46 E47T39-E43 WeakPolarHBondContact O-CB 3.25Å; T39-E43 PolarHBondContact O-N 2.81Å; K40-E43 PolarHBondContact O-N 2.84Å; I41-E43 VanDerWaalsContact C-N 3.33Å; I41-E43 PolarHBondContact O-N 3.1Å; E43-Q45 VanDerWaalsContact C-N 3.32Å; E43-Q45 PolarHBondContact O-N 3Å; E43-R46 PolarHBondContact O-N 3.38Å; E43-E47 PolarHBondContact O-N 3.28Å
44H80.9Confident75.4Confident91 Ų91111.2 Ų111.242%0.42153%0.527SS..Hα-helixtrans-62.7-37.7174.3-168.371.2000112.5K40 I41 E47 R48K40-H44 WeakPolarHBondContact O-CB 3.5Å; K40-H44 PolarHBondContact O-N 2.86Å; I41-H44 PolarHBondContact O-N 3.28Å; H44-E47 PolarHBondContact O-N 3.41Å; H44-R48 PolarHBondContact NE2-NE 3.49Å; H44-R48 VanDerWaalsContact NE2-NE 3.17Å; H44-R48 WeakPolarHBondContact O-CB 3.42Å; H44-R48 WeakPolarHBondContact O-CG 3.43Å; H44-R48 PolarHBondContact O-N 2.81Å
45Q79.5Confident75.4Confident102 Ų102118 Ų11848%0.47755%0.545SS..Hα-helixtrans-66.2-41.7173.6-76.6-179-25.800111.8I41 H42 E43 R48 Q49I41-Q45 HydrophobicContact CG2-CG 4.48Å; I41-Q45 WeakPolarHBondContact O-CB 3.48Å; I41-Q45 WeakPolarHBondContact O-CG 3.32Å; I41-Q45 PolarHBondContact O-N 3.37Å; H42-Q45 PolarHBondContact O-N 3Å; E43-Q45 VanDerWaalsContact C-N 3.32Å; E43-Q45 PolarHBondContact O-N 3Å; Q45-R48 PolarHBondContact O-N 2.98Å; Q45-Q49 PolarHBondContact O-N 3.46Å
46R81.1Confident74.8Confident154 Ų154119.9 Ų119.958%0.58155%0.553SS**Hα-helixtrans-65.2-39.6176.4-167.3178.6-174.7-176.81.9111.4H42 E43 Q49 K50H42-R46 WeakPolarHBondContact O-CB 3.38Å; H42-R46 PolarHBondContact O-N 2.84Å; E43-R46 PolarHBondContact O-N 3.38Å; R46-Q49 PolarHBondContact O-N 3.33Å; R46-K50 WeakPolarHBondContact O-CG 3.37Å; R46-K50 PolarHBondContact O-N 3.41Å
47E81.6Confident74.1Confident87 Ų87121.7 Ų121.741%0.40756%0.561SS.*Hα-helixtrans-64.5-43.4171.9-78-170.5165.800112.2E43 H44 Q49 K50 R51E43-E47 PolarHBondContact O-N 3.28Å; H44-E47 PolarHBondContact O-N 3.41Å; E47-Q49 VanDerWaalsContact C-N 3.33Å; E47-Q49 PolarHBondContact O-N 3.16Å; E47-K50 PolarHBondContact O-N 3.42Å; E47-R51 WeakPolarHBondContact O-CG 3.3Å; E47-R51 PolarHBondContact O-N 3.46Å
48R78.4Confident73.4Confident156 Ų156119.5 Ų119.559%0.58956%0.559SS**Hα-helixtrans-59.2-43.5173.2-81.4-173.3-179.1-161.5-2.6111.6H44 Q45 R51 L52H44-R48 PolarHBondContact NE2-NE 3.49Å; H44-R48 VanDerWaalsContact NE2-NE 3.17Å; H44-R48 WeakPolarHBondContact O-CB 3.42Å; H44-R48 WeakPolarHBondContact O-CG 3.43Å; H44-R48 PolarHBondContact O-N 2.81Å; Q45-R48 PolarHBondContact O-N 2.98Å; R48-R51 PolarHBondContact O-N 3.3Å; R48-L52 WeakPolarHBondContact O-CG 3.21Å; R48-L52 PolarHBondContact O-N 3.04Å
49Q79.6Confident72.7Confident129 Ų129120 Ų12060%0.60357%0.569SS**Hα-helixtrans-62.5-42.2175.7-79-175.2-34.800112.2Q45 R46 E47 R51 L52 Q53Q45-Q49 PolarHBondContact O-N 3.46Å; R46-Q49 PolarHBondContact O-N 3.33Å; E47-Q49 VanDerWaalsContact C-N 3.33Å; E47-Q49 PolarHBondContact O-N 3.16Å; Q49-R51 PolarHBondContact O-N 2.86Å; Q49-L52 PolarHBondContact O-N 3.33Å; Q49-Q53 PolarHBondContact O-N 3.37Å
50K82.4Confident71.8Confident111 Ų111121.7 Ų121.748%0.48357%0.574SS.*Hα-helixtrans-60.5-43.9172.9-74.2179.2177.5-174.50111.8R46 E47 L52 Q53 I54R46-K50 WeakPolarHBondContact O-CG 3.37Å; R46-K50 PolarHBondContact O-N 3.41Å; E47-K50 PolarHBondContact O-N 3.42Å; K50-L52 VanDerWaalsContact C-N 3.29Å; K50-L52 PolarHBondContact O-N 3.22Å; K50-Q53 PolarHBondContact O-N 2.87Å; K50-I54 VanDerWaalsContact O-CG1 3.32Å; K50-I54 WeakPolarHBondContact O-CG1 3.29Å; K50-I54 PolarHBondContact O-N 3.11Å; K50-I54 VanDerWaalsContact O-N 3.1Å
51R81.9Confident70.4Confident172 Ų172123.8 Ų123.865%0.64958%0.578SS**Hα-helixtrans-63.9-33.5176.2-69.8178.7-169.7-157.24.6112.4E47 R48 Q49 R55E47-R51 WeakPolarHBondContact O-CG 3.3Å; E47-R51 PolarHBondContact O-N 3.46Å; R48-R51 PolarHBondContact O-N 3.3Å; Q49-R51 PolarHBondContact O-N 2.86Å; R51-R55 PolarHBondContact O-N 2.8Å
52L76.9Confident69.4Low104 Ų104125.5 Ų125.555%0.54559%0.587SS.*Hα-helixtrans-73.1-41.3175.2-73.1170000112R48 Q49 K50 I54 R55 I56R48-L52 WeakPolarHBondContact O-CG 3.21Å; R48-L52 PolarHBondContact O-N 3.04Å; Q49-L52 PolarHBondContact O-N 3.33Å; K50-L52 VanDerWaalsContact C-N 3.29Å; K50-L52 PolarHBondContact O-N 3.22Å; L52-I54 VanDerWaalsContact C-N 3.3Å; L52-I54 PolarHBondContact O-N 2.8Å; L52-R55 CarbonylContact O-C 3.57Å; L52-R55 PolarHBondContact O-N 2.89Å; L52-I56 WeakPolarHBondContact O-CG1 3.29Å; L52-I56 PolarHBondContact O-N 3.36Å; L52-I56 VanDerWaalsContact O-N 3.12Å
53Q76.2Confident68.5Low143 Ų143123.9 Ų123.967%0.66859%0.587SS**Hα-helixtrans-61.4-37.7175.4-77.3-178.1-14.200112.3Q49 K50 R55 I56Q49-Q53 PolarHBondContact O-N 3.37Å; K50-Q53 PolarHBondContact O-N 2.87Å; Q53-R55 PolarHBondContact O-N 3.33Å; Q53-I56 PolarHBondContact O-N 2.9Å
54I71.5Confident67Low147 Ų147122 Ų12275%0.75459%0.586SS**Hα-helixtrans-66.7-25.9174.5-64.4163.7000111.6K50 L52K50-I54 VanDerWaalsContact O-CG1 3.32Å; K50-I54 WeakPolarHBondContact O-CG1 3.29Å; K50-I54 PolarHBondContact O-N 3.11Å; K50-I54 VanDerWaalsContact O-N 3.1Å; L52-I54 VanDerWaalsContact C-N 3.3Å; L52-I54 PolarHBondContact O-N 2.8Å
55R64.6Low65.7Low193 Ų193122.9 Ų122.973%0.72859%0.593SS**Hα-helixtrans-89.9-11.7-179-161.5-178.4-83.9-170-9113.4R51 L52 Q53 P57R51-R55 PolarHBondContact O-N 2.8Å; L52-R55 CarbonylContact O-C 3.57Å; L52-R55 PolarHBondContact O-N 2.89Å; Q53-R55 PolarHBondContact O-N 3.33Å; R55-P57 WeakPolarHBondContact O-CD 3.5Å
56I55.3Low64.4Low123 Ų123121.3 Ų121.363%0.63160%0.597SS**SBendtrans-82.4103.5171.2-60.9165.7000106L52 Q53 S58L52-I56 WeakPolarHBondContact O-CG1 3.29Å; L52-I56 PolarHBondContact O-N 3.36Å; L52-I56 VanDerWaalsContact O-N 3.12Å; Q53-I56 PolarHBondContact O-N 2.9Å; I56-S58 PolarHBondContact O-N 2.83Å
57P52.9Low63.1Low83 Ų83117.6 Ų117.654%0.53960%0.595SS.*  trans-59.3129.9173.926.8-32.7000107.1R55 S59R55-P57 WeakPolarHBondContact O-CD 3.5Å; P57-S59 PolarHBondContact O-N 3.44Å
58S54.2Low61.6Low76 Ų76121.8 Ų121.853%0.53162%0.615SS.*  trans-39.4117.8172.750.80000108.6I56 D60 R61I56-S58 PolarHBondContact O-N 2.83Å; S58-D60 PolarHBondContact O-N 3.26Å; S58-R61 PolarHBondContact O-N 2.94Å
59S55.8Low60.1Low84 Ų84120.9 Ų120.959%0.58762%0.62SS**THydrogen-bonded Turntrans-48.6-21.8179.2380000113P57 R61 L62 T63P57-S59 PolarHBondContact O-N 3.44Å; S59-R61 PolarHBondContact O-N 2.77Å; S59-L62 PolarHBondContact O-N 3.06Å; S59-T63 PolarHBondContact O-N 3.05Å; S59-T63 PolarHBondContact O-OG1 3.3Å
60D52.6Low58.1Low122 Ų122123.1 Ų123.165%0.65263%0.631SS**Hα-helixtrans-60.5-22.8175.1-55.6-13.1000113.5S58 T63S58-D60 PolarHBondContact O-N 3.26Å; D60-T63 WeakPolarHBondContact CA-OG1 3.47Å; D60-T63 PolarHBondContact O-OG1 2.95Å
61R47.6Very low56Low194 Ų194125.7 Ų125.773%0.73265%0.649SS**Hα-helixtrans-83.4-25.1173.6-124-170.6-176.1-161.91.3113.3S58 S59S58-R61 PolarHBondContact O-N 2.94Å; S59-R61 PolarHBondContact O-N 2.77Å
62L51.7Low53.9Low113 Ų113123.3 Ų123.359%0.59266%0.656SS**Hα-helixtrans-82.2-29.3178.3-79.8167.1000112.1S59 C64 I65 A66S59-L62 PolarHBondContact O-N 3.06Å; L62-C64 VanDerWaalsContact C-N 3.29Å; L62-C64 PolarHBondContact O-N 3.08Å; L62-I65 PolarHBondContact O-N 2.87Å; L62-A66 WeakPolarHBondContact O-CB 3.42Å; L62-A66 PolarHBondContact O-N 3.15Å
63T53Low51.7Low92 Ų92122 Ų12256%0.56467%0.667SS**Hα-helixtrans-66.2-32.6170.338.40000112.3S59 D60 I65 A66 S67S59-T63 PolarHBondContact O-N 3.05Å; S59-T63 PolarHBondContact O-OG1 3.3Å; D60-T63 WeakPolarHBondContact CA-OG1 3.47Å; D60-T63 PolarHBondContact O-OG1 2.95Å; T63-I65 VanDerWaalsContact C-N 3.34Å; T63-I65 PolarHBondContact O-N 2.83Å; T63-A66 PolarHBondContact O-N 3.37Å; T63-S67 PolarHBondContact O-N 3.19Å; T63-S67 VanDerWaalsContact O-N 3.16Å; T63-S67 PolarHBondContact O-OG 2.8Å
64C50Low49.6Very low86 Ų86120.4 Ų120.458%0.58167%0.671SS**Hα-helixtrans-71.6-27.3177.5-148.30000113.3L62 S67L62-C64 VanDerWaalsContact C-N 3.29Å; L62-C64 PolarHBondContact O-N 3.08Å; C64-S67 PolarHBondContact O-OG 3.43Å
65I52.6Low47.8Very low110 Ų110118.5 Ų118.556%0.56467%0.672SS**Hα-helixtrans-82.1-37.9173.5-62.6175.5000110.7L62 T63 S67 Q68L62-I65 PolarHBondContact O-N 2.87Å; T63-I65 VanDerWaalsContact C-N 3.34Å; T63-I65 PolarHBondContact O-N 2.83Å; I65-S67 VanDerWaalsContact C-N 3.29Å; I65-S67 PolarHBondContact O-N 3.46Å; I65-Q68 PolarHBondContact O-N 3.38Å
66A53.4Low46.3Very low68 Ų68115.7 Ų115.756%0.56268%0.675SS**Hα-helixtrans-65-31.3179.700000112.8L62 T63 Q68 I69L62-A66 WeakPolarHBondContact O-CB 3.42Å; L62-A66 PolarHBondContact O-N 3.15Å; T63-A66 PolarHBondContact O-N 3.37Å; A66-Q68 PolarHBondContact O-N 3.31Å; A66-I69 PolarHBondContact O-N 3.26Å
67S53.7Low45.2Very low77 Ų77115.9 Ų115.954%0.53868%0.678SS.*THydrogen-bonded Turntrans-75.1-5.8177.464.70000114.7T63 C64 I65T63-S67 PolarHBondContact O-N 3.19Å; T63-S67 VanDerWaalsContact O-N 3.16Å; T63-S67 PolarHBondContact O-OG 2.8Å; C64-S67 PolarHBondContact O-OG 3.43Å; I65-S67 VanDerWaalsContact C-N 3.29Å; I65-S67 PolarHBondContact O-N 3.46Å
68Q49.4Very low44.3Very low175 Ų175120.3 Ų120.382%0.81869%0.688SS**THydrogen-bonded Turntrans-94.2-1.5174.6-85.7-170.7-700113.9I65 A66I65-Q68 PolarHBondContact O-N 3.38Å; A66-Q68 PolarHBondContact O-N 3.31Å
69I47.2Very low43.1Very low137 Ų137124.8 Ų124.870%0.70371%0.706SS**  trans-117.260.5176.5-47.5178.5000108.3A66A66-I69 PolarHBondContact O-N 3.26Å
70E37.8Very low41.9Very low176 Ų176125 Ų12582%0.82271%0.713SS**  trans-9399.8161.8-74.6-169.6164.500108.3
71L37.9Very low40.9Very low165 Ų165129.3 Ų129.386%0.86473%0.726SS**  trans-104138.9160.2-131.394.6000108.2
72P38.7Very low40Very low122 Ų122124.9 Ų124.979%0.79272%0.724SS**  trans-95.9151.6-164.236.5-32.6000113.6
73G30.8Very low38.9Very low76 Ų76126.7 Ų126.778%0.78474%0.735SS**  trans88.8140.2161.300000114.2
74S31Very low38Very low109 Ų109127.8 Ų127.876%0.76274%0.741SS**  cis-171.5167.6-0.455.80000107.8
75S32.9Very low36.9Very low108 Ų108130.6 Ų130.676%0.75575%0.75SS**  trans70.687.815952.40000118.5
76V33.4Very low36Very low133 Ų133131 Ų13181%0.80676%0.762SS**  trans-39.8128.3138.9173.70000112.6
77D33.5Very low35.1Very low128 Ų128133.7 Ų133.768%0.68478%0.775SS**  trans-162.2123.9134.5-108.8-30.5000113.6
78K33.6Very low34Very low175 Ų175138 Ų13876%0.76179%0.79SS**  trans46.5108.1143.3-68.9164-174.5160.10119.5
79L28.4Very low33Very low171 Ų171134.8 Ų134.890%0.89579%0.787SS**  73115.374.7-156.489.4000114.9
80A30.9Very low32Very low89 Ų89135.7 Ų135.774%0.73679%0.792SS**  trans73.1102.6151.600000119.7
81K32Very low31.8Very low212 Ų212133.3 Ų133.392%0.92279%0.792SS**  -156.5134.7121.2-126.8166.5-176.7172.80113.2
82S27.4Very low31.3Very low101 Ų101132.8 Ų132.871%0.70679%0.79SS**  trans-77.9142.6179.953.20000113.9
83N29.9Very low30.7Very low151 Ų151134.8 Ų134.881%0.80779%0.793SS**  trans176.1106.4137.7-106.2-2.3000105.9
84V32.7Very low30.6Very low114 Ų114136.6 Ų136.669%0.69179%0.794SS**  59.1120.673.7-176.30000112.1
85D27.6Very low30.4Very low145 Ų145137.5 Ų137.578%0.77580%0.795SS**  trans88.693.4168.8-57.4-25.9000118.8
86S33.4Very low30.3Very low118 Ų118137.8 Ų137.883%0.82580%0.797SS**  trans-158.2133.5139.5-75.10000110.8
87P34.9Very low30.8Very low126 Ų126136.7 Ų136.782%0.81879%0.793SS**  trans-84.9149.3-165.334.1-35.3000113.9S89P87-S89 PolarHBondContact O-N 3.48Å
88I30.9Very low30.6Very low167 Ų167137.8 Ų137.886%0.85680%0.798SS**  trans-62.2115.2-173-63.6157.5000111.8
89S28.9Very low30.4Very low108 Ų108133.6 Ų133.676%0.75579%0.79SS**PPolyproline II helixtrans-99.4126.1163.343.10000110.3P87P87-S89 PolarHBondContact O-N 3.48Å
90L25Very low30.4Very low156 Ų156130.6 Ų130.682%0.81778%0.784SS**PPolyproline II helixtrans-56.3133175.9-97.478.7000112
91P33.4Very low30.5Very low126 Ų126132.2 Ų132.282%0.81879%0.789SS**PPolyproline II helixtrans-93.8128.8160.7117.4000111.1
92N28.7Very low31.1Very low154 Ų154128.1 Ų128.182%0.82478%0.784SS**PPolyproline II helixtrans-63.7144.2-178.9-88.7-36.3000114.3
93L24.6Very low31.3Very low164 Ų164128.5 Ų128.586%0.85979%0.787SS**PPolyproline II helixtrans-47.8123.8161.5-139.277.8000111.2
94S29.1Very low31.3Very low113 Ų113126.2 Ų126.279%0.7978%0.783SS**  trans-132.312115949.50000109.9
95T27.5Very low31.1Very low129 Ų129128.4 Ų128.479%0.79179%0.79SS**  trans-80.3134.7-18039.60000110.5
96S31.1Very low31.2Very low113 Ų113125.6 Ų125.679%0.7978%0.782SS**  trans-144.4127.7163.9-42.70000110
97P43.6Very low30.9Very low111 Ų111125.9 Ų125.972%0.72178%0.779SS**  trans-93.9159176.632.6-22.6000111
98L30.3Very low30.5Very low151 Ų151125.6 Ų125.679%0.79178%0.775SS**  168.6143.9126.5-106.4103000113.1
99S29.1Very low30.5Very low87 Ų87122.7 Ų122.761%0.60877%0.769SS**  trans45.5110.3148.661.10000119.7
100S27.2Very low30.6Very low108 Ų108122.8 Ų122.876%0.75577%0.765SS**  64.9103.772.174.20000115.1
101S32.9Very low31Very low122 Ų122120.3 Ų120.385%0.85376%0.761SS**  trans-174.5144.7133.2-76.50000110.4
102P44.2Very low30.9Very low126 Ų126122.9 Ų122.982%0.81876%0.763SS**  trans-109.4146.8-16838.4-27.7000114
103S32.5Very low31.4Very low110 Ų110121.8 Ų121.877%0.76976%0.755SS**  trans-165.4100.415833.50000106.4
104S29.3Very low31.8Very low103 Ų103123.2 Ų123.272%0.7276%0.755SS**  69.9129.482.372.40000113.6
105L29.2Very low32.2Very low159 Ų159128.3 Ų128.383%0.83276%0.756SS**  trans83.4134.8176.3-82.172.6000116
106S28.6Very low32.7Very low87 Ų87125.6 Ų125.661%0.60874%0.743SS**  cis-172.6144.3-4.135.80000108
107T28.3Very low33Very low123 Ų123126 Ų12676%0.75575%0.746SS**  trans48.5123147.355.80000117.5
108T26.5Very low32.9Very low120 Ų120123.6 Ų123.674%0.73673%0.732SS**  -174.514774.6-54.70000110
109S29.9Very low33.7Very low106 Ų106122 Ų12274%0.74172%0.724SS**  trans57.190.5157.557.30000118
110T32Very low34.7Very low110 Ų110122 Ų12268%0.67572%0.723SS**  trans-128.2103.6143.4-28.40000107.3Q112T110-Q112 PolarHBondContact O-N 2.85Å
111S32Very low36.4Very low105 Ų105119.6 Ų119.673%0.73470%0.7SS**  trans-48.7102.1164.3390000108.1I113S111-I113 PolarHBondContact O-N 2.84Å
112Q33.2Very low38.1Very low180 Ų180114.5 Ų114.584%0.84167%0.667SS**  trans-65.688.7170.2-77.9-168.9-29.300107.3T110 K114T110-Q112 PolarHBondContact O-N 2.85Å; Q112-K114 PolarHBondContact O-N 3.42Å
113I37.8Very low39.5Very low130 Ų130108.6 Ų108.667%0.66763%0.628SS**  trans-60.890.2152.4-65.5173.6000104.6S111 R115S111-I113 PolarHBondContact O-N 2.84Å; I113-R115 HydrophobicContact CG2-CB 4.35Å; I113-R115 HydrophobicContact CG2-CG 3.79Å; I113-R115 PolarHBondContact O-N 3.37Å
114K32.8Very low41.6Very low195 Ų195106.8 Ų106.885%0.84861%0.61SS**  trans-6667.3170.2-162.6177.6-173.2-179.70107.2Q112 S116Q112-K114 PolarHBondContact O-N 3.42Å; K114-S116 VanDerWaalsContact C-N 3.29Å; K114-S116 PolarHBondContact O-N 3.46Å
115R37.9Very low44Very low219 Ų219104.8 Ų104.883%0.82659%0.589SS**  trans-70.396.5166.8-98.4174.6-173.4172.32.7105.7I113 S117I113-R115 HydrophobicContact CG2-CB 4.35Å; I113-R115 HydrophobicContact CG2-CG 3.79Å; I113-R115 PolarHBondContact O-N 3.37Å; R115-S117 PolarHBondContact O-N 3.33Å
116S38.5Very low46.3Very low73 Ų7397.9 Ų97.951%0.5155%0.553SS.*  trans-34.8117171.544.90000111.5K114 S118K114-S116 VanDerWaalsContact C-N 3.29Å; K114-S116 PolarHBondContact O-N 3.46Å; S116-S118 PolarHBondContact O-N 2.93Å
117S36.2Very low48.6Very low122 Ų12294.7 Ų94.785%0.85353%0.529SS*.THydrogen-bonded Turntrans-67.421.6172.8600000113.6R115R115-S117 PolarHBondContact O-N 3.33Å
118S41.9Very low51.2Low60 Ų6091.3 Ų91.342%0.4251%0.514SS..THydrogen-bonded Turntrans-91.32.6-177.5560000113.7S116 S120 Q121S116-S118 PolarHBondContact O-N 2.93Å; S118-S120 VanDerWaalsContact C-N 3.29Å; S118-S120 PolarHBondContact O-N 3.13Å; S118-Q121 VanDerWaalsContact O-CG 3.3Å; S118-Q121 WeakPolarHBondContact O-CG 3.48Å
119D48.6Very low53.9Low118 Ų11891.5 Ų91.563%0.63150%0.501SS*.  trans-84.37.8-174.3-82.8-21.6000115.1Q121D119-Q121 PolarHBondContact O-N 2.81Å
120S49.4Very low56.3Low85 Ų8586.4 Ų86.459%0.59447%0.466SS*.  trans-74.812.5177600000114.8T32 S118 G122T32-S120 VanDerWaalsContact CG2-CA 3.43Å; S118-S120 VanDerWaalsContact C-N 3.29Å; S118-S120 PolarHBondContact O-N 3.13Å; S120-G122 PolarHBondContact O-N 3.21Å
121Q61.9Low58.6Low59 Ų5986.3 Ų86.328%0.27645%0.453SS..  trans-78.5115.2-171-64-177.4-24.900111S118 D119 E125 R200S118-Q121 VanDerWaalsContact O-CG 3.3Å; S118-Q121 WeakPolarHBondContact O-CG 3.48Å; D119-Q121 PolarHBondContact O-N 2.81Å; Q121-E125 HydrophobicContact CB-CB 4.43Å; Q121-E125 VanDerWaalsContact CB-OE2 3.24Å; Q121-E125 WeakPolarHBondContact CB-OE2 3.38Å; Q121-E125 WeakPolarHBondContact CG-OE2 3.47Å; Q121-E125 PolarHBondContact NE2-OE1 3.42Å; Q121-E125 PolarHBondContact NE2-OE2 2.89Å; Q121-E125 PolarHBondContact OE1-OE1 3.44Å; Q121-E125 PolarHBondContact OE1-OE2 3.48Å; Q121-R200 PolarHBondContact O-NH1 2.94Å
122G69.4Low61.2Low14 Ų1486.8 Ų86.814%0.14445%0.447CS..  trans-63.1173.6178.100000113.7S120 L124 E125 P126S120-G122 PolarHBondContact O-N 3.21Å; G122-L124 PolarHBondContact O-N 3.47Å; G122-E125 PolarHBondContact O-N 3.04Å; G122-P126 VanDerWaalsContact O-CD 3.23Å; G122-P126 WeakPolarHBondContact O-CD 3.21Å
123L73.7Confident63.6Low3 Ų380.8 Ų80.82%0.01642%0.42CS..THydrogen-bonded Turntrans-57.4-23.8-178.6-157.6114.1000114.6L21 L28 P126 L127 I197 I201 I355L21-L123 HydrophobicContact CD1-CD2 3.37Å; L28-L123 HydrophobicContact CD1-CB 3.72Å; L28-L123 HydrophobicContact CD1-CD1 3.45Å; L28-L123 VanDerWaalsContact CD1-CD1 3.45Å; L28-L123 HydrophobicContact CD1-CG 4.22Å; L123-P126 WeakPolarHBondContact O-CD 3.34Å; L123-P126 WeakPolarHBondContact O-CG 3.26Å; L123-L127 WeakPolarHBondContact O-CB 3.37Å; L123-L127 PolarHBondContact O-N 3.49Å; L123-I197 HydrophobicContact CD1-CG2 3.87Å; L123-I197 HydrophobicContact CG-CG2 4.28Å; L123-I201 HydrophobicContact CD1-CD1 4.26Å; L123-I201 HydrophobicContact CD1-CG1 4.07Å; L123-I355 HydrophobicContact CD2-CD1 4.01Å; L123-I355 HydrophobicContact CD2-CG2 4.25Å
124L76.9Confident65.7Low72 Ų7274.6 Ų74.638%0.37739%0.388SS..Hα-helixtrans-72.1-29.4-175.9-73.6173.1000113G122 L127 A128G122-L124 PolarHBondContact O-N 3.47Å; L124-L127 HydrophobicContact CD2-CD2 4.33Å; L124-L127 WeakPolarHBondContact O-CB 3.34Å; L124-L127 PolarHBondContact O-N 3.32Å; L124-A128 VanDerWaalsContact O-CB 3.26Å; L124-A128 WeakPolarHBondContact O-CB 3.25Å; L124-A128 PolarHBondContact O-N 3.33Å
125E79.8Confident68.1Low61 Ų6166.9 Ų66.929%0.28536%0.357SS..Hα-helixtrans-69.7-51.2179.9-176.3172.3167.400113.7Q121 G122 L127 A128 R129Q121-E125 HydrophobicContact CB-CB 4.43Å; Q121-E125 VanDerWaalsContact CB-OE2 3.24Å; Q121-E125 WeakPolarHBondContact CB-OE2 3.38Å; Q121-E125 WeakPolarHBondContact CG-OE2 3.47Å; Q121-E125 PolarHBondContact NE2-OE1 3.42Å; Q121-E125 PolarHBondContact NE2-OE2 2.89Å; Q121-E125 PolarHBondContact OE1-OE1 3.44Å; Q121-E125 PolarHBondContact OE1-OE2 3.48Å; G122-E125 PolarHBondContact O-N 3.04Å; E125-L127 PolarHBondContact O-N 2.86Å; E125-A128 PolarHBondContact O-N 2.83Å; E125-A128 VanDerWaalsContact O-N 3.16Å; E125-R129 WeakPolarHBondContact O-CG 3.28Å; E125-R129 PolarHBondContact O-N 3.15Å; E125-R129 IonicContact OE1-CZ 3.2Å; E125-R129 IonicContact OE1-NE 3.39Å; E125-R129 PolarHBondContact OE1-NE 2.87Å; E125-R129 IonicContact OE1-NH2 2.66Å; E125-R129 PolarHBondContact OE1-NH2 2.88Å
126P76.7Confident70.4Confident13 Ų1358.1 Ų58.18%0.08434%0.335CS..Hα-helixtrans-61.5-31.6174.623.9-32.4000111.5G122 L123 R129 M130 I197G122-P126 VanDerWaalsContact O-CD 3.23Å; G122-P126 WeakPolarHBondContact O-CD 3.21Å; L123-P126 WeakPolarHBondContact O-CD 3.34Å; L123-P126 WeakPolarHBondContact O-CG 3.26Å; P126-R129 PolarHBondContact O-N 3.02Å; P126-M130 VanDerWaalsContact O-CB 3.32Å; P126-M130 WeakPolarHBondContact O-CB 3.44Å; P126-M130 PolarHBondContact O-N 3.34Å; P126-I197 HydrophobicContact CB-CD1 4.29Å; P126-I197 HydrophobicContact CB-CG1 3.98Å; P126-I197 HydrophobicContact CG-CD1 4.48Å; P126-I197 HydrophobicContact CG-CG1 3.99Å
127L78.2Confident72.5Confident20 Ų2056.2 Ų56.211%0.10532%0.319CS..Hα-helixtrans-65.3-46173.4-172.264.5000112L21 L123 L124 E125 R129 M130 W131 P351 I355L21-L127 HydrophobicContact CD2-CD2 4.04Å; L123-L127 WeakPolarHBondContact O-CB 3.37Å; L123-L127 PolarHBondContact O-N 3.49Å; L124-L127 HydrophobicContact CD2-CD2 4.33Å; L124-L127 WeakPolarHBondContact O-CB 3.34Å; L124-L127 PolarHBondContact O-N 3.32Å; E125-L127 PolarHBondContact O-N 2.86Å; L127-R129 VanDerWaalsContact C-N 3.32Å; L127-R129 PolarHBondContact O-N 3.48Å; L127-M130 PolarHBondContact O-N 3.46Å; L127-W131 WeakPolarHBondContact O-CB 3.36Å; L127-W131 PolarHBondContact O-N 2.79Å; L127-P351 HydrophobicContact CD1-CB 3.39Å; L127-I355 HydrophobicContact CD1-CD1 3.54Å; L127-I355 HydrophobicContact CD2-CD1 4.21Å; L127-I355 HydrophobicContact CG-CD1 4.39Å
128A82Confident74.6Confident52 Ų5250.7 Ų50.743%0.4328%0.28SS..Hα-helixtrans-64.3-37.1176.900000111.6L124 E125 W131 L132L124-A128 VanDerWaalsContact O-CB 3.26Å; L124-A128 WeakPolarHBondContact O-CB 3.25Å; L124-A128 PolarHBondContact O-N 3.33Å; E125-A128 PolarHBondContact O-N 2.83Å; E125-A128 VanDerWaalsContact O-N 3.16Å; A128-W131 PolarHBondContact O-N 3.16Å; A128-L132 WeakPolarHBondContact O-CB 3.38Å; A128-L132 PolarHBondContact O-N 3.4Å
129R83.3Confident76.5Confident124 Ų12452.9 Ų52.947%0.46829%0.286SS..Hα-helixtrans-66.6-46.5174.3-69.7-179.3-173.8-158.55.5111.9E125 P126 L127 W131 L132 I133 Y193E125-R129 WeakPolarHBondContact O-CG 3.28Å; E125-R129 PolarHBondContact O-N 3.15Å; E125-R129 IonicContact OE1-CZ 3.2Å; E125-R129 IonicContact OE1-NE 3.39Å; E125-R129 PolarHBondContact OE1-NE 2.87Å; E125-R129 IonicContact OE1-NH2 2.66Å; E125-R129 PolarHBondContact OE1-NH2 2.88Å; P126-R129 PolarHBondContact O-N 3.02Å; L127-R129 VanDerWaalsContact C-N 3.32Å; L127-R129 PolarHBondContact O-N 3.48Å; R129-W131 VanDerWaalsContact C-N 3.27Å; R129-W131 PolarHBondContact O-N 2.91Å; R129-L132 PolarHBondContact O-N 2.68Å; R129-I133 WeakPolarHBondContact O-CD1 3.37Å; R129-I133 VanDerWaalsContact O-CG1 3.3Å; R129-I133 WeakPolarHBondContact O-CG1 3.36Å; R129-I133 PolarHBondContact O-N 2.9Å; R129-Y193 HydrophobicContact CB-CE1 3.92Å
130M80.4Confident78.2Confident0 Ų049.3 Ų49.30%027%0.274CS..Hα-helixtrans-57.3-43.8174.2-179.6-176.5174.500110.7P126 L127 N134 N190 Y193 L194 P351P126-M130 VanDerWaalsContact O-CB 3.32Å; P126-M130 WeakPolarHBondContact O-CB 3.44Å; P126-M130 PolarHBondContact O-N 3.34Å; L127-M130 PolarHBondContact O-N 3.46Å; M130-N134 VanDerWaalsContact O-CB 3.27Å; M130-N134 WeakPolarHBondContact O-CB 3.39Å; M130-N134 VanDerWaalsContact O-CG 3.23Å; M130-N134 PolarHBondContact O-N 3.5Å; M130-N134 PolarHBondContact O-ND2 2.88Å; M130-N190 HydrophobicContact CE-CB 3.55Å; M130-N190 WeakPolarHBondContact CE-OD1 2.97Å; M130-Y193 HydrophobicContact CB-CD1 4.36Å; M130-Y193 HydrophobicContact CB-CD2 4.45Å; M130-Y193 HydrophobicContact CB-CG 4.01Å; M130-Y193 HydrophobicContact CG-CG 4.44Å; M130-L194 HydrophobicContact CE-CD1 3.66Å; M130-P351 HydrophobicContact CE-CB 3.7Å; M130-P351 HydrophobicContact CE-CG 3.74Å; M130-P351 HydrophobicContact CG-CG 4.42Å; M130-P351 HydrophobicContact SD-CB 3.87Å; M130-P351 HydrophobicContact SD-CG 4.11Å
131W80.6Confident79.6Confident108 Ų10847.1 Ų47.141%0.40926%0.255SS..Hα-helixtrans-62.3-50.5175.5173.571000112.9L127 A128 R129 I133 N134 V135 I348L127-W131 WeakPolarHBondContact O-CB 3.36Å; L127-W131 PolarHBondContact O-N 2.79Å; A128-W131 PolarHBondContact O-N 3.16Å; R129-W131 VanDerWaalsContact C-N 3.27Å; R129-W131 PolarHBondContact O-N 2.91Å; W131-I133 VanDerWaalsContact C-N 3.26Å; W131-I133 PolarHBondContact O-N 3.4Å; W131-N134 PolarHBondContact O-N 3.38Å; W131-N134 VanDerWaalsContact O-N 3.15Å; W131-V135 HydrophobicContact CD2-CG2 4.29Å; W131-V135 HydrophobicContact CG-CG2 4.36Å; W131-V135 HydrophobicContact CZ2-CG2 4.1Å; W131-V135 WeakPolarHBondContact O-CG2 3.35Å; W131-V135 PolarHBondContact O-N 3.2Å; W131-I348 VanDerWaalsContact CD1-CG1 3.45Å
132L85.4Confident80.4Confident115 Ų11545.6 Ų45.660%0.60225%0.252SS*.Hα-helixtrans-60.4-39.2-178.2-170.2153.1000111.2A128 R129 G136A128-L132 WeakPolarHBondContact O-CB 3.38Å; A128-L132 PolarHBondContact O-N 3.4Å; R129-L132 PolarHBondContact O-N 2.68Å; L132-G136 WeakPolarHBondContact O-CA 3.27Å; L132-G136 PolarHBondContact O-N 2.91Å
133I84.7Confident81Confident53 Ų5348.6 Ų48.627%0.27226%0.264SS..Hα-helixtrans-66.8-46.4176-67.4165.2000110.8R129 W131 G136 L137 V189 Y193R129-I133 WeakPolarHBondContact O-CD1 3.37Å; R129-I133 VanDerWaalsContact O-CG1 3.3Å; R129-I133 WeakPolarHBondContact O-CG1 3.36Å; R129-I133 PolarHBondContact O-N 2.9Å; W131-I133 VanDerWaalsContact C-N 3.26Å; W131-I133 PolarHBondContact O-N 3.4Å; I133-G136 PolarHBondContact O-N 2.88Å; I133-L137 WeakPolarHBondContact O-CB 3.38Å; I133-L137 PolarHBondContact O-N 3.08Å; I133-V189 HydrophobicContact CB-CG1 4.23Å; I133-V189 HydrophobicContact CG2-CB 4.45Å; I133-V189 HydrophobicContact CG2-CG1 3.68Å; I133-V189 HydrophobicContact CG2-CG2 3.91Å; I133-Y193 HydrophobicContact CD1-CE2 3.43Å; I133-Y193 VanDerWaalsContact CD1-CE2 3.43Å; I133-Y193 VanDerWaalsContact CD1-CZ 3.42Å; I133-Y193 WeakPolarHBondContact CD1-OH 3.15Å
134N82.3Confident81.4Confident1 Ų152.1 Ų52.11%0.00528%0.282CS..Hα-helixtrans-62.1-45.8179.6-83-5.8000112.6M130 W131 L137 I138 M186 N190 A347M130-N134 VanDerWaalsContact O-CB 3.27Å; M130-N134 WeakPolarHBondContact O-CB 3.39Å; M130-N134 VanDerWaalsContact O-CG 3.23Å; M130-N134 PolarHBondContact O-N 3.5Å; M130-N134 PolarHBondContact O-ND2 2.88Å; W131-N134 PolarHBondContact O-N 3.38Å; W131-N134 VanDerWaalsContact O-N 3.15Å; N134-L137 PolarHBondContact O-N 3.45Å; N134-I138 WeakPolarHBondContact O-CG1 3.42Å; N134-I138 PolarHBondContact O-N 2.87Å; N134-I138 VanDerWaalsContact O-N 3.1Å; N134-M186 HydrophobicContact CB-CE 3.38Å; N134-N190 PolarHBondContact ND2-OD1 3.42Å; N134-A347 HydrophobicContact CB-CB 4.24Å
135V83.2Confident81.4Confident32 Ų3250.6 Ų50.619%0.19428%0.278CS..Hα-helixtrans-67.4-42.1175.3172.70000111W131 L137 I138 L139 V344 A347W131-V135 HydrophobicContact CD2-CG2 4.29Å; W131-V135 HydrophobicContact CG-CG2 4.36Å; W131-V135 HydrophobicContact CZ2-CG2 4.1Å; W131-V135 WeakPolarHBondContact O-CG2 3.35Å; W131-V135 PolarHBondContact O-N 3.2Å; V135-L137 VanDerWaalsContact C-N 3.28Å; V135-L137 PolarHBondContact O-N 3.48Å; V135-I138 PolarHBondContact O-N 3.5Å; V135-L139 WeakPolarHBondContact O-CB 3.35Å; V135-L139 PolarHBondContact O-N 3.46Å; V135-V344 HydrophobicContact CG2-CG1 4.38Å; V135-A347 HydrophobicContact CG2-CB 4.23Å
136G85.1Confident81.4Confident35 Ų3554.6 Ų54.636%0.36129%0.291SS..Hα-helixtrans-59.7-39.1176.100000112.4L132 I133 L139 A140L132-G136 WeakPolarHBondContact O-CA 3.27Å; L132-G136 PolarHBondContact O-N 2.91Å; I133-G136 PolarHBondContact O-N 2.88Å; G136-L139 PolarHBondContact O-N 3.41Å; G136-A140 VanDerWaalsContact O-CB 3.3Å; G136-A140 WeakPolarHBondContact O-CB 3.35Å; G136-A140 PolarHBondContact O-N 3.49Å
137L82.4Confident81.7Confident33 Ų3360 Ų6017%0.17331%0.314CS..Hα-helixtrans-65.1-47.6175.2-16796000111.8I133 N134 V135 L139 A140 L141 L182 F185 M186I133-L137 WeakPolarHBondContact O-CB 3.38Å; I133-L137 PolarHBondContact O-N 3.08Å; N134-L137 PolarHBondContact O-N 3.45Å; V135-L137 VanDerWaalsContact C-N 3.28Å; V135-L137 PolarHBondContact O-N 3.48Å; L137-L139 VanDerWaalsContact C-N 3.29Å; L137-L139 PolarHBondContact O-N 2.83Å; L137-A140 PolarHBondContact O-N 3.36Å; L137-L141 HydrophobicContact CD2-CD1 4Å; L137-L141 HydrophobicContact CG-CD1 3.96Å; L137-L141 WeakPolarHBondContact O-CB 3.35Å; L137-L141 WeakPolarHBondContact O-CG 3.48Å; L137-L141 PolarHBondContact O-N 3.21Å; L137-L182 HydrophobicContact CD2-CD2 4.1Å; L137-L182 HydrophobicContact CD2-CG 3.85Å; L137-F185 HydrophobicContact CD1-CD1 3.17Å; L137-F185 HydrophobicContact CD1-CE1 3.31Å; L137-F185 HydrophobicContact CD1-CG 3.95Å; L137-F185 HydrophobicContact CD1-CZ 4.19Å; L137-F185 HydrophobicContact CD2-CB 4.2Å; L137-F185 HydrophobicContact CD2-CD1 3.72Å; L137-F185 HydrophobicContact CD2-CG 4.32Å; L137-F185 HydrophobicContact CG-CD1 4.03Å; L137-F185 HydrophobicContact CG-CE1 4.47Å; L137-M186 HydrophobicContact CD2-CG 4.25Å
138I80.8Confident81.6Confident7 Ų763.3 Ų63.34%0.03633%0.327CS..Hα-helixtrans-61.1-42.7177.5-69.6163.2000110.2N134 V135 L141 A142 L182 M186 G343 A347N134-I138 WeakPolarHBondContact O-CG1 3.42Å; N134-I138 PolarHBondContact O-N 2.87Å; N134-I138 VanDerWaalsContact O-N 3.1Å; V135-I138 PolarHBondContact O-N 3.5Å; I138-L141 PolarHBondContact O-N 2.95Å; I138-A142 WeakPolarHBondContact O-CB 3.3Å; I138-A142 PolarHBondContact O-N 3.45Å; I138-L182 HydrophobicContact CG1-CD1 4.37Å; I138-L182 HydrophobicContact CG1-CD2 4.2Å; I138-M186 HydrophobicContact CD1-CE 3.48Å; I138-M186 VanDerWaalsContact CD1-CE 3.48Å; I138-M186 HydrophobicContact CD1-SD 4.34Å; I138-M186 HydrophobicContact CG1-CE 4.17Å; I138-G343 WeakPolarHBondContact CD1-O 3.46Å; I138-A347 HydrophobicContact CD1-CB 3.71Å
139L82.4Confident81.2Confident105 Ų10563.8 Ų63.855%0.5533%0.328SS..Hα-helixtrans-64.2-46.5177.8-175.268.7000111.4V135 G136 L137 L141 A142 I143V135-L139 WeakPolarHBondContact O-CB 3.35Å; V135-L139 PolarHBondContact O-N 3.46Å; G136-L139 PolarHBondContact O-N 3.41Å; L137-L139 VanDerWaalsContact C-N 3.29Å; L137-L139 PolarHBondContact O-N 2.83Å; L139-L141 VanDerWaalsContact C-N 3.26Å; L139-L141 PolarHBondContact O-N 3.44Å; L139-A142 PolarHBondContact O-N 2.96Å; L139-I143 HydrophobicContact CD1-CD1 4.49Å; L139-I143 HydrophobicContact CG-CD1 4Å; L139-I143 WeakPolarHBondContact O-CB 3.36Å; L139-I143 VanDerWaalsContact O-CG1 3.24Å; L139-I143 WeakPolarHBondContact O-CG1 3.32Å; L139-I143 PolarHBondContact O-N 2.9Å
140A83.5Confident81.1Confident44 Ų4461 Ų6136%0.36432%0.322SS..Hα-helixtrans-58.5-41176.600000111.4G136 L137 I143 I144G136-A140 VanDerWaalsContact O-CB 3.3Å; G136-A140 WeakPolarHBondContact O-CB 3.35Å; G136-A140 PolarHBondContact O-N 3.49Å; L137-A140 PolarHBondContact O-N 3.36Å; A140-I143 WeakPolarHBondContact O-CB 3.39Å; A140-I143 PolarHBondContact O-N 2.92Å; A140-I144 VanDerWaalsContact O-CG1 3.25Å; A140-I144 WeakPolarHBondContact O-CG1 3.34Å; A140-I144 PolarHBondContact O-N 2.87Å
141L78.5Confident80.8Confident38 Ų3865.1 Ų65.120%0.19934%0.343CS..Hα-helixtrans-73.9-34.1178.2-72.2166000112.9L137 I138 L139 I143 I144 S145 V178 L182L137-L141 HydrophobicContact CD2-CD1 4Å; L137-L141 HydrophobicContact CG-CD1 3.96Å; L137-L141 WeakPolarHBondContact O-CB 3.35Å; L137-L141 WeakPolarHBondContact O-CG 3.48Å; L137-L141 PolarHBondContact O-N 3.21Å; I138-L141 PolarHBondContact O-N 2.95Å; L139-L141 VanDerWaalsContact C-N 3.26Å; L139-L141 PolarHBondContact O-N 3.44Å; L141-I143 VanDerWaalsContact C-N 3.31Å; L141-I144 HydrophobicContact CD2-CD1 4.23Å; L141-I144 PolarHBondContact O-N 3.3Å; L141-S145 VanDerWaalsContact O-CB 3.25Å; L141-S145 WeakPolarHBondContact O-CB 3.27Å; L141-S145 PolarHBondContact O-N 3Å; L141-V178 HydrophobicContact CD2-CG1 3.94Å; L141-L182 HydrophobicContact CB-CD1 4.04Å; L141-L182 HydrophobicContact CD1-CB 3.8Å; L141-L182 HydrophobicContact CD1-CD1 3.22Å; L141-L182 HydrophobicContact CD1-CG 3.36Å; L141-L182 HydrophobicContact CG-CD1 4.24Å
142A78.5Confident80.1Confident27 Ų2762.5 Ų62.522%0.22334%0.34CS..Hα-helixtrans-62.2-41.9170.400000111I138 L139 S145 Y146 I339I138-A142 WeakPolarHBondContact O-CB 3.3Å; I138-A142 PolarHBondContact O-N 3.45Å; L139-A142 PolarHBondContact O-N 2.96Å; A142-S145 PolarHBondContact O-N 3.16Å; A142-Y146 VanDerWaalsContact O-CB 3.29Å; A142-Y146 WeakPolarHBondContact O-CB 3.25Å; A142-Y146 PolarHBondContact O-N 2.98Å; A142-I339 HydrophobicContact CB-CG2 3.6Å
143I82.8Confident79.3Confident78 Ų7863.1 Ų63.140%0.434%0.343SS..Hα-helixtrans-63.8-47.4175-69.7165.8000110.6L139 A140 L141 S145 Y146 F147L139-I143 HydrophobicContact CD1-CD1 4.49Å; L139-I143 HydrophobicContact CG-CD1 4Å; L139-I143 WeakPolarHBondContact O-CB 3.36Å; L139-I143 VanDerWaalsContact O-CG1 3.24Å; L139-I143 WeakPolarHBondContact O-CG1 3.32Å; L139-I143 PolarHBondContact O-N 2.9Å; A140-I143 WeakPolarHBondContact O-CB 3.39Å; A140-I143 PolarHBondContact O-N 2.92Å; L141-I143 VanDerWaalsContact C-N 3.31Å; I143-S145 PolarHBondContact O-N 3.36Å; I143-Y146 WeakPolarHBondContact O-CB 3.41Å; I143-Y146 PolarHBondContact O-N 3.46Å; I143-F147 HydrophobicContact CG2-CD2 3.64Å; I143-F147 HydrophobicContact CG2-CE2 3.3Å; I143-F147 HydrophobicContact CG2-CZ 4.39Å; I143-F147 WeakPolarHBondContact O-CD2 3.02Å; I143-F147 PolarHBondContact O-N 3.46Å
144I82.5Confident78.6Confident77 Ų7763.6 Ų63.640%0.39535%0.349SS..Hα-helixtrans-60.4-47.3176.6-70.3163.2000110.4A140 L141 Y146 F147 F148A140-I144 VanDerWaalsContact O-CG1 3.25Å; A140-I144 WeakPolarHBondContact O-CG1 3.34Å; A140-I144 PolarHBondContact O-N 2.87Å; L141-I144 HydrophobicContact CD2-CD1 4.23Å; L141-I144 PolarHBondContact O-N 3.3Å; I144-Y146 VanDerWaalsContact C-N 3.27Å; I144-Y146 PolarHBondContact O-N 3.17Å; I144-F147 WeakPolarHBondContact O-CB 3.36Å; I144-F147 PolarHBondContact O-N 3.43Å; I144-F147 VanDerWaalsContact O-N 3.15Å; I144-F148 HydrophobicContact CG2-CD2 3.7Å; I144-F148 HydrophobicContact CG2-CE2 3.66Å; I144-F148 VanDerWaalsContact O-CD2 3.29Å; I144-F148 WeakPolarHBondContact O-CD2 3.31Å; I144-F148 PolarHBondContact O-N 3.45Å
145S77.1Confident78Confident40 Ų4069.1 Ų69.128%0.2838%0.384SS..Hα-helixtrans-61.3-36.7177.4-171.20000112.1L141 A142 I143 F148 S149L141-S145 VanDerWaalsContact O-CB 3.25Å; L141-S145 WeakPolarHBondContact O-CB 3.27Å; L141-S145 PolarHBondContact O-N 3Å; A142-S145 PolarHBondContact O-N 3.16Å; I143-S145 PolarHBondContact O-N 3.36Å; S145-F148 PolarHBondContact O-N 3.24Å; S145-S149 WeakPolarHBondContact O-CB 3.43Å; S145-S149 PolarHBondContact O-N 3.06Å; S145-S149 PolarHBondContact O-OG 3.29Å
146Y80.1Confident77.4Confident145 Ų14572.1 Ų72.157%0.56941%0.407SS*.Hα-helixtrans-65.1-45.6173.9178.5-104.3000111.2A142 I143 I144 F148 S149 L150A142-Y146 VanDerWaalsContact O-CB 3.29Å; A142-Y146 WeakPolarHBondContact O-CB 3.25Å; A142-Y146 PolarHBondContact O-N 2.98Å; I143-Y146 WeakPolarHBondContact O-CB 3.41Å; I143-Y146 PolarHBondContact O-N 3.46Å; I144-Y146 VanDerWaalsContact C-N 3.27Å; I144-Y146 PolarHBondContact O-N 3.17Å; Y146-F148 VanDerWaalsContact C-N 3.34Å; Y146-F148 PolarHBondContact O-N 3.33Å; Y146-S149 CarbonylContact O-C 3.57Å; Y146-S149 WeakPolarHBondContact O-CA 3.26Å; Y146-S149 WeakPolarHBondContact O-CB 3.48Å; Y146-S149 PolarHBondContact O-N 3.2Å; Y146-L150 HydrophobicContact CD1-CD1 4.03Å; Y146-L150 HydrophobicContact CE1-CD1 3.59Å; Y146-L150 HydrophobicContact CE1-CG 4.19Å; Y146-L150 WeakPolarHBondContact O-CG 3.31Å; Y146-L150 PolarHBondContact O-N 3.44Å
147F81.7Confident76.4Confident127 Ų12774.4 Ų74.456%0.55741%0.41SS*.Hα-helixtrans-59.5-41.9174.1-77.6-62.1000112.7I143 I144 S149 L150 I151I143-F147 HydrophobicContact CG2-CD2 3.64Å; I143-F147 HydrophobicContact CG2-CE2 3.3Å; I143-F147 HydrophobicContact CG2-CZ 4.39Å; I143-F147 WeakPolarHBondContact O-CD2 3.02Å; I143-F147 PolarHBondContact O-N 3.46Å; I144-F147 WeakPolarHBondContact O-CB 3.36Å; I144-F147 PolarHBondContact O-N 3.43Å; I144-F147 VanDerWaalsContact O-N 3.15Å; F147-S149 VanDerWaalsContact C-N 3.28Å; F147-S149 PolarHBondContact O-N 2.93Å; F147-L150 HydrophobicContact CD1-CD1 4.25Å; F147-L150 WeakPolarHBondContact O-CB 3.24Å; F147-L150 PolarHBondContact O-N 2.82Å; F147-L150 VanDerWaalsContact O-N 3.09Å; F147-I151 PolarHBondContact O-N 3Å
148F76.2Confident75.6Confident88 Ų8875 Ų7539%0.38642%0.415SS..Hα-helixtrans-63.2-35.1173.5-86.9-78.1000112.6I144 S145 Y146 L150 I151 P152 F174I144-F148 HydrophobicContact CG2-CD2 3.7Å; I144-F148 HydrophobicContact CG2-CE2 3.66Å; I144-F148 VanDerWaalsContact O-CD2 3.29Å; I144-F148 WeakPolarHBondContact O-CD2 3.31Å; I144-F148 PolarHBondContact O-N 3.45Å; S145-F148 PolarHBondContact O-N 3.24Å; Y146-F148 VanDerWaalsContact C-N 3.34Å; Y146-F148 PolarHBondContact O-N 3.33Å; F148-L150 PolarHBondContact O-N 3.32Å; F148-I151 HydrophobicContact CD1-CD1 3.58Å; F148-I151 HydrophobicContact CE1-CD1 4.01Å; F148-I151 HydrophobicContact CG-CD1 4.29Å; F148-I151 WeakPolarHBondContact O-CB 3.04Å; F148-I151 PolarHBondContact O-N 3.43Å; F148-P152 VanDerWaalsContact O-CD 3.31Å; F148-P152 WeakPolarHBondContact O-CD 3.38Å; F148-F174 HydrophobicContact CD1-CE1 4.45Å; F148-F174 HydrophobicContact CD2-CE1 4.08Å; F148-F174 HydrophobicContact CD2-CZ 4.49Å; F148-F174 HydrophobicContact CE1-CE1 4.29Å; F148-F174 HydrophobicContact CE1-CZ 4.47Å; F148-F174 AromaticContact CE2-CE1 3.9Å; F148-F174 HydrophobicContact CE2-CE1 3.9Å; F148-F174 AromaticContact CE2-CZ 3.86Å; F148-F174 HydrophobicContact CE2-CZ 3.86Å; F148-F174 HydrophobicContact CG-CE1 4.37Å; F148-F174 HydrophobicContact CZ-CE1 4.02Å; F148-F174 AromaticContact CZ-CZ 3.86Å; F148-F174 HydrophobicContact CZ-CZ 3.86Å
149S74.6Confident75.1Confident63 Ų6378.7 Ų78.744%0.44144%0.441SS..Hα-helixtrans-70.9-17.8175.4-53.80000112.9S145 Y146 F147 P152S145-S149 WeakPolarHBondContact O-CB 3.43Å; S145-S149 PolarHBondContact O-N 3.06Å; S145-S149 PolarHBondContact O-OG 3.29Å; Y146-S149 CarbonylContact O-C 3.57Å; Y146-S149 WeakPolarHBondContact O-CA 3.26Å; Y146-S149 WeakPolarHBondContact O-CB 3.48Å; Y146-S149 PolarHBondContact O-N 3.2Å; F147-S149 VanDerWaalsContact C-N 3.28Å; F147-S149 PolarHBondContact O-N 2.93Å; S149-P152 WeakPolarHBondContact O-CD 3.43Å; S149-P152 VanDerWaalsContact O-CG 3.31Å; S149-P152 WeakPolarHBondContact O-CG 3.32Å
150L79.9Confident74.5Confident65 Ų6581.5 Ų81.534%0.3445%0.445SS..Hα-helixtrans-83.4-22.6173.7-69.3172.8000113.5Y146 F147 F148 L153Y146-L150 HydrophobicContact CD1-CD1 4.03Å; Y146-L150 HydrophobicContact CE1-CD1 3.59Å; Y146-L150 HydrophobicContact CE1-CG 4.19Å; Y146-L150 WeakPolarHBondContact O-CG 3.31Å; Y146-L150 PolarHBondContact O-N 3.44Å; F147-L150 HydrophobicContact CD1-CD1 4.25Å; F147-L150 WeakPolarHBondContact O-CB 3.24Å; F147-L150 PolarHBondContact O-N 2.82Å; F147-L150 VanDerWaalsContact O-N 3.09Å; F148-L150 PolarHBondContact O-N 3.32Å; L150-L153 HydrophobicContact CD2-CD1 4.32Å; L150-L153 WeakPolarHBondContact O-CB 3.26Å; L150-L153 PolarHBondContact O-N 3.14Å
151I74.7Confident73.6Confident86 Ų8682.8 Ų82.844%0.44144%0.442SS..G310 helixtrans-55.3-44.2177.6-61.2175000112.5F147 F148 L153 T154F147-I151 PolarHBondContact O-N 3Å; F148-I151 HydrophobicContact CD1-CD1 3.58Å; F148-I151 HydrophobicContact CE1-CD1 4.01Å; F148-I151 HydrophobicContact CG-CD1 4.29Å; F148-I151 WeakPolarHBondContact O-CB 3.04Å; F148-I151 PolarHBondContact O-N 3.43Å; I151-L153 PolarHBondContact O-N 3.22Å; I151-L153 VanDerWaalsContact O-N 3.14Å; I151-T154 PolarHBondContact O-N 3.42Å; I151-T154 PolarHBondContact O-OG1 3.25Å; I151-T154 VanDerWaalsContact O-OG1 3.12Å
152P65.8Low73Confident53 Ų5387.8 Ų87.834%0.34447%0.465SS..G310 helixtrans-65.2-11.4176.123.6-32.9000113.7F148 S149 T154 V158F148-P152 VanDerWaalsContact O-CD 3.31Å; F148-P152 WeakPolarHBondContact O-CD 3.38Å; S149-P152 WeakPolarHBondContact O-CD 3.43Å; S149-P152 VanDerWaalsContact O-CG 3.31Å; S149-P152 WeakPolarHBondContact O-CG 3.32Å; P152-T154 PolarHBondContact O-N 2.87Å; P152-T154 VanDerWaalsContact O-N 3.1Å; P152-V158 WeakPolarHBondContact O-CG2 3.45Å
153L68.5Low72.8Confident128 Ų12891.4 Ų91.467%0.6749%0.489SS*.G310 helixtrans-69.5-7.5178.4-87.382.2000114.3L150 I151 P155L150-L153 HydrophobicContact CD2-CD1 4.32Å; L150-L153 WeakPolarHBondContact O-CB 3.26Å; L150-L153 PolarHBondContact O-N 3.14Å; I151-L153 PolarHBondContact O-N 3.22Å; I151-L153 VanDerWaalsContact O-N 3.14Å; L153-P155 WeakPolarHBondContact O-CD 3.21Å
154T70.6Confident72.6Confident64 Ų6489 Ų8939%0.39348%0.479SS..SBendtrans-74.1115171.2500000110.6I151 P152 S156 L157 V158I151-T154 PolarHBondContact O-N 3.42Å; I151-T154 PolarHBondContact O-OG1 3.25Å; I151-T154 VanDerWaalsContact O-OG1 3.12Å; P152-T154 PolarHBondContact O-N 2.87Å; P152-T154 VanDerWaalsContact O-N 3.1Å; T154-S156 PolarHBondContact O-N 2.85Å; T154-L157 PolarHBondContact O-N 3.4Å; T154-V158 PolarHBondContact O-N 2.82Å
155P69.5Low72.5Confident116 Ų11696.2 Ų96.275%0.75350%0.501SS*.Hα-helixtrans-62.1-24-165.821.4-32.8000114.6L153L153-P155 WeakPolarHBondContact O-CD 3.21Å
156S70.3Confident72.7Confident96 Ų96101.2 Ų101.267%0.67152%0.518SS*.Hα-helixtrans-77.1-25.9177.556.50000114T154T154-S156 PolarHBondContact O-N 2.85Å
157L64.3Low72.5Confident82 Ų8294.9 Ų94.943%0.42950%0.495SS..Hα-helixtrans-90.5-27.7-179-70.8176.5000112.5T154 S159 W160 F161T154-L157 PolarHBondContact O-N 3.4Å; L157-S159 PolarHBondContact O-N 3.21Å; L157-W160 PolarHBondContact O-N 3.28Å; L157-F161 WeakPolarHBondContact O-CB 3.28Å; L157-F161 PolarHBondContact O-N 3.36Å
158V66.2Low72.2Confident46 Ų4693.7 Ų93.728%0.27949%0.491SS..Hα-helixtrans-52-52-178-179.30000111.9P152 T154 W160 F161 E162P152-V158 WeakPolarHBondContact O-CG2 3.45Å; T154-V158 PolarHBondContact O-N 2.82Å; V158-W160 VanDerWaalsContact C-N 3.3Å; V158-W160 PolarHBondContact O-N 2.82Å; V158-F161 PolarHBondContact O-N 2.94Å; V158-F161 VanDerWaalsContact O-N 3.16Å; V158-E162 HydrophobicContact CG1-CG 4.21Å; V158-E162 WeakPolarHBondContact O-CB 3.28Å; V158-E162 PolarHBondContact O-N 2.93Å
159S70.3Confident72.3Confident84 Ų8495.3 Ų95.359%0.58750%0.498SS*.Hα-helixtrans-64.8-37.3-172.563.30000112L157 S163L157-S159 PolarHBondContact O-N 3.21Å; S159-S163 WeakPolarHBondContact O-CB 3.45Å; S159-S163 PolarHBondContact O-N 2.66Å
160W68.7Low72.5Confident164 Ų16495.5 Ų95.562%0.62150%0.496SS*.Hα-helixtrans-72.2-39.2175.6-17078.9000111.8L157 V158 S164L157-W160 PolarHBondContact O-N 3.28Å; V158-W160 VanDerWaalsContact C-N 3.3Å; V158-W160 PolarHBondContact O-N 2.82Å; W160-S164 VanDerWaalsContact O-CB 3.31Å; W160-S164 WeakPolarHBondContact O-CB 3.16Å; W160-S164 PolarHBondContact O-N 3.31Å
161F64.4Low72.3Confident71 Ų7196.6 Ų96.631%0.31150%0.499SS..Hα-helixtrans-71.1-43.9-177.9-141.6-82.1000112.3L157 V158 S164 C167L157-F161 WeakPolarHBondContact O-CB 3.28Å; L157-F161 PolarHBondContact O-N 3.36Å; V158-F161 PolarHBondContact O-N 2.94Å; V158-F161 VanDerWaalsContact O-N 3.16Å; F161-S164 PolarHBondContact O-N 2.92Å; F161-C167 HydrophobicContact CD1-CB 3.84Å; F161-C167 HydrophobicContact CD2-CB 4.45Å; F161-C167 WeakPolarHBondContact CD2-SG 3.34Å; F161-C167 HydrophobicContact CE1-CB 3.87Å; F161-C167 WeakPolarHBondContact CE1-SG 3.27Å; F161-C167 HydrophobicContact CE2-CB 4.49Å; F161-C167 WeakPolarHBondContact CE2-SG 3.4Å; F161-C167 HydrophobicContact CG-CB 4.16Å; F161-C167 HydrophobicContact CZ-CB 4.22Å; F161-C167 WeakPolarHBondContact CZ-SG 3.47Å
162E66.7Low72.2Confident144 Ų144100.8 Ų100.867%0.67351%0.51SS*.Hα-helixtrans-67.5-36.9177.5-80.6-166.214800112.4V158 S164V158-E162 HydrophobicContact CG1-CG 4.21Å; V158-E162 WeakPolarHBondContact O-CB 3.28Å; V158-E162 PolarHBondContact O-N 2.93Å; E162-S164 VanDerWaalsContact C-N 3.28Å; E162-S164 PolarHBondContact O-N 3.39Å
163S73Confident72.7Confident103 Ų103102.7 Ų102.772%0.7252%0.516SS*.Hα-helixtrans-73.2-23179.8-174.40000112.8S159 R165S159-S163 WeakPolarHBondContact O-CB 3.45Å; S159-S163 PolarHBondContact O-N 2.66Å; S163-R165 PolarHBondContact O-N 3.36Å
164S79.5Confident73Confident27 Ų27100.9 Ų100.919%0.18950%0.503CS..  trans-92.2102.8-172.1-178.80000111.5W160 F161 E162 F166 C167 H168W160-S164 VanDerWaalsContact O-CB 3.31Å; W160-S164 WeakPolarHBondContact O-CB 3.16Å; W160-S164 PolarHBondContact O-N 3.31Å; F161-S164 PolarHBondContact O-N 2.92Å; E162-S164 VanDerWaalsContact C-N 3.28Å; E162-S164 PolarHBondContact O-N 3.39Å; S164-F166 PolarHBondContact O-N 2.91Å; S164-F166 VanDerWaalsContact O-N 3.12Å; S164-C167 WeakPolarHBondContact O-CB 3.4Å; S164-C167 PolarHBondContact O-N 2.94Å; S164-C167 PolarHBondContact OG-N 3.25Å; S164-H168 PolarHBondContact O-N 3.28Å
165R81.1Confident73.2Confident229 Ų22999.6 Ų99.686%0.86450%0.497SS*.Hα-helixtrans-52.2-32.8169.4-70.3-171.7178.9177.10.9112.4S163 C167 F169S163-R165 PolarHBondContact O-N 3.36Å; R165-C167 VanDerWaalsContact C-N 3.34Å; R165-F169 WeakPolarHBondContact O-CB 3.24Å; R165-F169 PolarHBondContact O-N 2.79Å
166F79.7Confident73.3Confident144 Ų14496.5 Ų96.563%0.63248%0.477SS*.Hα-helixtrans-63-41176.3-180-101.4000111.6S164 F169 V170S164-F166 PolarHBondContact O-N 2.91Å; S164-F166 VanDerWaalsContact O-N 3.12Å; F166-F169 WeakPolarHBondContact O-CB 3.36Å; F166-F169 PolarHBondContact O-N 3.46Å; F166-V170 HydrophobicContact CD1-CG2 4.16Å; F166-V170 HydrophobicContact CE1-CG2 3.73Å; F166-V170 HydrophobicContact CE2-CG2 4.16Å; F166-V170 HydrophobicContact CZ-CG2 3.73Å; F166-V170 WeakPolarHBondContact O-CG2 3.33Å; F166-V170 PolarHBondContact O-N 3.34Å
167C77.3Confident73.4Confident13 Ų1395.4 Ų95.49%0.08847%0.47CS..Hα-helixtrans-66.4-43.8179.8-133.70000112.5F161 S164 R165 F169 V170 H171F161-C167 HydrophobicContact CD1-CB 3.84Å; F161-C167 HydrophobicContact CD2-CB 4.45Å; F161-C167 WeakPolarHBondContact CD2-SG 3.34Å; F161-C167 HydrophobicContact CE1-CB 3.87Å; F161-C167 WeakPolarHBondContact CE1-SG 3.27Å; F161-C167 HydrophobicContact CE2-CB 4.49Å; F161-C167 WeakPolarHBondContact CE2-SG 3.4Å; F161-C167 HydrophobicContact CG-CB 4.16Å; F161-C167 HydrophobicContact CZ-CB 4.22Å; F161-C167 WeakPolarHBondContact CZ-SG 3.47Å; S164-C167 WeakPolarHBondContact O-CB 3.4Å; S164-C167 PolarHBondContact O-N 2.94Å; S164-C167 PolarHBondContact OG-N 3.25Å; R165-C167 VanDerWaalsContact C-N 3.34Å; C167-F169 VanDerWaalsContact C-N 3.28Å; C167-F169 PolarHBondContact O-N 3.4Å; C167-V170 PolarHBondContact O-N 2.88Å; C167-H171 WeakPolarHBondContact O-CB 3.37Å; C167-H171 PolarHBondContact O-N 3.37Å
168H74.5Confident73.8Confident101 Ų10193.3 Ų93.347%0.46846%0.46SS..Hα-helixtrans-59.7-39.4172.7-78.8-68.9000112.5S164 R172S164-H168 PolarHBondContact O-N 3.28Å; H168-R172 VanDerWaalsContact O-CB 3.29Å; H168-R172 WeakPolarHBondContact O-CB 3.46Å; H168-R172 PolarHBondContact O-N 2.88Å
169F78.3Confident74Confident123 Ų12394.1 Ų94.154%0.53946%0.461SS..Hα-helixtrans-63.9-48.5175.7177-104.2000111.9R165 F166 C167 H171 R172 L173R165-F169 WeakPolarHBondContact O-CB 3.24Å; R165-F169 PolarHBondContact O-N 2.79Å; F166-F169 WeakPolarHBondContact O-CB 3.36Å; F166-F169 PolarHBondContact O-N 3.46Å; C167-F169 VanDerWaalsContact C-N 3.28Å; C167-F169 PolarHBondContact O-N 3.4Å; F169-H171 PolarHBondContact O-N 3.27Å; F169-R172 PolarHBondContact O-N 3.5Å; F169-L173 HydrophobicContact CD1-CD1 3.93Å; F169-L173 HydrophobicContact CD1-CG 4.48Å; F169-L173 HydrophobicContact CE1-CD1 3.3Å; F169-L173 HydrophobicContact CE1-CG 4.1Å; F169-L173 HydrophobicContact CE2-CD1 4.26Å; F169-L173 HydrophobicContact CE2-CG 4.26Å; F169-L173 HydrophobicContact CZ-CD1 3.5Å; F169-L173 HydrophobicContact CZ-CD2 4.34Å; F169-L173 HydrophobicContact CZ-CG 3.98Å; F169-L173 WeakPolarHBondContact O-CG 3.43Å; F169-L173 PolarHBondContact O-N 3.24Å
170V78.8Confident74.1Confident66 Ų6693.1 Ų93.140%0.445%0.448SS..Hα-helixtrans-61.3-44.6177.1173.10000111.3F166 C167 R172 L173 F174F166-V170 HydrophobicContact CD1-CG2 4.16Å; F166-V170 HydrophobicContact CE1-CG2 3.73Å; F166-V170 HydrophobicContact CE2-CG2 4.16Å; F166-V170 HydrophobicContact CZ-CG2 3.73Å; F166-V170 WeakPolarHBondContact O-CG2 3.33Å; F166-V170 PolarHBondContact O-N 3.34Å; C167-V170 PolarHBondContact O-N 2.88Å; V170-R172 VanDerWaalsContact C-N 3.33Å; V170-R172 PolarHBondContact O-N 3.38Å; V170-L173 PolarHBondContact O-N 3.07Å; V170-F174 WeakPolarHBondContact O-CB 3.46Å; V170-F174 PolarHBondContact O-N 3.3Å
171H76.2Confident74.3Confident88 Ų8887.6 Ų87.641%0.40744%0.437SS..Hα-helixtrans-60.4-42175.9176.5-96.2000112C167 F169 F174 S175C167-H171 WeakPolarHBondContact O-CB 3.37Å; C167-H171 PolarHBondContact O-N 3.37Å; F169-H171 PolarHBondContact O-N 3.27Å; H171-F174 PolarHBondContact O-N 3.46Å; H171-S175 VanDerWaalsContact O-CB 3.29Å; H171-S175 WeakPolarHBondContact O-CB 3.27Å; H171-S175 PolarHBondContact O-N 3.38Å
172R73.6Confident74.7Confident175 Ų17584.6 Ų84.666%0.6643%0.425SS*.Hα-helixtrans-68.5-37.4178.4-162.3166.7-174.9162.8-0.4112H168 F169 V170 C176H168-R172 VanDerWaalsContact O-CB 3.29Å; H168-R172 WeakPolarHBondContact O-CB 3.46Å; H168-R172 PolarHBondContact O-N 2.88Å; F169-R172 PolarHBondContact O-N 3.5Å; V170-R172 VanDerWaalsContact C-N 3.33Å; V170-R172 PolarHBondContact O-N 3.38Å; R172-C176 WeakPolarHBondContact O-CB 3.35Å; R172-C176 PolarHBondContact O-N 3.17Å
173L74.8Confident74.8Confident93 Ų9379.4 Ų79.449%0.48740%0.401SS..Hα-helixtrans-64.8-45.8171.8-77.8-177.9000112.1F169 V170 C176 S177F169-L173 HydrophobicContact CD1-CD1 3.93Å; F169-L173 HydrophobicContact CD1-CG 4.48Å; F169-L173 HydrophobicContact CE1-CD1 3.3Å; F169-L173 HydrophobicContact CE1-CG 4.1Å; F169-L173 HydrophobicContact CE2-CD1 4.26Å; F169-L173 HydrophobicContact CE2-CG 4.26Å; F169-L173 HydrophobicContact CZ-CD1 3.5Å; F169-L173 HydrophobicContact CZ-CD2 4.34Å; F169-L173 HydrophobicContact CZ-CG 3.98Å; F169-L173 WeakPolarHBondContact O-CG 3.43Å; F169-L173 PolarHBondContact O-N 3.24Å; V170-L173 PolarHBondContact O-N 3.07Å; L173-C176 WeakPolarHBondContact O-CB 3.32Å; L173-C176 PolarHBondContact O-N 2.94Å; L173-S177 WeakPolarHBondContact O-CB 3.27Å; L173-S177 PolarHBondContact O-N 3.48Å
174F76.3Confident74.8Confident89 Ų8977.4 Ų77.439%0.3938%0.382SS..Hα-helixtrans-61.9-48.8177.4177.7-103.5000111.1F148 V170 H171 C176 S177 V178F148-F174 HydrophobicContact CD1-CE1 4.45Å; F148-F174 HydrophobicContact CD2-CE1 4.08Å; F148-F174 HydrophobicContact CD2-CZ 4.49Å; F148-F174 HydrophobicContact CE1-CE1 4.29Å; F148-F174 HydrophobicContact CE1-CZ 4.47Å; F148-F174 AromaticContact CE2-CE1 3.9Å; F148-F174 HydrophobicContact CE2-CE1 3.9Å; F148-F174 AromaticContact CE2-CZ 3.86Å; F148-F174 HydrophobicContact CE2-CZ 3.86Å; F148-F174 HydrophobicContact CG-CE1 4.37Å; F148-F174 HydrophobicContact CZ-CE1 4.02Å; F148-F174 AromaticContact CZ-CZ 3.86Å; F148-F174 HydrophobicContact CZ-CZ 3.86Å; V170-F174 WeakPolarHBondContact O-CB 3.46Å; V170-F174 PolarHBondContact O-N 3.3Å; H171-F174 PolarHBondContact O-N 3.46Å; F174-C176 VanDerWaalsContact C-N 3.31Å; F174-C176 PolarHBondContact O-N 3.03Å; F174-S177 PolarHBondContact O-N 3.36Å; F174-S177 VanDerWaalsContact O-N 3.15Å; F174-V178 HydrophobicContact CD1-CG2 4.2Å; F174-V178 HydrophobicContact CD2-CG2 4.32Å; F174-V178 HydrophobicContact CE1-CG2 3.78Å; F174-V178 HydrophobicContact CE2-CG2 3.9Å; F174-V178 HydrophobicContact CG-CG2 4.46Å; F174-V178 HydrophobicContact CZ-CG2 3.62Å; F174-V178 WeakPolarHBondContact O-CG2 3.02Å; F174-V178 PolarHBondContact O-N 2.98Å
175S73.3Confident74.4Confident38 Ų3880.5 Ų80.527%0.26639%0.392SS..Hα-helixtrans-57.2-44.9175.3-177.10000111.3H171 V178 H179H171-S175 VanDerWaalsContact O-CB 3.29Å; H171-S175 WeakPolarHBondContact O-CB 3.27Å; H171-S175 PolarHBondContact O-N 3.38Å; S175-V178 PolarHBondContact O-N 3.42Å; S175-H179 PolarHBondContact O-N 3.49Å; S175-H179 PolarHBondContact O-ND1 3.3Å
176C71.1Confident74.1Confident51 Ų5170.2 Ų70.235%0.34535%0.354SS..Hα-helixtrans-60.6-46.2174.9-171.80000112.1R172 L173 F174 V178 H179 I180R172-C176 WeakPolarHBondContact O-CB 3.35Å; R172-C176 PolarHBondContact O-N 3.17Å; L173-C176 WeakPolarHBondContact O-CB 3.32Å; L173-C176 PolarHBondContact O-N 2.94Å; F174-C176 VanDerWaalsContact C-N 3.31Å; F174-C176 PolarHBondContact O-N 3.03Å; C176-V178 PolarHBondContact O-N 3.1Å; C176-H179 PolarHBondContact O-N 3.08Å; C176-I180 VanDerWaalsContact O-CG1 3.31Å; C176-I180 WeakPolarHBondContact O-CG1 3.5Å; C176-I180 PolarHBondContact O-N 3.27Å
177S73Confident73.7Confident72 Ų7263.8 Ų63.850%0.50333%0.326SS..Hα-helixtrans-61.3-43178-178.20000111.9L173 F174 I180 A181L173-S177 WeakPolarHBondContact O-CB 3.27Å; L173-S177 PolarHBondContact O-N 3.48Å; F174-S177 PolarHBondContact O-N 3.36Å; F174-S177 VanDerWaalsContact O-N 3.15Å; S177-I180 PolarHBondContact O-N 2.89Å; S177-A181 VanDerWaalsContact O-CB 3.27Å; S177-A181 WeakPolarHBondContact O-CB 3.35Å; S177-A181 PolarHBondContact O-N 2.88Å
178V72.9Confident73.5Confident39 Ų3967.5 Ų67.524%0.23635%0.345CS..Hα-helixtrans-63.3-41.9175.1171.40000111.2L141 F174 S175 C176 A181 L182L141-V178 HydrophobicContact CD2-CG1 3.94Å; F174-V178 HydrophobicContact CD1-CG2 4.2Å; F174-V178 HydrophobicContact CD2-CG2 4.32Å; F174-V178 HydrophobicContact CE1-CG2 3.78Å; F174-V178 HydrophobicContact CE2-CG2 3.9Å; F174-V178 HydrophobicContact CG-CG2 4.46Å; F174-V178 HydrophobicContact CZ-CG2 3.62Å; F174-V178 WeakPolarHBondContact O-CG2 3.02Å; F174-V178 PolarHBondContact O-N 2.98Å; S175-V178 PolarHBondContact O-N 3.42Å; C176-V178 PolarHBondContact O-N 3.1Å; V178-A181 PolarHBondContact O-N 3.4Å; V178-L182 VanDerWaalsContact O-CB 3.32Å; V178-L182 WeakPolarHBondContact O-CB 3.35Å; V178-L182 PolarHBondContact O-N 3.46Å
179H71.2Confident73.5Confident63 Ų6363.1 Ų63.129%0.29233%0.325SS..Hα-helixtrans-63.2-42.3176.1-7979000112S175 C176 L182 L183 F338S175-H179 PolarHBondContact O-N 3.49Å; S175-H179 PolarHBondContact O-ND1 3.3Å; C176-H179 PolarHBondContact O-N 3.08Å; H179-L182 PolarHBondContact O-N 3.01Å; H179-L183 PolarHBondContact O-N 2.89Å; H179-L183 VanDerWaalsContact O-N 3.13Å; H179-F338 AromaticContact CD2-CD1 3.74Å
180I72.2Confident73.3Confident62 Ų6257.5 Ų57.532%0.31830%0.301SS..Hα-helixtrans-64.8-45.9175.7-66.7167.8000110.4C176 S177 L182 L183 L184 M259 L263C176-I180 VanDerWaalsContact O-CG1 3.31Å; C176-I180 WeakPolarHBondContact O-CG1 3.5Å; C176-I180 PolarHBondContact O-N 3.27Å; S177-I180 PolarHBondContact O-N 2.89Å; I180-L182 VanDerWaalsContact C-N 3.32Å; I180-L182 PolarHBondContact O-N 2.87Å; I180-L183 WeakPolarHBondContact O-CB 3.48Å; I180-L183 PolarHBondContact O-N 3.21Å; I180-L184 PolarHBondContact O-N 3.01Å; I180-M259 HydrophobicContact CG2-CE 3.96Å; I180-M259 HydrophobicContact CG2-SD 3.69Å; I180-L263 HydrophobicContact CD1-CD1 4.41Å
181A72.1Confident73Confident48 Ų4856.2 Ų56.240%0.39729%0.291SS..Hα-helixtrans-63.6-35.8178.400000112.5S177 V178 L184 F185S177-A181 VanDerWaalsContact O-CB 3.27Å; S177-A181 WeakPolarHBondContact O-CB 3.35Å; S177-A181 PolarHBondContact O-N 2.88Å; V178-A181 PolarHBondContact O-N 3.4Å; A181-L184 WeakPolarHBondContact O-CB 3.46Å; A181-L184 PolarHBondContact O-N 3.35Å; A181-F185 WeakPolarHBondContact O-CB 2.91Å; A181-F185 PolarHBondContact O-N 3.47Å
182L72.1Confident72.9Confident9 Ų957.1 Ų57.15%0.04730%0.299CS..Hα-helixtrans-62.5-47174-165.3163.5000110.3L137 I138 L141 V178 H179 I180 L184 F185 M186 F338L137-L182 HydrophobicContact CD2-CD2 4.1Å; L137-L182 HydrophobicContact CD2-CG 3.85Å; I138-L182 HydrophobicContact CG1-CD1 4.37Å; I138-L182 HydrophobicContact CG1-CD2 4.2Å; L141-L182 HydrophobicContact CB-CD1 4.04Å; L141-L182 HydrophobicContact CD1-CB 3.8Å; L141-L182 HydrophobicContact CD1-CD1 3.22Å; L141-L182 HydrophobicContact CD1-CG 3.36Å; L141-L182 HydrophobicContact CG-CD1 4.24Å; V178-L182 VanDerWaalsContact O-CB 3.32Å; V178-L182 WeakPolarHBondContact O-CB 3.35Å; V178-L182 PolarHBondContact O-N 3.46Å; H179-L182 PolarHBondContact O-N 3.01Å; I180-L182 VanDerWaalsContact C-N 3.32Å; I180-L182 PolarHBondContact O-N 2.87Å; L182-L184 VanDerWaalsContact C-N 3.35Å; L182-L184 PolarHBondContact O-N 2.94Å; L182-F185 PolarHBondContact O-N 3.12Å; L182-M186 HydrophobicContact CD2-CG 3.99Å; L182-M186 HydrophobicContact CD2-SD 3.82Å; L182-M186 WeakPolarHBondContact O-CB 3.44Å; L182-M186 PolarHBondContact O-N 3.37Å; L182-F338 HydrophobicContact CD1-CE1 3.87Å; L182-F338 HydrophobicContact CD2-CE1 3.7Å; L182-F338 HydrophobicContact CD2-CZ 3.89Å; L182-F338 HydrophobicContact CG-CE1 4.26Å
183L70.9Confident73Confident34 Ų3451.1 Ų51.118%0.17828%0.276CS..Hα-helixtrans-60.7-44.3176.9-164.1121.7000111.3H179 I180 E187 M259 L289H179-L183 PolarHBondContact O-N 2.89Å; H179-L183 VanDerWaalsContact O-N 3.13Å; I180-L183 WeakPolarHBondContact O-CB 3.48Å; I180-L183 PolarHBondContact O-N 3.21Å; L183-E187 WeakPolarHBondContact O-CB 3.45Å; L183-E187 PolarHBondContact O-N 2.84Å; L183-M259 HydrophobicContact CB-CE 4.32Å; L183-M259 HydrophobicContact CD2-CE 3.48Å; L183-M259 VanDerWaalsContact CD2-CE 3.48Å; L183-L289 HydrophobicContact CD1-CD2 4.41Å
184L71.1Confident72.9Confident61 Ų6146.7 Ų46.732%0.31925%0.253SS..Hα-helixtrans-58.1-47.9173.3-78.1176.2000112.6I180 A181 L182 E187 L188 L255 M259I180-L184 PolarHBondContact O-N 3.01Å; A181-L184 WeakPolarHBondContact O-CB 3.46Å; A181-L184 PolarHBondContact O-N 3.35Å; L182-L184 VanDerWaalsContact C-N 3.35Å; L182-L184 PolarHBondContact O-N 2.94Å; L184-E187 WeakPolarHBondContact O-CB 3.49Å; L184-E187 PolarHBondContact O-N 3.33Å; L184-L188 WeakPolarHBondContact O-CB 3.37Å; L184-L188 PolarHBondContact O-N 2.88Å; L184-L255 HydrophobicContact CD2-CD1 3.77Å; L184-L255 HydrophobicContact CD2-CD2 3.23Å; L184-L255 HydrophobicContact CD2-CG 3.78Å; L184-M259 HydrophobicContact CB-CE 4.3Å; L184-M259 HydrophobicContact CD1-CE 4.3Å; L184-M259 HydrophobicContact CD1-SD 3.95Å; L184-M259 HydrophobicContact CD2-CE 3.31Å; L184-M259 HydrophobicContact CD2-CG 4.39Å; L184-M259 HydrophobicContact CD2-SD 3.31Å; L184-M259 WeakPolarHBondContact CD2-SD 3.3Å; L184-M259 HydrophobicContact CG-CE 3.31Å; L184-M259 HydrophobicContact CG-SD 3.52Å; L184-M259 VanDerWaalsContact CG-SD 3.52Å
185F72.3Confident72.7Confident92 Ų9249.2 Ų49.240%0.40426%0.264SS..Hα-helixtrans-70.7-42.4-175-169.1-85.4000111.1L137 A181 L182 E187 L188 V189L137-F185 HydrophobicContact CD1-CD1 3.17Å; L137-F185 HydrophobicContact CD1-CE1 3.31Å; L137-F185 HydrophobicContact CD1-CG 3.95Å; L137-F185 HydrophobicContact CD1-CZ 4.19Å; L137-F185 HydrophobicContact CD2-CB 4.2Å; L137-F185 HydrophobicContact CD2-CD1 3.72Å; L137-F185 HydrophobicContact CD2-CG 4.32Å; L137-F185 HydrophobicContact CG-CD1 4.03Å; L137-F185 HydrophobicContact CG-CE1 4.47Å; A181-F185 WeakPolarHBondContact O-CB 2.91Å; A181-F185 PolarHBondContact O-N 3.47Å; L182-F185 PolarHBondContact O-N 3.12Å; F185-E187 VanDerWaalsContact C-N 3.27Å; F185-E187 PolarHBondContact O-N 3.49Å; F185-L188 PolarHBondContact O-N 2.93Å; F185-V189 HydrophobicContact CD1-CG2 3.69Å; F185-V189 HydrophobicContact CE1-CG2 3.32Å; F185-V189 HydrophobicContact CZ-CG2 4.03Å; F185-V189 WeakPolarHBondContact O-CG2 3.36Å; F185-V189 PolarHBondContact O-N 3.25Å
186M74.1Confident72.9Confident13 Ų1353.5 Ų53.56%0.06428%0.278CS..Hα-helixtrans-55.1-46.8169.4-91.8-168.3137.400110.5N134 L137 I138 L182 L188 V189 N190 A347N134-M186 HydrophobicContact CB-CE 3.38Å; L137-M186 HydrophobicContact CD2-CG 4.25Å; I138-M186 HydrophobicContact CD1-CE 3.48Å; I138-M186 VanDerWaalsContact CD1-CE 3.48Å; I138-M186 HydrophobicContact CD1-SD 4.34Å; I138-M186 HydrophobicContact CG1-CE 4.17Å; L182-M186 HydrophobicContact CD2-CG 3.99Å; L182-M186 HydrophobicContact CD2-SD 3.82Å; L182-M186 WeakPolarHBondContact O-CB 3.44Å; L182-M186 PolarHBondContact O-N 3.37Å; M186-L188 PolarHBondContact O-N 3.43Å; M186-V189 PolarHBondContact O-N 2.85Å; M186-N190 WeakPolarHBondContact O-CB 3.15Å; M186-N190 PolarHBondContact O-N 2.86Å; M186-N190 PolarHBondContact O-ND2 3.38Å; M186-N190 PolarHBondContact O-OD1 2.95Å; M186-A347 HydrophobicContact CE-CB 3.45Å; M186-A347 VanDerWaalsContact CE-CB 3.45Å
187E71.1Confident73Confident9 Ų951.1 Ų51.14%0.04226%0.262CS..Hα-helixtrans-60.5-43.6177.3-169-179.2162.300112.1L183 L184 F185 N190 L191 L255 Y293L183-E187 WeakPolarHBondContact O-CB 3.45Å; L183-E187 PolarHBondContact O-N 2.84Å; L184-E187 WeakPolarHBondContact O-CB 3.49Å; L184-E187 PolarHBondContact O-N 3.33Å; F185-E187 VanDerWaalsContact C-N 3.27Å; F185-E187 PolarHBondContact O-N 3.49Å; E187-N190 CarbonylContact O-C 3.59Å; E187-N190 PolarHBondContact O-N 2.92Å; E187-L191 HydrophobicContact CG-CD1 4.39Å; E187-L191 WeakPolarHBondContact O-CB 3.23Å; E187-L191 VanDerWaalsContact O-CG 3.31Å; E187-L191 WeakPolarHBondContact O-CG 3.37Å; E187-L191 PolarHBondContact O-N 3.41Å; E187-L255 HydrophobicContact CG-CD1 4.39Å; E187-L255 WeakPolarHBondContact OE1-CD1 3.44Å; E187-L255 WeakPolarHBondContact OE2-CG 3.3Å; E187-Y293 PolarHBondContact OE2-OH 3.33Å
188L72.8Confident72.9Confident92 Ų9248.4 Ų48.448%0.48224%0.243SC..Hα-helixtrans-62.7-46.5177.7-175.770.9000112.1L184 F185 M186 N190 L191 L192L184-L188 WeakPolarHBondContact O-CB 3.37Å; L184-L188 PolarHBondContact O-N 2.88Å; F185-L188 PolarHBondContact O-N 2.93Å; M186-L188 PolarHBondContact O-N 3.43Å; L188-N190 VanDerWaalsContact C-N 3.31Å; L188-L191 WeakPolarHBondContact O-CB 3.32Å; L188-L191 PolarHBondContact O-N 3.06Å; L188-L192 HydrophobicContact CG-CD1 4.46Å; L188-L192 WeakPolarHBondContact O-CG 3.31Å; L188-L192 PolarHBondContact O-N 2.85Å
189V74.6Confident72.9Confident9 Ų951 Ų516%0.05526%0.255CS..Hα-helixtrans-60-47.9173.91700000109.2I133 F185 M186 L191 L192 Y193I133-V189 HydrophobicContact CB-CG1 4.23Å; I133-V189 HydrophobicContact CG2-CB 4.45Å; I133-V189 HydrophobicContact CG2-CG1 3.68Å; I133-V189 HydrophobicContact CG2-CG2 3.91Å; F185-V189 HydrophobicContact CD1-CG2 3.69Å; F185-V189 HydrophobicContact CE1-CG2 3.32Å; F185-V189 HydrophobicContact CZ-CG2 4.03Å; F185-V189 WeakPolarHBondContact O-CG2 3.36Å; F185-V189 PolarHBondContact O-N 3.25Å; M186-V189 PolarHBondContact O-N 2.85Å; V189-L191 VanDerWaalsContact C-N 3.3Å; V189-L191 PolarHBondContact O-N 3.42Å; V189-L192 PolarHBondContact O-N 3.35Å; V189-L192 VanDerWaalsContact O-N 3.14Å; V189-Y193 HydrophobicContact CG1-CD2 3.72Å; V189-Y193 HydrophobicContact CG1-CE2 3.97Å; V189-Y193 VanDerWaalsContact O-CD2 3.3Å; V189-Y193 WeakPolarHBondContact O-CD2 3.02Å; V189-Y193 PolarHBondContact O-N 3.49Å
190N76Confident72.9Confident4 Ų451.4 Ų51.42%0.02125%0.254CS..Hα-helixtrans-59.8-42.4179.9-66.6-24.1000110.8M130 N134 M186 E187 L188 L192 Y193 L194 Y350M130-N190 HydrophobicContact CE-CB 3.55Å; M130-N190 WeakPolarHBondContact CE-OD1 2.97Å; N134-N190 PolarHBondContact ND2-OD1 3.42Å; M186-N190 WeakPolarHBondContact O-CB 3.15Å; M186-N190 PolarHBondContact O-N 2.86Å; M186-N190 PolarHBondContact O-ND2 3.38Å; M186-N190 PolarHBondContact O-OD1 2.95Å; E187-N190 CarbonylContact O-C 3.59Å; E187-N190 PolarHBondContact O-N 2.92Å; L188-N190 VanDerWaalsContact C-N 3.31Å; N190-L192 PolarHBondContact O-N 3.36Å; N190-Y193 PolarHBondContact O-N 3.37Å; N190-L194 HydrophobicContact CB-CD1 4.45Å; N190-L194 WeakPolarHBondContact O-CA 3.26Å; N190-L194 WeakPolarHBondContact O-CB 3.31Å; N190-L194 PolarHBondContact O-N 2.89Å; N190-Y350 HydrophobicContact CB-CE1 3.82Å; N190-Y350 WeakPolarHBondContact ND2-CD1 3.3Å; N190-Y350 WeakPolarHBondContact ND2-CE1 3.38Å
191L72Confident72.8Confident39 Ų3949.5 Ų49.520%0.20425%0.245CC..Hα-helixtrans-58.3-48.2174.2-78.8167.3000111.8E187 L188 V189 Y193 K195 Y297E187-L191 HydrophobicContact CG-CD1 4.39Å; E187-L191 WeakPolarHBondContact O-CB 3.23Å; E187-L191 VanDerWaalsContact O-CG 3.31Å; E187-L191 WeakPolarHBondContact O-CG 3.37Å; E187-L191 PolarHBondContact O-N 3.41Å; L188-L191 WeakPolarHBondContact O-CB 3.32Å; L188-L191 PolarHBondContact O-N 3.06Å; V189-L191 VanDerWaalsContact C-N 3.3Å; V189-L191 PolarHBondContact O-N 3.42Å; L191-Y193 PolarHBondContact O-N 2.89Å; L191-K195 WeakPolarHBondContact O-CB 3.38Å; L191-K195 PolarHBondContact O-N 3.45Å; L191-Y297 WeakPolarHBondContact CA-OH 3.24Å; L191-Y297 HydrophobicContact CD2-CE1 3.52Å; L191-Y297 VanDerWaalsContact CD2-OH 3.29Å; L191-Y297 WeakPolarHBondContact CD2-OH 3.46Å; L191-Y297 HydrophobicContact CG-CE1 4.25Å; L191-Y297 WeakPolarHBondContact CG-OH 3.32Å; L191-Y297 PolarHBondContact N-OH 3.25Å; L191-Y297 VanDerWaalsContact N-OH 3.17Å
192L73.4Confident72.7Confident108 Ų10850.1 Ų50.157%0.56524%0.243SC*.Hα-helixtrans-63.3-42-178.9-72.7169.1000112.2L188 V189 N190L188-L192 HydrophobicContact CG-CD1 4.46Å; L188-L192 WeakPolarHBondContact O-CG 3.31Å; L188-L192 PolarHBondContact O-N 2.85Å; V189-L192 PolarHBondContact O-N 3.35Å; V189-L192 VanDerWaalsContact O-N 3.14Å; N190-L192 PolarHBondContact O-N 3.36Å
193Y74.9Confident72.4Confident48 Ų4854.8 Ų54.819%0.18827%0.268CS..Hα-helixtrans-79.9-39.1179.8-79.8-85.6000112.7R129 M130 I133 V189 N190 L191 K195 K196 I197R129-Y193 HydrophobicContact CB-CE1 3.92Å; M130-Y193 HydrophobicContact CB-CD1 4.36Å; M130-Y193 HydrophobicContact CB-CD2 4.45Å; M130-Y193 HydrophobicContact CB-CG 4.01Å; M130-Y193 HydrophobicContact CG-CG 4.44Å; I133-Y193 HydrophobicContact CD1-CE2 3.43Å; I133-Y193 VanDerWaalsContact CD1-CE2 3.43Å; I133-Y193 VanDerWaalsContact CD1-CZ 3.42Å; I133-Y193 WeakPolarHBondContact CD1-OH 3.15Å; V189-Y193 HydrophobicContact CG1-CD2 3.72Å; V189-Y193 HydrophobicContact CG1-CE2 3.97Å; V189-Y193 VanDerWaalsContact O-CD2 3.3Å; V189-Y193 WeakPolarHBondContact O-CD2 3.02Å; V189-Y193 PolarHBondContact O-N 3.49Å; N190-Y193 PolarHBondContact O-N 3.37Å; L191-Y193 PolarHBondContact O-N 2.89Å; Y193-K195 VanDerWaalsContact C-N 3.29Å; Y193-K195 PolarHBondContact O-N 3.29Å; Y193-K196 WeakPolarHBondContact O-CB 3.35Å; Y193-K196 PolarHBondContact O-N 2.93Å; Y193-K196 VanDerWaalsContact O-N 3.16Å; Y193-I197 WeakPolarHBondContact O-CG1 3.44Å; Y193-I197 PolarHBondContact O-N 2.92Å
194L73.9Confident72.1Confident1 Ų154 Ų541%0.00526%0.264CS..Hα-helixtrans-63.9-35.9174.3-102.8126.9000111.7M130 N190 K196 I197 C198 Y297 V354 L358M130-L194 HydrophobicContact CE-CD1 3.66Å; N190-L194 HydrophobicContact CB-CD1 4.45Å; N190-L194 WeakPolarHBondContact O-CA 3.26Å; N190-L194 WeakPolarHBondContact O-CB 3.31Å; N190-L194 PolarHBondContact O-N 2.89Å; L194-K196 VanDerWaalsContact C-N 3.29Å; L194-K196 PolarHBondContact O-N 3.22Å; L194-I197 CarbonylContact O-C 3.55Å; L194-I197 PolarHBondContact O-N 3.36Å; L194-I197 VanDerWaalsContact O-N 3.15Å; L194-C198 WeakPolarHBondContact O-CB 3.25Å; L194-C198 PolarHBondContact O-N 3.17Å; L194-C198 PolarHBondContact O-SG 3.22Å; L194-Y297 HydrophobicContact CB-CD1 3.94Å; L194-Y297 HydrophobicContact CB-CE1 3.67Å; L194-Y297 HydrophobicContact CD1-CD1 4.26Å; L194-Y297 HydrophobicContact CD1-CE1 3.94Å; L194-Y297 HydrophobicContact CD1-CE2 4.44Å; L194-Y297 HydrophobicContact CD2-CD1 3.86Å; L194-Y297 HydrophobicContact CD2-CE1 4.3Å; L194-Y297 HydrophobicContact CD2-CG 4.16Å; L194-Y297 HydrophobicContact CG-CD1 4.23Å; L194-Y297 HydrophobicContact CG-CE1 4.16Å; L194-V354 HydrophobicContact CD1-CB 3.9Å; L194-V354 HydrophobicContact CD1-CG1 3.63Å; L194-V354 HydrophobicContact CD1-CG2 4.08Å; L194-V354 HydrophobicContact CD2-CB 4.16Å; L194-V354 HydrophobicContact CD2-CG1 3.27Å; L194-V354 HydrophobicContact CG-CG1 4.06Å; L194-L358 HydrophobicContact CD2-CD1 4.05Å
195K72.8Confident71.9Confident141 Ų14154.3 Ų54.361%0.61327%0.271SS*.Hα-helixtrans-55.3-48.5172.7-174.1171.9-178.9175.30110.8L191 Y193 I197 C198 D199L191-K195 WeakPolarHBondContact O-CB 3.38Å; L191-K195 PolarHBondContact O-N 3.45Å; Y193-K195 VanDerWaalsContact C-N 3.29Å; Y193-K195 PolarHBondContact O-N 3.29Å; K195-I197 VanDerWaalsContact C-N 3.35Å; K195-I197 PolarHBondContact O-N 2.92Å; K195-C198 PolarHBondContact O-N 3.05Å; K195-D199 WeakPolarHBondContact O-CB 3.46Å; K195-D199 PolarHBondContact O-N 3.01Å
196K75.6Confident71.4Confident129 Ų12955.3 Ų55.356%0.56128%0.278SS*.Hα-helixtrans-61.4-39.3176-68.2-179.6177.8176.50113.1Y193 L194 R200Y193-K196 WeakPolarHBondContact O-CB 3.35Å; Y193-K196 PolarHBondContact O-N 2.93Å; Y193-K196 VanDerWaalsContact O-N 3.16Å; L194-K196 VanDerWaalsContact C-N 3.29Å; L194-K196 PolarHBondContact O-N 3.22Å; K196-R200 WeakPolarHBondContact O-CG 3.33Å; K196-R200 PolarHBondContact O-N 2.98Å
197I73.8Confident70.6Confident1 Ų156.7 Ų56.71%0.00529%0.287CS..Hα-helixtrans-70.7-44.9178.6-65.5167.3000110.6L123 P126 Y193 L194 K195 R200 I201L123-I197 HydrophobicContact CD1-CG2 3.87Å; L123-I197 HydrophobicContact CG-CG2 4.28Å; P126-I197 HydrophobicContact CB-CD1 4.29Å; P126-I197 HydrophobicContact CB-CG1 3.98Å; P126-I197 HydrophobicContact CG-CD1 4.48Å; P126-I197 HydrophobicContact CG-CG1 3.99Å; Y193-I197 WeakPolarHBondContact O-CG1 3.44Å; Y193-I197 PolarHBondContact O-N 2.92Å; L194-I197 CarbonylContact O-C 3.55Å; L194-I197 PolarHBondContact O-N 3.36Å; L194-I197 VanDerWaalsContact O-N 3.15Å; K195-I197 VanDerWaalsContact C-N 3.35Å; K195-I197 PolarHBondContact O-N 2.92Å; I197-R200 CarbonylContact O-C 3.59Å; I197-R200 WeakPolarHBondContact O-CB 3.44Å; I197-R200 PolarHBondContact O-N 3.49Å; I197-I201 HydrophobicContact CG2-CD1 3.74Å; I197-I201 HydrophobicContact CG2-CG1 4.29Å; I197-I201 WeakPolarHBondContact O-CG1 3.39Å; I197-I201 PolarHBondContact O-N 3.48Å
198C71.6Confident69.9Low15 Ų1561.7 Ų61.710%0.10131%0.309CS..Hα-helixtrans-59.3-46.3175.6-72.60000110.8L194 K195 R200 I201 T202 Q301L194-C198 WeakPolarHBondContact O-CB 3.25Å; L194-C198 PolarHBondContact O-N 3.17Å; L194-C198 PolarHBondContact O-SG 3.22Å; K195-C198 PolarHBondContact O-N 3.05Å; C198-R200 PolarHBondContact O-N 2.93Å; C198-I201 CarbonylContact O-C 3.58Å; C198-I201 PolarHBondContact O-N 2.97Å; C198-I201 VanDerWaalsContact O-N 3.08Å; C198-T202 WeakPolarHBondContact O-CB 3.46Å; C198-T202 PolarHBondContact O-N 3.43Å; C198-T202 PolarHBondContact O-OG1 3.14Å; C198-Q301 PolarHBondContact SG-NE2 3.08Å
199D71.9Confident68.9Low94 Ų9462.8 Ų62.850%0.50331%0.311SS..Hα-helixtrans-57.8-40.2176.5-67.2-19.2000111K195 L203K195-D199 WeakPolarHBondContact O-CB 3.46Å; K195-D199 PolarHBondContact O-N 3.01Å; D199-L203 PolarHBondContact O-N 3.25Å
200R71.7Confident67.4Low71 Ų7170.1 Ų70.127%0.26834%0.339SS..Hα-helixtrans-68.1-41174-71.3177.1174.5-151.7-2.8112.9Q121 K196 I197 C198 L203 L204Q121-R200 PolarHBondContact O-NH1 2.94Å; K196-R200 WeakPolarHBondContact O-CG 3.33Å; K196-R200 PolarHBondContact O-N 2.98Å; I197-R200 CarbonylContact O-C 3.59Å; I197-R200 WeakPolarHBondContact O-CB 3.44Å; I197-R200 PolarHBondContact O-N 3.49Å; C198-R200 PolarHBondContact O-N 2.93Å; R200-L203 WeakPolarHBondContact O-CB 3.4Å; R200-L203 PolarHBondContact O-N 3.32Å; R200-L204 WeakPolarHBondContact O-CG 3.34Å; R200-L204 PolarHBondContact O-N 3.47Å
201I71.1Confident66Low22 Ų2275.7 Ų75.711%0.11336%0.36CS..Hα-helixtrans-67.5-40.7176.9-68.7169.5000110.7L123 I197 C198 L203 L204 S205 L358L123-I201 HydrophobicContact CD1-CD1 4.26Å; L123-I201 HydrophobicContact CD1-CG1 4.07Å; I197-I201 HydrophobicContact CG2-CD1 3.74Å; I197-I201 HydrophobicContact CG2-CG1 4.29Å; I197-I201 WeakPolarHBondContact O-CG1 3.39Å; I197-I201 PolarHBondContact O-N 3.48Å; C198-I201 CarbonylContact O-C 3.58Å; C198-I201 PolarHBondContact O-N 2.97Å; C198-I201 VanDerWaalsContact O-N 3.08Å; I201-L203 VanDerWaalsContact C-N 3.28Å; I201-L203 PolarHBondContact O-N 3.46Å; I201-L204 CarbonylContact O-C 3.6Å; I201-L204 WeakPolarHBondContact O-CA 3.44Å; I201-L204 VanDerWaalsContact O-CB 3.29Å; I201-L204 WeakPolarHBondContact O-CB 3.38Å; I201-L204 PolarHBondContact O-N 2.93Å; I201-L204 VanDerWaalsContact O-N 3.07Å; I201-S205 PolarHBondContact O-N 3.29Å; I201-L358 HydrophobicContact CD1-CD1 3.76Å
202T68.7Low64.5Low60 Ų6081.6 Ų81.637%0.36838%0.381SS..Hα-helixtrans-60.5-41175-60.30000110.3C198 L204 S205 M206C198-T202 WeakPolarHBondContact O-CB 3.46Å; C198-T202 PolarHBondContact O-N 3.43Å; C198-T202 PolarHBondContact O-OG1 3.14Å; T202-L204 VanDerWaalsContact C-N 3.3Å; T202-L204 PolarHBondContact O-N 3.45Å; T202-S205 PolarHBondContact O-N 3.48Å; T202-S205 VanDerWaalsContact O-N 3.12Å; T202-M206 HydrophobicContact CG2-CG 4.4Å; T202-M206 WeakPolarHBondContact O-CB 3.36Å; T202-M206 VanDerWaalsContact O-CG 3.3Å; T202-M206 WeakPolarHBondContact O-CG 3.39Å; T202-M206 PolarHBondContact O-N 3.41Å
203L66.7Low63.1Low107 Ų10779.6 Ų79.656%0.5637%0.37SS*.Hα-helixtrans-59.4-40.1173.2-163.9157.3000111.7D199 R200 I201 T207D199-L203 PolarHBondContact O-N 3.25Å; R200-L203 WeakPolarHBondContact O-CB 3.4Å; R200-L203 PolarHBondContact O-N 3.32Å; I201-L203 VanDerWaalsContact C-N 3.28Å; I201-L203 PolarHBondContact O-N 3.46Å; L203-T207 WeakPolarHBondContact O-CB 3.06Å; L203-T207 PolarHBondContact O-N 3.49Å; L203-T207 PolarHBondContact O-OG1 2.8Å
204L64.7Low61.5Low19 Ų1983.8 Ų83.810%0.09939%0.391CS..Hα-helixtrans-65.9-41.7172.6-62.2169.5000113L28 L31 R200 I201 T202 M206 T207 K208L28-L204 HydrophobicContact CD1-CD1 3.68Å; L28-L204 HydrophobicContact CD2-CD1 3.75Å; L28-L204 HydrophobicContact CD2-CD2 3.66Å; L28-L204 HydrophobicContact CD2-CG 3.85Å; L28-L204 HydrophobicContact CG-CD1 3.41Å; L28-L204 VanDerWaalsContact CG-CD1 3.41Å; L28-L204 HydrophobicContact CG-CD2 3.82Å; L28-L204 HydrophobicContact CG-CG 4.01Å; L31-L204 HydrophobicContact CD1-CD2 3.26Å; R200-L204 WeakPolarHBondContact O-CG 3.34Å; R200-L204 PolarHBondContact O-N 3.47Å; I201-L204 CarbonylContact O-C 3.6Å; I201-L204 WeakPolarHBondContact O-CA 3.44Å; I201-L204 VanDerWaalsContact O-CB 3.29Å; I201-L204 WeakPolarHBondContact O-CB 3.38Å; I201-L204 PolarHBondContact O-N 2.93Å; I201-L204 VanDerWaalsContact O-N 3.07Å; T202-L204 VanDerWaalsContact C-N 3.3Å; T202-L204 PolarHBondContact O-N 3.45Å; L204-M206 VanDerWaalsContact C-N 3.34Å; L204-T207 CarbonylContact O-C 3.53Å; L204-T207 PolarHBondContact O-N 3.23Å; L204-K208 PolarHBondContact O-N 2.88Å
205S66.7Low60.3Low66 Ų6694.1 Ų94.146%0.46243%0.43SS..Hα-helixtrans-62.7-46.9179.7-1650000109.7I201 T202 T207 K208 E209I201-S205 PolarHBondContact O-N 3.29Å; T202-S205 PolarHBondContact O-N 3.48Å; T202-S205 VanDerWaalsContact O-N 3.12Å; S205-T207 VanDerWaalsContact C-N 3.29Å; S205-T207 PolarHBondContact O-N 2.99Å; S205-K208 PolarHBondContact O-N 2.88Å; S205-K208 VanDerWaalsContact O-N 3.13Å; S205-E209 WeakPolarHBondContact O-CB 3.39Å; S205-E209 WeakPolarHBondContact O-CG 3.5Å; S205-E209 PolarHBondContact O-N 2.99Å
206M60.7Low59Low113 Ų11391.5 Ų91.556%0.55743%0.426SS*.Hα-helixtrans-59.5-38.9172.4-68.4-65.3-175.500111.5T202 L204 K208 Y210T202-M206 HydrophobicContact CG2-CG 4.4Å; T202-M206 WeakPolarHBondContact O-CB 3.36Å; T202-M206 VanDerWaalsContact O-CG 3.3Å; T202-M206 WeakPolarHBondContact O-CG 3.39Å; T202-M206 PolarHBondContact O-N 3.41Å; L204-M206 VanDerWaalsContact C-N 3.34Å; M206-K208 PolarHBondContact O-N 3.22Å; M206-Y210 WeakPolarHBondContact O-CB 3.13Å; M206-Y210 PolarHBondContact O-N 2.93Å
207T58.9Low57.1Low42 Ų4287 Ų8726%0.25841%0.409SS..Hα-helixtrans-68.9-32.5176.7-53.50000112.7L31 L203 L204 S205 R211L31-T207 HydrophobicContact CD2-CG2 4.02Å; L203-T207 WeakPolarHBondContact O-CB 3.06Å; L203-T207 PolarHBondContact O-N 3.49Å; L203-T207 PolarHBondContact O-OG1 2.8Å; L204-T207 CarbonylContact O-C 3.53Å; L204-T207 PolarHBondContact O-N 3.23Å; S205-T207 VanDerWaalsContact C-N 3.29Å; S205-T207 PolarHBondContact O-N 2.99Å; T207-R211 WeakPolarHBondContact O-CB 3.43Å; T207-R211 PolarHBondContact O-N 3.32Å
208K55.8Low55.7Low115 Ų11593.7 Ų93.750%0.545%0.451SS..Hα-helixtrans-73.6-46.3174.7-78.6-176.8178.8179.40111.5L204 S205 M206 Y210 R211 Y212L204-K208 PolarHBondContact O-N 2.88Å; S205-K208 PolarHBondContact O-N 2.88Å; S205-K208 VanDerWaalsContact O-N 3.13Å; M206-K208 PolarHBondContact O-N 3.22Å; K208-Y210 VanDerWaalsContact C-N 3.33Å; K208-R211 CarbonylContact O-C 3.59Å; K208-R211 PolarHBondContact O-N 2.91Å; K208-Y212 PolarHBondContact O-N 3.22Å
209E51.6Low54Low114 Ų114104.3 Ų104.353%0.53349%0.489SS..Hα-helixtrans-57.8-46.8172.9-75.4-89.6142.700109.8S205 R211 Y212 I213S205-E209 WeakPolarHBondContact O-CB 3.39Å; S205-E209 WeakPolarHBondContact O-CG 3.5Å; S205-E209 PolarHBondContact O-N 2.99Å; E209-R211 VanDerWaalsContact C-N 3.32Å; E209-R211 PolarHBondContact O-N 3.5Å; E209-Y212 CarbonylContact O-C 3.6Å; E209-Y212 PolarHBondContact O-N 3.41Å; E209-I213 WeakPolarHBondContact O-CB 3.25Å; E209-I213 VanDerWaalsContact O-CG1 3.24Å; E209-I213 WeakPolarHBondContact O-CG1 3.5Å; E209-I213 PolarHBondContact O-N 3.4Å
210Y42.5Very low52.1Low164 Ų164104.1 Ų104.164%0.64350%0.495SS*.Hα-helixtrans-62.1-38.2176.1-152.6-91.8000111.9M206 K208 Y212 Q214M206-Y210 WeakPolarHBondContact O-CB 3.13Å; M206-Y210 PolarHBondContact O-N 2.93Å; K208-Y210 VanDerWaalsContact C-N 3.33Å; Y210-Y212 VanDerWaalsContact C-N 3.35Å; Y210-Q214 WeakPolarHBondContact O-CA 2.99Å; Y210-Q214 WeakPolarHBondContact O-CB 3.19Å; Y210-Q214 PolarHBondContact O-N 2.86Å
211R47.2Very low50.3Low121 Ų121106.6 Ų106.646%0.45752%0.521SS..Hα-helixtrans-69.5-28.9172.8-92-167-72.4-169.7-3.6113.9T207 K208 E209 R215T207-R211 WeakPolarHBondContact O-CB 3.43Å; T207-R211 PolarHBondContact O-N 3.32Å; K208-R211 CarbonylContact O-C 3.59Å; K208-R211 PolarHBondContact O-N 2.91Å; E209-R211 VanDerWaalsContact C-N 3.32Å; E209-R211 PolarHBondContact O-N 3.5Å; R211-R215 PolarHBondContact O-N 2.99Å
212Y41Very low48.8Very low163 Ų163112.8 Ų112.864%0.63955%0.553SS**Hα-helixtrans-75.9-48.9175.5-168.1-99.1000110.4K208 E209 Y210 Q214 R215 T216K208-Y212 PolarHBondContact O-N 3.22Å; E209-Y212 CarbonylContact O-C 3.6Å; E209-Y212 PolarHBondContact O-N 3.41Å; Y210-Y212 VanDerWaalsContact C-N 3.35Å; Y212-Q214 PolarHBondContact O-N 3.37Å; Y212-R215 PolarHBondContact O-N 3.47Å; Y212-R215 VanDerWaalsContact O-N 3.08Å; Y212-T216 PolarHBondContact O-N 2.82Å; Y212-T216 VanDerWaalsContact O-N 3.13Å; Y212-T216 PolarHBondContact O-OG1 3.4Å
213I44.2Very low47.3Very low65 Ų65117.8 Ų117.833%0.33358%0.576SS.*Hα-helixtrans-61.4-42.2175.8-65.7169.9000110.3E209 R215 T216 T217E209-I213 WeakPolarHBondContact O-CB 3.25Å; E209-I213 VanDerWaalsContact O-CG1 3.24Å; E209-I213 WeakPolarHBondContact O-CG1 3.5Å; E209-I213 PolarHBondContact O-N 3.4Å; I213-R215 PolarHBondContact O-N 3.37Å; I213-T216 CarbonylContact O-C 3.58Å; I213-T216 PolarHBondContact O-N 3.02Å; I213-T216 VanDerWaalsContact O-N 3.09Å; I213-T216 PolarHBondContact O-OG1 3.06Å; I213-T217 HydrophobicContact CG2-CG2 4.3Å; I213-T217 WeakPolarHBondContact CG2-OG1 3.48Å; I213-T217 WeakPolarHBondContact O-CA 3.5Å; I213-T217 WeakPolarHBondContact O-CB 3.4Å; I213-T217 PolarHBondContact O-N 2.97Å; I213-T217 PolarHBondContact O-OG1 3.24Å
214Q40.1Very low45.8Very low136 Ų136121.2 Ų121.264%0.63659%0.587SS**Hα-helixtrans-65.8-25176.9-170176.1-0.100112.8Y210 Y212Y210-Q214 WeakPolarHBondContact O-CA 2.99Å; Y210-Q214 WeakPolarHBondContact O-CB 3.19Å; Y210-Q214 PolarHBondContact O-N 2.86Å; Y212-Q214 PolarHBondContact O-N 3.37Å
215R49.4Very low44.5Very low219 Ų219125.6 Ų125.683%0.82662%0.615SS**Hα-helixtrans-82-22.2172-82.1-175.9-174.7156.70.6113.9R211 Y212 I213R211-R215 PolarHBondContact O-N 2.99Å; Y212-R215 PolarHBondContact O-N 3.47Å; Y212-R215 VanDerWaalsContact O-N 3.08Å; I213-R215 PolarHBondContact O-N 3.37Å
216T45.5Very low42.9Very low86 Ų86125.5 Ų125.553%0.52862%0.624SS.*Hα-helixtrans-108.3-9.9-178.848.10000114.4Y212 I213Y212-T216 PolarHBondContact O-N 2.82Å; Y212-T216 VanDerWaalsContact O-N 3.13Å; Y212-T216 PolarHBondContact O-OG1 3.4Å; I213-T216 CarbonylContact O-C 3.58Å; I213-T216 PolarHBondContact O-N 3.02Å; I213-T216 VanDerWaalsContact O-N 3.09Å; I213-T216 PolarHBondContact O-OG1 3.06Å
217T36.1Very low41.6Very low34 Ų34127.3 Ų127.321%0.20964%0.635CS.*  trans-12556.5-163.3-44.50000112.8I213 R219I213-T217 HydrophobicContact CG2-CG2 4.3Å; I213-T217 WeakPolarHBondContact CG2-OG1 3.48Å; I213-T217 WeakPolarHBondContact O-CA 3.5Å; I213-T217 WeakPolarHBondContact O-CB 3.4Å; I213-T217 PolarHBondContact O-N 2.97Å; I213-T217 PolarHBondContact O-OG1 3.24Å; T217-R219 PolarHBondContact O-N 3.06Å
218T42.7Very low40.5Very low142 Ų142130.3 Ų130.387%0.87166%0.658SS**SBendtrans-72.38.1150.7-1.80000112.1
219R37Very low39.4Very low238 Ų238133.8 Ų133.890%0.89867%0.673SS**SBendtrans-136.23.4-176.2-88.4-169.4162.4-170.5-4.9118.8T217T217-R219 PolarHBondContact O-N 3.06Å
220S32.5Very low38.7Very low90 Ų90136.9 Ų136.963%0.62969%0.685SS**  trans-142.553.7-179.1-55.20000114.7I222S220-I222 PolarHBondContact O-N 3.33Å; S220-I222 VanDerWaalsContact O-N 3.17Å
221C32.9Very low38.3Very low122 Ų122134 Ų13482%0.82469%0.689SS**THydrogen-bonded Turntrans-77.325.8173-820000115.2
222I39.7Very low38Very low153 Ų153132 Ų13279%0.78569%0.693SS**THydrogen-bonded Turntrans-108.7-12.6-175-61.8-179.8000114.4S220S220-I222 PolarHBondContact O-N 3.33Å; S220-I222 VanDerWaalsContact O-N 3.17Å
223L37.6Very low38.3Very low164 Ų164130.6 Ų130.686%0.85970%0.697SS**SBendtrans-99.4-6.5-170.9-100.7156.5000117.2
224F34.8Very low38.7Very low180 Ų180133.5 Ų133.579%0.78971%0.713SS**SBendtrans-99.60.2-174-124.7-87.3000116.3G226F224-G226 VanDerWaalsContact C-N 3.34Å
225T37.4Very low39.1Very low111 Ų111134 Ų13468%0.68172%0.715SS**SBendtrans-86.92.3175.532.70000114.1L227T225-L227 PolarHBondContact O-N 3.32Å
226G32.7Very low39.5Very low63 Ų63125.1 Ų125.165%0.64969%0.687SS**SBendtrans-76.4-17-17500000116.7F224F224-G226 VanDerWaalsContact C-N 3.34Å
227L34.4Very low40Very low151 Ų151125 Ų12579%0.79168%0.683SS**SBendtrans-105.8-4.4-171.9-87.3159.6000115.6T225 K229T225-L227 PolarHBondContact O-N 3.32Å; L227-K229 VanDerWaalsContact C-N 3.33Å
228S36.1Very low41.3Very low105 Ų105128 Ų12873%0.73470%0.701SS**SBendtrans-92.211.8175.567.40000113.9
229K33Very low42.2Very low189 Ų189126.9 Ų126.982%0.82269%0.689SS**  trans-113.221-176.7-117.8-176.6-176.4-176.10115.3L227 S231L227-K229 VanDerWaalsContact C-N 3.33Å; K229-S231 PolarHBondContact O-N 3.37Å
230F35.7Very low43.3Very low178 Ų178120.4 Ų120.478%0.78167%0.672SS**  trans-84.974.3158.7-92.3-82.3000109.2
231S33.4Very low45Very low105 Ų105121 Ų12173%0.73467%0.668SS**  trans-125.772.8170.1178.20000108.6K229K229-S231 PolarHBondContact O-N 3.37Å
232S42.7Very low46.6Very low77 Ų77119.2 Ų119.254%0.53866%0.657SS.*  trans-124.3112.5153.852.90000107.5S236S232-S236 WeakPolarHBondContact O-CB 3.49Å; S232-S236 PolarHBondContact O-OG 2.9Å
233N46.4Very low48Very low135 Ų135114.8 Ų114.872%0.72264%0.643SS**THydrogen-bonded Turntrans-62.1148.5179-84.8-18.5000109.6
234D52.9Low49.7Very low125 Ų125110.5 Ų110.567%0.66862%0.62SS**THydrogen-bonded Turntrans92.7-60.3176.4-54.7-18.7000116.1S236 N237D234-S236 VanDerWaalsContact C-N 3.33Å; D234-S236 PolarHBondContact O-N 3.04Å; D234-N237 PolarHBondContact O-N 3.22Å
235H47.7Very low51.7Low146 Ų146103.7 Ų103.768%0.67660%0.601SS**Hα-helixtrans-71.5-29.6177.7-107-66.1000113.4N237 V238 L239H235-N237 VanDerWaalsContact C-N 3.31Å; H235-N237 PolarHBondContact O-N 3.33Å; H235-V238 PolarHBondContact O-N 3.49Å; H235-L239 PolarHBondContact O-N 3.07Å; H235-L239 VanDerWaalsContact O-N 3.12Å
236S57.7Low53.5Low33 Ų33100 Ų10023%0.23159%0.585CS.*Hα-helixtrans-64.3-34.9176.749.40000112.1S232 D234 L240S232-S236 WeakPolarHBondContact O-CB 3.49Å; S232-S236 PolarHBondContact O-OG 2.9Å; D234-S236 VanDerWaalsContact C-N 3.33Å; D234-S236 PolarHBondContact O-N 3.04Å; S236-L240 WeakPolarHBondContact O-CB 3.41Å; S236-L240 PolarHBondContact O-N 3.42Å
237N56.6Low55.5Low83 Ų83101.1 Ų101.144%0.44458%0.579SS.*Hα-helixtrans-68.4-41.6179-68.6-32.1000111.8D234 H235 L240 N241D234-N237 PolarHBondContact O-N 3.22Å; H235-N237 VanDerWaalsContact C-N 3.31Å; H235-N237 PolarHBondContact O-N 3.33Å; N237-L240 PolarHBondContact O-N 2.89Å; N237-N241 WeakPolarHBondContact O-CB 3.49Å; N237-N241 PolarHBondContact O-N 3.41Å; N237-N241 PolarHBondContact O-ND2 3.49Å
238V62.9Low57.6Low99 Ų9998.3 Ų98.360%0.656%0.564SS**Hα-helixtrans-67.2-44.3177.2179.70000110.9H235 N241 S242H235-V238 PolarHBondContact O-N 3.49Å; V238-N241 PolarHBondContact O-N 3.14Å; V238-S242 WeakPolarHBondContact O-CB 3.48Å; V238-S242 PolarHBondContact O-N 2.93Å
239L61.2Low59.7Low118 Ų11899 Ų9962%0.61856%0.557SS**Hα-helixtrans-63.2-42.2175.5-90.5158.5000112.1H235 S242 A243H235-L239 PolarHBondContact O-N 3.07Å; H235-L239 VanDerWaalsContact O-N 3.12Å; L239-S242 PolarHBondContact O-N 3.35Å; L239-A243 VanDerWaalsContact O-CB 3.23Å; L239-A243 WeakPolarHBondContact O-CB 3.47Å; L239-A243 PolarHBondContact O-N 3.33Å
240L61.8Low62.1Low101 Ų10191.8 Ų91.853%0.52953%0.528SS..Hα-helixtrans-68.9-41.8178.9-171.2127.8000111S236 N237 A243 I244S236-L240 WeakPolarHBondContact O-CB 3.41Å; S236-L240 PolarHBondContact O-N 3.42Å; N237-L240 PolarHBondContact O-N 2.89Å; L240-A243 PolarHBondContact O-N 2.96Å; L240-I244 HydrophobicContact CD2-CD1 3.4Å; L240-I244 VanDerWaalsContact CD2-CD1 3.4Å; L240-I244 HydrophobicContact CG-CD1 3.94Å; L240-I244 VanDerWaalsContact O-CB 3.31Å; L240-I244 WeakPolarHBondContact O-CB 3.49Å; L240-I244 WeakPolarHBondContact O-CD1 3.07Å; L240-I244 WeakPolarHBondContact O-CG1 3.45Å; L240-I244 PolarHBondContact O-N 2.75Å
241N66.8Low64.2Low104 Ų10486.4 Ų86.456%0.55650%0.502SS*.Hα-helixtrans-65-40.2174.1-72.4-17.8000111.8N237 V238 I244 G245N237-N241 WeakPolarHBondContact O-CB 3.49Å; N237-N241 PolarHBondContact O-N 3.41Å; N237-N241 PolarHBondContact O-ND2 3.49Å; V238-N241 PolarHBondContact O-N 3.14Å; N241-I244 PolarHBondContact O-N 3Å; N241-G245 PolarHBondContact O-N 2.91Å
242S66.5Low66.6Low83 Ų8386 Ų8658%0.5849%0.491SS*.Hα-helixtrans-65.7-42.3174.7-175.30000111.5V238 L239 G245 G246V238-S242 WeakPolarHBondContact O-CB 3.48Å; V238-S242 PolarHBondContact O-N 2.93Å; L239-S242 PolarHBondContact O-N 3.35Å; S242-G245 PolarHBondContact O-N 3.44Å; S242-G246 PolarHBondContact O-N 3.31Å
243A70.8Confident68.6Low60 Ų6083.9 Ų83.950%0.49647%0.472SS..Hα-helixtrans-64.3-45.1175.200000111.7L239 L240 G246 T247L239-A243 VanDerWaalsContact O-CB 3.23Å; L239-A243 WeakPolarHBondContact O-CB 3.47Å; L239-A243 PolarHBondContact O-N 3.33Å; L240-A243 PolarHBondContact O-N 2.96Å; A243-G246 PolarHBondContact O-N 3.17Å; A243-T247 WeakPolarHBondContact O-CG2 3.37Å; A243-T247 PolarHBondContact O-N 3.38Å
244I73Confident70.5Confident75 Ų7577.5 Ų77.539%0.38544%0.437SS..Hα-helixtrans-61.2-48175.1-71164.2000109.8L240 N241 G246 T247 I248L240-I244 HydrophobicContact CD2-CD1 3.4Å; L240-I244 VanDerWaalsContact CD2-CD1 3.4Å; L240-I244 HydrophobicContact CG-CD1 3.94Å; L240-I244 VanDerWaalsContact O-CB 3.31Å; L240-I244 WeakPolarHBondContact O-CB 3.49Å; L240-I244 WeakPolarHBondContact O-CD1 3.07Å; L240-I244 WeakPolarHBondContact O-CG1 3.45Å; L240-I244 PolarHBondContact O-N 2.75Å; N241-I244 PolarHBondContact O-N 3Å; I244-G246 VanDerWaalsContact C-N 3.33Å; I244-G246 PolarHBondContact O-N 3.24Å; I244-T247 PolarHBondContact O-N 3.25Å; I244-T247 VanDerWaalsContact O-N 3.14Å; I244-T247 PolarHBondContact O-OG1 3.31Å; I244-I248 HydrophobicContact CG2-CD1 3.57Å; I244-I248 HydrophobicContact CG2-CG1 4.29Å; I244-I248 WeakPolarHBondContact O-CG1 3.47Å; I244-I248 PolarHBondContact O-N 3.02Å
245G75.5Confident71.9Confident37 Ų3772.6 Ų72.638%0.38141%0.411SS..Hα-helixtrans-57.2-44.9176.800000112.1N241 S242 T247 I248 M249N241-G245 PolarHBondContact O-N 2.91Å; S242-G245 PolarHBondContact O-N 3.44Å; G245-T247 PolarHBondContact O-N 3.01Å; G245-I248 PolarHBondContact O-N 2.74Å; G245-M249 VanDerWaalsContact O-CB 3.32Å; G245-M249 WeakPolarHBondContact O-CB 3.03Å; G245-M249 PolarHBondContact O-N 2.97Å
246G75.7Confident73.8Confident34 Ų3467.5 Ų67.535%0.35139%0.388SS..Hα-helixtrans-59.1-44.8174.300000112.5S242 A243 I244 M249 D250S242-G246 PolarHBondContact O-N 3.31Å; A243-G246 PolarHBondContact O-N 3.17Å; I244-G246 VanDerWaalsContact C-N 3.33Å; I244-G246 PolarHBondContact O-N 3.24Å; G246-M249 PolarHBondContact O-N 3.39Å; G246-D250 WeakPolarHBondContact O-CB 3.37Å; G246-D250 PolarHBondContact O-N 3.15Å
247T75.9Confident75.2Confident86 Ų8666.1 Ų66.153%0.52838%0.378SS..Hα-helixtrans-66.6-38.3177.162.90000113A243 I244 G245 R251A243-T247 WeakPolarHBondContact O-CG2 3.37Å; A243-T247 PolarHBondContact O-N 3.38Å; I244-T247 PolarHBondContact O-N 3.25Å; I244-T247 VanDerWaalsContact O-N 3.14Å; I244-T247 PolarHBondContact O-OG1 3.31Å; G245-T247 PolarHBondContact O-N 3.01Å; T247-R251 WeakPolarHBondContact O-CG 3.41Å; T247-R251 PolarHBondContact O-N 3.16Å
248I77.9Confident76.7Confident92 Ų9262.2 Ų62.247%0.47236%0.357SS..Hα-helixtrans-68.8-43.1178.2-67.7168.3000110.2I244 G245 R251 L252I244-I248 HydrophobicContact CG2-CD1 3.57Å; I244-I248 HydrophobicContact CG2-CG1 4.29Å; I244-I248 WeakPolarHBondContact O-CG1 3.47Å; I244-I248 PolarHBondContact O-N 3.02Å; G245-I248 PolarHBondContact O-N 2.74Å; I248-R251 WeakPolarHBondContact O-CB 3.4Å; I248-R251 PolarHBondContact O-N 3.43Å; I248-L252 HydrophobicContact CG2-CD1 4.13Å; I248-L252 HydrophobicContact CG2-CG 4.5Å; I248-L252 WeakPolarHBondContact O-CG 3.07Å; I248-L252 PolarHBondContact O-N 3.11Å
249M80.2Confident77.7Confident118 Ų11859 Ų5958%0.58134%0.336SS*.Hα-helixtrans-62-45.1177.3-175.3-173.768.700111.1G245 G246 R251 L252 Y253G245-M249 VanDerWaalsContact O-CB 3.32Å; G245-M249 WeakPolarHBondContact O-CB 3.03Å; G245-M249 PolarHBondContact O-N 2.97Å; G246-M249 PolarHBondContact O-N 3.39Å; M249-R251 PolarHBondContact O-N 2.75Å; M249-L252 PolarHBondContact O-N 2.97Å; M249-Y253 WeakPolarHBondContact O-CB 3.39Å; M249-Y253 PolarHBondContact O-N 3.39Å
250D83Confident78.9Confident39 Ų3954.5 Ų54.521%0.20931%0.312CS..Hα-helixtrans-63.6-31.5176.8-170.654.4000111.7G246 T254 R300 F307G246-D250 WeakPolarHBondContact O-CB 3.37Å; G246-D250 PolarHBondContact O-N 3.15Å; D250-T254 WeakPolarHBondContact O-CB 3.23Å; D250-T254 PolarHBondContact O-N 3.04Å; D250-T254 VanDerWaalsContact O-N 3.13Å; D250-T254 PolarHBondContact O-OG1 3.13Å; D250-R300 VanDerWaalsContact C-NH1 3.32Å; D250-R300 VanDerWaalsContact CG-NH1 3.31Å; D250-R300 PolarHBondContact O-NH2 3.42Å; D250-R300 IonicContact OD2-CZ 3.91Å; D250-R300 IonicContact OD2-NH1 2.89Å; D250-R300 PolarHBondContact OD2-NH1 3.19Å; D250-R300 IonicContact OD2-NH2 2.94Å; D250-F307 VanDerWaalsContact OD1-CB 3.29Å; D250-F307 WeakPolarHBondContact OD1-CB 3.26Å
251R80.2Confident80.1Confident65 Ų6549.8 Ų49.825%0.24529%0.287CS..Hα-helixtrans-66.1-52.3171.6-72.3-76.8178.2-177.310.8112T247 I248 M249 Y253 T254 L255 E296 R300T247-R251 WeakPolarHBondContact O-CG 3.41Å; T247-R251 PolarHBondContact O-N 3.16Å; I248-R251 WeakPolarHBondContact O-CB 3.4Å; I248-R251 PolarHBondContact O-N 3.43Å; M249-R251 PolarHBondContact O-N 2.75Å; R251-Y253 VanDerWaalsContact C-N 3.28Å; R251-Y253 PolarHBondContact O-N 2.95Å; R251-T254 PolarHBondContact O-N 2.87Å; R251-L255 VanDerWaalsContact O-CB 3.32Å; R251-L255 WeakPolarHBondContact O-CB 3.31Å; R251-L255 PolarHBondContact O-N 3.4Å; R251-E296 IonicContact CZ-OE1 2.8Å; R251-E296 IonicContact NH1-OE1 3.79Å; R251-E296 PolarHBondContact NH1-OE1 3.4Å; R251-R300 VanDerWaalsContact CA-NH2 3.34Å; R251-R300 VanDerWaalsContact CZ-CG 3.42Å; R251-R300 VanDerWaalsContact NH1-NE 3.18Å; R251-R300 VanDerWaalsContact NH2-CD 3.34Å
252L82.4Confident81Confident95 Ų9546.1 Ų46.150%0.49727%0.267SS..Hα-helixtrans-59-42.7178-71.7171.5000111.1I248 M249 T254 L255 I256I248-L252 HydrophobicContact CG2-CD1 4.13Å; I248-L252 HydrophobicContact CG2-CG 4.5Å; I248-L252 WeakPolarHBondContact O-CG 3.07Å; I248-L252 PolarHBondContact O-N 3.11Å; M249-L252 PolarHBondContact O-N 2.97Å; L252-T254 PolarHBondContact O-N 2.87Å; L252-L255 PolarHBondContact O-N 3.39Å; L252-I256 WeakPolarHBondContact O-CB 3.34Å; L252-I256 WeakPolarHBondContact O-CD1 3.47Å; L252-I256 WeakPolarHBondContact O-CG1 3.38Å; L252-I256 PolarHBondContact O-N 3.33Å
253Y85.7Confident81.8Confident34 Ų3445.5 Ų45.513%0.13326%0.257CS..Hα-helixtrans-60.1-47.6177.8-176.2-101.6000112.3M249 R251 I256 F257 F307 L393 S396 N397 V400M249-Y253 WeakPolarHBondContact O-CB 3.39Å; M249-Y253 PolarHBondContact O-N 3.39Å; R251-Y253 VanDerWaalsContact C-N 3.28Å; R251-Y253 PolarHBondContact O-N 2.95Å; Y253-I256 PolarHBondContact O-N 3.45Å; Y253-F257 VanDerWaalsContact O-CB 3.3Å; Y253-F257 WeakPolarHBondContact O-CB 3.46Å; Y253-F257 PolarHBondContact O-N 3.23Å; Y253-F307 HydrophobicContact CD1-CB 4.4Å; Y253-F307 AromaticContact CD1-CD1 3.6Å; Y253-F307 HydrophobicContact CD1-CD1 3.6Å; Y253-F307 AromaticContact CD1-CE1 3.99Å; Y253-F307 HydrophobicContact CD1-CE1 3.99Å; Y253-F307 AromaticContact CD1-CG 3.96Å; Y253-F307 HydrophobicContact CD1-CG 3.96Å; Y253-F307 AromaticContact CE1-CD1 3.29Å; Y253-F307 HydrophobicContact CE1-CD1 3.29Å; Y253-F307 AromaticContact CE1-CE1 3.41Å; Y253-F307 HydrophobicContact CE1-CE1 3.41Å; Y253-F307 VanDerWaalsContact CE1-CE1 3.41Å; Y253-F307 HydrophobicContact CE1-CG 4.11Å; Y253-F307 HydrophobicContact CE1-CZ 4.34Å; Y253-L393 WeakPolarHBondContact OH-CD2 3.31Å; Y253-S396 WeakPolarHBondContact CE2-OG 3.32Å; Y253-S396 PolarHBondContact OH-OG 3.39Å; Y253-N397 WeakPolarHBondContact CE2-OD1 3.32Å; Y253-N397 VanDerWaalsContact CZ-OD1 3.3Å; Y253-N397 PolarHBondContact OH-OD1 3.4Å; Y253-V400 HydrophobicContact CD2-CG2 3.81Å; Y253-V400 HydrophobicContact CE2-CG2 4.45Å
254T85.5Confident82.6Confident1 Ų144.9 Ų44.91%0.00624%0.244CC..Hα-helixtrans-65-42-179.8-580000111.7D250 R251 L252 F257 F258 E296 R300 F307D250-T254 WeakPolarHBondContact O-CB 3.23Å; D250-T254 PolarHBondContact O-N 3.04Å; D250-T254 VanDerWaalsContact O-N 3.13Å; D250-T254 PolarHBondContact O-OG1 3.13Å; R251-T254 PolarHBondContact O-N 2.87Å; L252-T254 PolarHBondContact O-N 2.87Å; T254-F257 WeakPolarHBondContact O-CB 3.41Å; T254-F257 PolarHBondContact O-N 3.4Å; T254-F258 HydrophobicContact CG2-CD2 3.6Å; T254-F258 HydrophobicContact CG2-CE2 3.37Å; T254-F258 VanDerWaalsContact O-CD2 3.22Å; T254-F258 WeakPolarHBondContact O-CD2 3.31Å; T254-F258 PolarHBondContact O-N 3.28Å; T254-E296 HydrophobicContact CG2-CG 3.85Å; T254-E296 WeakPolarHBondContact CG2-OE2 3.47Å; T254-R300 VanDerWaalsContact CB-NH2 3.25Å; T254-R300 PolarHBondContact OG1-NH2 3.27Å; T254-F307 HydrophobicContact CG2-CD2 3.67Å; T254-F307 HydrophobicContact CG2-CE2 3.69Å; T254-F307 WeakPolarHBondContact OG1-CD2 3.34Å
255L83.8Confident83.4Confident22 Ų2242 Ų4212%0.11523%0.228CC..Hα-helixtrans-61.9-49.8176.2173.2161.4000110.7L184 E187 R251 L252 F257 F258 M259L184-L255 HydrophobicContact CD2-CD1 3.77Å; L184-L255 HydrophobicContact CD2-CD2 3.23Å; L184-L255 HydrophobicContact CD2-CG 3.78Å; E187-L255 HydrophobicContact CG-CD1 4.39Å; E187-L255 WeakPolarHBondContact OE1-CD1 3.44Å; E187-L255 WeakPolarHBondContact OE2-CG 3.3Å; R251-L255 VanDerWaalsContact O-CB 3.32Å; R251-L255 WeakPolarHBondContact O-CB 3.31Å; R251-L255 PolarHBondContact O-N 3.4Å; L252-L255 PolarHBondContact O-N 3.39Å; L255-F257 VanDerWaalsContact C-N 3.3Å; L255-F257 PolarHBondContact O-N 3.39Å; L255-F258 PolarHBondContact O-N 3.03Å; L255-M259 HydrophobicContact CD2-CG 3.99Å; L255-M259 HydrophobicContact CD2-SD 4.2Å; L255-M259 WeakPolarHBondContact O-CG 3.41Å; L255-M259 PolarHBondContact O-N 3.41Å
256I85.7Confident83.6Confident39 Ų3942.4 Ų42.420%0.223%0.225CC..Hα-helixtrans-58.6-44.5176.8-70.2164000110.4L252 Y253 M259 I260 V399L252-I256 WeakPolarHBondContact O-CB 3.34Å; L252-I256 WeakPolarHBondContact O-CD1 3.47Å; L252-I256 WeakPolarHBondContact O-CG1 3.38Å; L252-I256 PolarHBondContact O-N 3.33Å; Y253-I256 PolarHBondContact O-N 3.45Å; I256-M259 WeakPolarHBondContact O-CB 3.16Å; I256-M259 PolarHBondContact O-N 2.85Å; I256-I260 HydrophobicContact CG2-CD1 3.6Å; I256-I260 HydrophobicContact CG2-CG1 4.46Å; I256-I260 WeakPolarHBondContact O-CD1 3.32Å; I256-I260 VanDerWaalsContact O-CG1 3.3Å; I256-I260 WeakPolarHBondContact O-CG1 3.43Å; I256-I260 PolarHBondContact O-N 2.67Å; I256-V399 HydrophobicContact CD1-CG1 4.33Å; I256-V399 HydrophobicContact CG2-CB 4.42Å; I256-V399 HydrophobicContact CG2-CG1 4.34Å
257F88.9Confident83.8Confident3 Ų345.2 Ų45.21%0.01323%0.232CC..Hα-helixtrans-58-50.6177.4170.6-93.5000111.9Y253 T254 L255 M259 I260 F261 F307 L311 L389 A392 L393Y253-F257 VanDerWaalsContact O-CB 3.3Å; Y253-F257 WeakPolarHBondContact O-CB 3.46Å; Y253-F257 PolarHBondContact O-N 3.23Å; T254-F257 WeakPolarHBondContact O-CB 3.41Å; T254-F257 PolarHBondContact O-N 3.4Å; L255-F257 VanDerWaalsContact C-N 3.3Å; L255-F257 PolarHBondContact O-N 3.39Å; F257-M259 VanDerWaalsContact C-N 3.32Å; F257-M259 PolarHBondContact O-N 3.41Å; F257-I260 PolarHBondContact O-N 3.22Å; F257-F261 VanDerWaalsContact O-CB 3.29Å; F257-F261 WeakPolarHBondContact O-CB 2.96Å; F257-F261 PolarHBondContact O-N 2.96Å; F257-F307 HydrophobicContact CB-CZ 4.03Å; F257-F307 AromaticContact CD1-CE2 3.94Å; F257-F307 HydrophobicContact CD1-CE2 3.94Å; F257-F307 AromaticContact CD1-CZ 3.43Å; F257-F307 HydrophobicContact CD1-CZ 3.43Å; F257-F307 VanDerWaalsContact CD1-CZ 3.43Å; F257-F307 HydrophobicContact CD2-CE1 4.47Å; F257-F307 HydrophobicContact CD2-CZ 4.04Å; F257-F307 HydrophobicContact CE1-CE2 4.45Å; F257-F307 AromaticContact CE1-CZ 3.84Å; F257-F307 HydrophobicContact CE1-CZ 3.84Å; F257-F307 HydrophobicContact CE2-CZ 4.4Å; F257-F307 HydrophobicContact CG-CE1 4.29Å; F257-F307 HydrophobicContact CG-CE2 4.32Å; F257-F307 AromaticContact CG-CZ 3.53Å; F257-F307 HydrophobicContact CG-CZ 3.53Å; F257-F307 HydrophobicContact CZ-CZ 4.3Å; F257-L311 HydrophobicContact CE1-CD1 3.93Å; F257-L311 HydrophobicContact CZ-CD1 3.77Å; F257-L389 HydrophobicContact CZ-CG 4.11Å; F257-A392 HydrophobicContact CD2-CB 3.91Å; F257-A392 HydrophobicContact CE2-CB 3.56Å; F257-A392 HydrophobicContact CZ-CB 4.27Å; F257-L393 HydrophobicContact CD2-CD2 3.97Å; F257-L393 HydrophobicContact CD2-CG 4.24Å; F257-L393 HydrophobicContact CE2-CD2 3.9Å; F257-L393 HydrophobicContact CE2-CG 3.78Å
258F87.5Confident84.3Confident2 Ų245.7 Ų45.71%0.00923%0.23CC..Hα-helixtrans-67.8-31.2179.7-76.9-54.7000112.9T254 L255 Q262 L289 C292 Y293 F310 I314T254-F258 HydrophobicContact CG2-CD2 3.6Å; T254-F258 HydrophobicContact CG2-CE2 3.37Å; T254-F258 VanDerWaalsContact O-CD2 3.22Å; T254-F258 WeakPolarHBondContact O-CD2 3.31Å; T254-F258 PolarHBondContact O-N 3.28Å; L255-F258 PolarHBondContact O-N 3.03Å; F258-Q262 VanDerWaalsContact O-CB 3.31Å; F258-Q262 WeakPolarHBondContact O-CB 3.41Å; F258-Q262 PolarHBondContact O-N 3.15Å; F258-L289 HydrophobicContact CB-CD1 3.88Å; F258-L289 HydrophobicContact CD1-CD1 4.04Å; F258-L289 HydrophobicContact CG-CD1 4.25Å; F258-C292 HydrophobicContact CD1-CB 4.45Å; F258-C292 HydrophobicContact CE1-CB 3.5Å; F258-C292 HydrophobicContact CZ-CB 3.57Å; F258-Y293 HydrophobicContact CB-CE1 3.66Å; F258-Y293 HydrophobicContact CB-CE2 4.13Å; F258-Y293 WeakPolarHBondContact CB-OH 3.43Å; F258-Y293 AromaticContact CD2-CD1 3.76Å; F258-Y293 HydrophobicContact CD2-CD1 3.76Å; F258-Y293 AromaticContact CD2-CE1 3.42Å; F258-Y293 HydrophobicContact CD2-CE1 3.42Å; F258-Y293 VanDerWaalsContact CD2-CE1 3.42Å; F258-Y293 HydrophobicContact CE2-CD1 4.23Å; F258-Y293 HydrophobicContact CE2-CE1 4.33Å; F258-Y293 HydrophobicContact CG-CD1 4.32Å; F258-Y293 AromaticContact CG-CE1 3.79Å; F258-Y293 HydrophobicContact CG-CE1 3.79Å; F258-Y293 AromaticContact CG-CZ 3.91Å; F258-F310 HydrophobicContact CE2-CE1 4.16Å; F258-F310 AromaticContact CZ-CE1 3.89Å; F258-F310 HydrophobicContact CZ-CE1 3.89Å; F258-I314 HydrophobicContact CZ-CD1 4.26Å
259M83.4Confident84.6Confident30 Ų3042 Ų4215%0.14821%0.213CC..Hα-helixtrans-59.9-51.8171.2-56.8-127.7108.900111.4I180 L183 L184 L255 I256 F257 F261 Q262 L263I180-M259 HydrophobicContact CG2-CE 3.96Å; I180-M259 HydrophobicContact CG2-SD 3.69Å; L183-M259 HydrophobicContact CB-CE 4.32Å; L183-M259 HydrophobicContact CD2-CE 3.48Å; L183-M259 VanDerWaalsContact CD2-CE 3.48Å; L184-M259 HydrophobicContact CB-CE 4.3Å; L184-M259 HydrophobicContact CD1-CE 4.3Å; L184-M259 HydrophobicContact CD1-SD 3.95Å; L184-M259 HydrophobicContact CD2-CE 3.31Å; L184-M259 HydrophobicContact CD2-CG 4.39Å; L184-M259 HydrophobicContact CD2-SD 3.31Å; L184-M259 WeakPolarHBondContact CD2-SD 3.3Å; L184-M259 HydrophobicContact CG-CE 3.31Å; L184-M259 HydrophobicContact CG-SD 3.52Å; L184-M259 VanDerWaalsContact CG-SD 3.52Å; L255-M259 HydrophobicContact CD2-CG 3.99Å; L255-M259 HydrophobicContact CD2-SD 4.2Å; L255-M259 WeakPolarHBondContact O-CG 3.41Å; L255-M259 PolarHBondContact O-N 3.41Å; I256-M259 WeakPolarHBondContact O-CB 3.16Å; I256-M259 PolarHBondContact O-N 2.85Å; F257-M259 VanDerWaalsContact C-N 3.32Å; F257-M259 PolarHBondContact O-N 3.41Å; M259-F261 VanDerWaalsContact C-N 3.33Å; M259-Q262 PolarHBondContact O-N 2.93Å; M259-L263 WeakPolarHBondContact O-CB 3.3Å; M259-L263 PolarHBondContact O-N 3.48Å
260I86.3Confident84.4Confident24 Ų2440.4 Ų40.412%0.12321%0.211CC..Hα-helixtrans-65-43.8-177.9-67159.6000109.5I256 F257 Q262 L263 Q264 A392 V395I256-I260 HydrophobicContact CG2-CD1 3.6Å; I256-I260 HydrophobicContact CG2-CG1 4.46Å; I256-I260 WeakPolarHBondContact O-CD1 3.32Å; I256-I260 VanDerWaalsContact O-CG1 3.3Å; I256-I260 WeakPolarHBondContact O-CG1 3.43Å; I256-I260 PolarHBondContact O-N 2.67Å; F257-I260 PolarHBondContact O-N 3.22Å; I260-Q262 PolarHBondContact O-N 3.45Å; I260-L263 PolarHBondContact O-N 2.98Å; I260-Q264 HydrophobicContact CG2-CG 4.43Å; I260-Q264 VanDerWaalsContact CG2-NE2 3.26Å; I260-Q264 VanDerWaalsContact O-CG 3.25Å; I260-Q264 WeakPolarHBondContact O-CG 3.48Å; I260-Q264 PolarHBondContact O-N 3.39Å; I260-A392 HydrophobicContact CG2-CB 4.1Å; I260-V395 HydrophobicContact CD1-CB 3.95Å; I260-V395 HydrophobicContact CD1-CG1 3.55Å; I260-V395 HydrophobicContact CG1-CG1 4.1Å; I260-V395 HydrophobicContact CG2-CB 4.08Å; I260-V395 HydrophobicContact CG2-CG1 4.2Å
261F88Confident84.3Confident2 Ų245.4 Ų45.41%0.00924%0.237CC..Hα-helixtrans-56.1-52.1175.4-178.7-95.5000110.8F257 M259 L263 Q264 W265 F288 S388 L389 A392F257-F261 VanDerWaalsContact O-CB 3.29Å; F257-F261 WeakPolarHBondContact O-CB 2.96Å; F257-F261 PolarHBondContact O-N 2.96Å; M259-F261 VanDerWaalsContact C-N 3.33Å; F261-L263 VanDerWaalsContact C-N 3.32Å; F261-L263 PolarHBondContact O-N 2.84Å; F261-Q264 PolarHBondContact O-N 2.88Å; F261-W265 AromaticContact CD1-CD1 3.96Å; F261-W265 AromaticContact CD2-NE1 3.91Å; F261-W265 AromaticContact CE1-CD1 3.64Å; F261-W265 AromaticContact CE1-NE1 3.69Å; F261-W265 AromaticContact CE2-CD1 3.79Å; F261-W265 AromaticContact CE2-NE1 3.23Å; F261-W265 AromaticContact CZ-CD1 3.57Å; F261-W265 AromaticContact CZ-NE1 3.1Å; F261-W265 VanDerWaalsContact O-CD1 3.25Å; F261-W265 PolarHBondContact O-N 3.44Å; F261-W265 VanDerWaalsContact O-N 3.17Å; F261-F288 AromaticContact CE1-CD1 3.75Å; F261-F288 HydrophobicContact CE1-CD1 3.75Å; F261-F288 HydrophobicContact CE1-CE1 4.24Å; F261-F288 AromaticContact CZ-CD1 3.8Å; F261-F288 HydrophobicContact CZ-CD1 3.8Å; F261-F288 AromaticContact CZ-CE1 3.97Å; F261-F288 HydrophobicContact CZ-CE1 3.97Å; F261-S388 VanDerWaalsContact CE2-OG 3.32Å; F261-S388 WeakPolarHBondContact CE2-OG 3.41Å; F261-L389 HydrophobicContact CE2-CD1 3.88Å; F261-L389 HydrophobicContact CE2-CG 4.47Å; F261-A392 HydrophobicContact CB-CB 4.15Å; F261-A392 HydrophobicContact CD2-CB 4.48Å
262Q85.6Confident84.5Confident28 Ų2844.1 Ų44.113%0.13124%0.238CC..Hα-helixtrans-62.2-39.2178.7-177.858.82800112.4F258 M259 I260 Q264 W265 S266 S285 L289F258-Q262 VanDerWaalsContact O-CB 3.31Å; F258-Q262 WeakPolarHBondContact O-CB 3.41Å; F258-Q262 PolarHBondContact O-N 3.15Å; M259-Q262 PolarHBondContact O-N 2.93Å; I260-Q262 PolarHBondContact O-N 3.45Å; Q262-Q264 PolarHBondContact O-N 2.96Å; Q262-W265 PolarHBondContact O-N 2.94Å; Q262-S266 VanDerWaalsContact O-CB 3.31Å; Q262-S266 WeakPolarHBondContact O-CB 3.38Å; Q262-S266 PolarHBondContact O-N 3.35Å; Q262-S285 PolarHBondContact OE1-OG 3.37Å; Q262-L289 HydrophobicContact CB-CD1 4.16Å; Q262-L289 HydrophobicContact CB-CD2 4.07Å; Q262-L289 HydrophobicContact CG-CD2 3.83Å
263L83.1Confident84.4Confident69 Ų6944.5 Ų44.536%0.36125%0.254SS..Hα-helixtrans-62-43.5177.2-176.265.5000111.3I180 M259 I260 F261 W265 S266 L267I180-L263 HydrophobicContact CD1-CD1 4.41Å; M259-L263 WeakPolarHBondContact O-CB 3.3Å; M259-L263 PolarHBondContact O-N 3.48Å; I260-L263 PolarHBondContact O-N 2.98Å; F261-L263 VanDerWaalsContact C-N 3.32Å; F261-L263 PolarHBondContact O-N 2.84Å; L263-W265 PolarHBondContact O-N 3.14Å; L263-S266 PolarHBondContact O-N 2.94Å; L263-L267 HydrophobicContact CG-CD1 4.14Å; L263-L267 WeakPolarHBondContact O-CB 3.16Å; L263-L267 VanDerWaalsContact O-CG 3.25Å; L263-L267 WeakPolarHBondContact O-CG 3.48Å; L263-L267 PolarHBondContact O-N 3.34Å
264Q88.4Confident84.5Confident47 Ų4747.5 Ų47.522%0.2227%0.273CS..Hα-helixtrans-60.8-45.5177.8-71.7168.39.400112I260 F261 Q262 L267 L268 S388I260-Q264 HydrophobicContact CG2-CG 4.43Å; I260-Q264 VanDerWaalsContact CG2-NE2 3.26Å; I260-Q264 VanDerWaalsContact O-CG 3.25Å; I260-Q264 WeakPolarHBondContact O-CG 3.48Å; I260-Q264 PolarHBondContact O-N 3.39Å; F261-Q264 PolarHBondContact O-N 2.88Å; Q262-Q264 PolarHBondContact O-N 2.96Å; Q264-L267 PolarHBondContact O-N 3.18Å; Q264-L268 WeakPolarHBondContact O-CB 3.21Å; Q264-L268 PolarHBondContact O-N 3.03Å; Q264-S388 PolarHBondContact OE1-O 3Å; Q264-S388 VanDerWaalsContact OE1-O 3.11Å
265W88Confident84.5Confident14 Ų1455.4 Ų55.45%0.05330%0.304CS..Hα-helixtrans-70.2-35178.6-79.192.9000112.7F261 Q262 L263 L268 A269 T281 F284 S285 C384 S388F261-W265 AromaticContact CD1-CD1 3.96Å; F261-W265 AromaticContact CD2-NE1 3.91Å; F261-W265 AromaticContact CE1-CD1 3.64Å; F261-W265 AromaticContact CE1-NE1 3.69Å; F261-W265 AromaticContact CE2-CD1 3.79Å; F261-W265 AromaticContact CE2-NE1 3.23Å; F261-W265 AromaticContact CZ-CD1 3.57Å; F261-W265 AromaticContact CZ-NE1 3.1Å; F261-W265 VanDerWaalsContact O-CD1 3.25Å; F261-W265 PolarHBondContact O-N 3.44Å; F261-W265 VanDerWaalsContact O-N 3.17Å; Q262-W265 PolarHBondContact O-N 2.94Å; L263-W265 PolarHBondContact O-N 3.14Å; W265-L268 HydrophobicContact CE3-CD2 4.29Å; W265-L268 HydrophobicContact CZ3-CD2 4.38Å; W265-L268 PolarHBondContact O-N 3.48Å; W265-A269 WeakPolarHBondContact O-CB 3.19Å; W265-A269 PolarHBondContact O-N 3.09Å; W265-T281 HydrophobicContact CE3-CG2 3.59Å; W265-T281 HydrophobicContact CZ3-CG2 3.9Å; W265-F284 HydrophobicContact CE3-CD1 4.21Å; W265-F284 AromaticContact CH2-CD1 3.86Å; W265-F284 HydrophobicContact CH2-CD1 3.86Å; W265-F284 AromaticContact CH2-CE1 3.66Å; W265-F284 HydrophobicContact CH2-CE1 3.66Å; W265-F284 HydrophobicContact CZ2-CD1 4.42Å; W265-F284 AromaticContact CZ2-CE1 3.97Å; W265-F284 HydrophobicContact CZ2-CE1 3.97Å; W265-F284 AromaticContact CZ3-CD1 3.74Å; W265-F284 HydrophobicContact CZ3-CD1 3.74Å; W265-F284 HydrophobicContact CZ3-CE1 4.05Å; W265-S285 WeakPolarHBondContact CB-OG 3.27Å; W265-C384 HydrophobicContact CH2-CB 4.4Å; W265-S388 PolarHBondContact NE1-OG 3.07Å
266S79.8Confident84.6Confident47 Ų4763.8 Ų63.833%0.32933%0.334SS..Hα-helixtrans-65.7-41173.2-176.50000111.9Q262 L263 A269 T270Q262-S266 VanDerWaalsContact O-CB 3.31Å; Q262-S266 WeakPolarHBondContact O-CB 3.38Å; Q262-S266 PolarHBondContact O-N 3.35Å; L263-S266 PolarHBondContact O-N 2.94Å; S266-A269 PolarHBondContact O-N 3.48Å; S266-T270 WeakPolarHBondContact O-CB 2.9Å; S266-T270 PolarHBondContact O-N 2.86Å; S266-T270 PolarHBondContact O-OG1 3.33Å
267L81.3Confident84.7Confident92 Ų9265.8 Ų65.848%0.48234%0.344SS..Hα-helixtrans-63.5-45.6172.4-72.5170.8000111.1L263 Q264 A269 T270 L271L263-L267 HydrophobicContact CG-CD1 4.14Å; L263-L267 WeakPolarHBondContact O-CB 3.16Å; L263-L267 VanDerWaalsContact O-CG 3.25Å; L263-L267 WeakPolarHBondContact O-CG 3.48Å; L263-L267 PolarHBondContact O-N 3.34Å; Q264-L267 PolarHBondContact O-N 3.18Å; L267-A269 VanDerWaalsContact C-N 3.32Å; L267-A269 PolarHBondContact O-N 2.91Å; L267-T270 PolarHBondContact O-N 2.88Å; L267-T270 VanDerWaalsContact O-N 3.16Å; L267-L271 WeakPolarHBondContact O-CB 3.47Å; L267-L271 VanDerWaalsContact O-CG 3.26Å; L267-L271 WeakPolarHBondContact O-CG 3.32Å; L267-L271 PolarHBondContact O-N 3Å
268L85.4Confident84.5Confident96 Ų9666 Ų6650%0.50335%0.348SS..Hα-helixtrans-60.2-41.5176.7-178.462.9000112.1Q264 W265 T270 L271 S272 T281Q264-L268 WeakPolarHBondContact O-CB 3.21Å; Q264-L268 PolarHBondContact O-N 3.03Å; W265-L268 HydrophobicContact CE3-CD2 4.29Å; W265-L268 HydrophobicContact CZ3-CD2 4.38Å; W265-L268 PolarHBondContact O-N 3.48Å; L268-T270 VanDerWaalsContact C-N 3.35Å; L268-L271 PolarHBondContact O-N 3.23Å; L268-S272 PolarHBondContact O-N 2.7Å; L268-S272 VanDerWaalsContact O-N 3.11Å; L268-T281 HydrophobicContact CD2-CG2 4.2Å; L268-T281 HydrophobicContact CG-CG2 4.29Å
269A83.6Confident84.5Confident14 Ų1468 Ų6812%0.11636%0.357CS..Hα-helixtrans-63.6-40.9175.600000111.9W265 S266 L267 S272 G278 T281 N282W265-A269 WeakPolarHBondContact O-CB 3.19Å; W265-A269 PolarHBondContact O-N 3.09Å; S266-A269 PolarHBondContact O-N 3.48Å; L267-A269 VanDerWaalsContact C-N 3.32Å; L267-A269 PolarHBondContact O-N 2.91Å; A269-S272 PolarHBondContact O-N 3.22Å; A269-G278 WeakPolarHBondContact CB-O 3.22Å; A269-G278 WeakPolarHBondContact O-CA 3.29Å; A269-T281 HydrophobicContact CB-CG2 4.17Å; A269-N282 HydrophobicContact CB-CB 4.08Å
270T76.6Confident84.7Confident85 Ų8570.6 Ų70.652%0.52137%0.374SS..Hα-helixtrans-71.2-34.3179.2-54.20000112.5S266 L267 L268 S272S266-T270 WeakPolarHBondContact O-CB 2.9Å; S266-T270 PolarHBondContact O-N 2.86Å; S266-T270 PolarHBondContact O-OG1 3.33Å; L267-T270 PolarHBondContact O-N 2.88Å; L267-T270 VanDerWaalsContact O-N 3.16Å; L268-T270 VanDerWaalsContact C-N 3.35Å; T270-S272 VanDerWaalsContact C-N 3.32Å
271L81.5Confident84.8Confident144 Ų14470.6 Ų70.675%0.75438%0.375SS*.Hα-helixtrans-82.5-9.5178.9-68.2172.6000113.2L267 L268 A273L267-L271 WeakPolarHBondContact O-CB 3.47Å; L267-L271 VanDerWaalsContact O-CG 3.26Å; L267-L271 WeakPolarHBondContact O-CG 3.32Å; L267-L271 PolarHBondContact O-N 3Å; L268-L271 PolarHBondContact O-N 3.23Å; L271-A273 PolarHBondContact O-N 2.45Å
272S83.7Confident84.6Confident38 Ų3872.8 Ų72.827%0.26639%0.387SS..  trans-68.9121.5178.9-162.50000110.4L268 A269 T270 N274 I277L268-S272 PolarHBondContact O-N 2.7Å; L268-S272 VanDerWaalsContact O-N 3.11Å; A269-S272 PolarHBondContact O-N 3.22Å; T270-S272 VanDerWaalsContact C-N 3.32Å; S272-N274 PolarHBondContact O-N 3.04Å; S272-I277 WeakPolarHBondContact OG-CG2 3.39Å
273A80.6Confident84.7Confident103 Ų10372 Ų7285%0.85139%0.385SS*.SBendtrans-60.9-30.5179.400000112.7L271L271-A273 PolarHBondContact O-N 2.45Å
274N87.8Confident85.1Confident98 Ų9869.8 Ų69.852%0.52437%0.373SS..SBendtrans-93.4116.5-179.5-72.3-20.5000110.4S272 W276 I277 G278S272-N274 PolarHBondContact O-N 3.04Å; N274-W276 VanDerWaalsContact C-N 3.32Å; N274-W276 PolarHBondContact O-N 2.96Å; N274-I277 HydrophobicContact CB-CB 3.94Å; N274-I277 HydrophobicContact CB-CD1 3.67Å; N274-I277 HydrophobicContact CB-CG1 3.66Å; N274-I277 VanDerWaalsContact ND2-CD1 3.32Å; N274-I277 WeakPolarHBondContact ND2-CD1 3.35Å; N274-I277 PolarHBondContact O-N 2.93Å; N274-G278 PolarHBondContact O-N 3.49Å
275Y84.7Confident85.1Confident167 Ų16767.5 Ų67.566%0.65536%0.362SS*.Hα-helixtrans-48.3-50.3177.1179.4-97.2000112.8I277 G278 H279Y275-I277 VanDerWaalsContact C-N 3.33Å; Y275-I277 PolarHBondContact O-N 3.5Å; Y275-G278 PolarHBondContact O-N 3.39Å; Y275-H279 AromaticContact CD1-CD2 3.74Å; Y275-H279 AromaticContact CD2-CD2 3.89Å; Y275-H279 AromaticContact CD2-NE2 3.77Å; Y275-H279 AromaticContact CE1-CD2 3.43Å; Y275-H279 VanDerWaalsContact CE1-CD2 3.43Å; Y275-H279 WeakPolarHBondContact CE1-CD2 3.47Å; Y275-H279 AromaticContact CE1-NE2 3.58Å; Y275-H279 AromaticContact CE2-CD2 3.62Å; Y275-H279 AromaticContact CE2-NE2 3.08Å; Y275-H279 WeakPolarHBondContact CE2-NE2 3.47Å; Y275-H279 AromaticContact CG-CD2 3.96Å; Y275-H279 AromaticContact CZ-CD2 3.37Å; Y275-H279 AromaticContact CZ-NE2 2.97Å; Y275-H279 PolarHBondContact O-CD2 2.83Å; Y275-H279 VanDerWaalsContact O-CD2 3.23Å; Y275-H279 PolarHBondContact O-N 3.41Å; Y275-H279 PolarHBondContact OH-NE2 2.9Å; Y275-H279 VanDerWaalsContact OH-NE2 3.14Å
276W87.6Confident84.9Confident197 Ų19767.5 Ų67.575%0.74636%0.364SS*.Hα-helixtrans-60.8-39.2178.9-76105.1000113.4N274 H279 V280N274-W276 VanDerWaalsContact C-N 3.32Å; N274-W276 PolarHBondContact O-N 2.96Å; W276-H279 PolarHBondContact O-N 2.76Å; W276-V280 WeakPolarHBondContact O-CG2 3.42Å; W276-V280 PolarHBondContact O-N 3.34Å
277I87.6Confident85.5Confident82 Ų8265.3 Ų65.342%0.42135%0.348SS..Hα-helixtrans-67.3-45.2178.7-60.6-177.2000109.2S272 N274 Y275 H279 V280 T281S272-I277 WeakPolarHBondContact OG-CG2 3.39Å; N274-I277 HydrophobicContact CB-CB 3.94Å; N274-I277 HydrophobicContact CB-CD1 3.67Å; N274-I277 HydrophobicContact CB-CG1 3.66Å; N274-I277 VanDerWaalsContact ND2-CD1 3.32Å; N274-I277 WeakPolarHBondContact ND2-CD1 3.35Å; N274-I277 PolarHBondContact O-N 2.93Å; Y275-I277 VanDerWaalsContact C-N 3.33Å; Y275-I277 PolarHBondContact O-N 3.5Å; I277-H279 VanDerWaalsContact C-N 3.33Å; I277-H279 PolarHBondContact O-N 3Å; I277-V280 PolarHBondContact O-N 3.26Å; I277-T281 VanDerWaalsContact O-CB 3.27Å; I277-T281 WeakPolarHBondContact O-CB 3.43Å; I277-T281 PolarHBondContact O-N 3.26Å; I277-T281 PolarHBondContact O-OG1 2.87Å
278G85.3Confident85.9Confident8 Ų861.1 Ų61.18%0.08233%0.326CS..Hα-helixtrans-55-46.2175.600000112.8A269 N274 Y275 T281 N282A269-G278 WeakPolarHBondContact CB-O 3.22Å; A269-G278 WeakPolarHBondContact O-CA 3.29Å; N274-G278 PolarHBondContact O-N 3.49Å; Y275-G278 PolarHBondContact O-N 3.39Å; G278-T281 PolarHBondContact O-N 2.95Å; G278-N282 WeakPolarHBondContact O-CB 2.92Å; G278-N282 PolarHBondContact O-N 3.36Å
279H86Confident86Confident42 Ų4256.7 Ų56.719%0.19430%0.303CS..Hα-helixtrans-64.7-44.3177.6-81.5-75.4000113.4Y275 W276 I277 N282 A283Y275-H279 AromaticContact CD1-CD2 3.74Å; Y275-H279 AromaticContact CD2-CD2 3.89Å; Y275-H279 AromaticContact CD2-NE2 3.77Å; Y275-H279 AromaticContact CE1-CD2 3.43Å; Y275-H279 VanDerWaalsContact CE1-CD2 3.43Å; Y275-H279 WeakPolarHBondContact CE1-CD2 3.47Å; Y275-H279 AromaticContact CE1-NE2 3.58Å; Y275-H279 AromaticContact CE2-CD2 3.62Å; Y275-H279 AromaticContact CE2-NE2 3.08Å; Y275-H279 WeakPolarHBondContact CE2-NE2 3.47Å; Y275-H279 AromaticContact CG-CD2 3.96Å; Y275-H279 AromaticContact CZ-CD2 3.37Å; Y275-H279 AromaticContact CZ-NE2 2.97Å; Y275-H279 PolarHBondContact O-CD2 2.83Å; Y275-H279 VanDerWaalsContact O-CD2 3.23Å; Y275-H279 PolarHBondContact O-N 3.41Å; Y275-H279 PolarHBondContact OH-NE2 2.9Å; Y275-H279 VanDerWaalsContact OH-NE2 3.14Å; W276-H279 PolarHBondContact O-N 2.76Å; I277-H279 VanDerWaalsContact C-N 3.33Å; I277-H279 PolarHBondContact O-N 3Å; H279-N282 PolarHBondContact O-N 3.41Å; H279-A283 WeakPolarHBondContact O-CB 3.25Å; H279-A283 PolarHBondContact O-N 3.4Å
280V88Confident86.1Confident86 Ų8657 Ų5752%0.52130%0.302SS..Hα-helixtrans-65.7-41.2177.7172.10000111W276 I277 A283 F284W276-V280 WeakPolarHBondContact O-CG2 3.42Å; W276-V280 PolarHBondContact O-N 3.34Å; I277-V280 PolarHBondContact O-N 3.26Å; V280-A283 PolarHBondContact O-N 2.84Å; V280-F284 WeakPolarHBondContact O-CB 3.34Å; V280-F284 PolarHBondContact O-N 2.91Å
281T87.5Confident86.8Confident23 Ų2353 Ų5314%0.14128%0.277CS..Hα-helixtrans-61.4-43.8175.1-65.70000111.3W265 L268 A269 I277 G278 F284 S285W265-T281 HydrophobicContact CE3-CG2 3.59Å; W265-T281 HydrophobicContact CZ3-CG2 3.9Å; L268-T281 HydrophobicContact CD2-CG2 4.2Å; L268-T281 HydrophobicContact CG-CG2 4.29Å; A269-T281 HydrophobicContact CB-CG2 4.17Å; I277-T281 VanDerWaalsContact O-CB 3.27Å; I277-T281 WeakPolarHBondContact O-CB 3.43Å; I277-T281 PolarHBondContact O-N 3.26Å; I277-T281 PolarHBondContact O-OG1 2.87Å; G278-T281 PolarHBondContact O-N 2.95Å; T281-F284 PolarHBondContact O-N 3.39Å; T281-S285 WeakPolarHBondContact O-CB 3.47Å; T281-S285 PolarHBondContact O-N 3.21Å
282N85.3Confident87.1Confident49 Ų4946.1 Ų46.126%0.26224%0.241SC..Hα-helixtrans-64.7-44.4176-172.333.4000111.6A269 G278 H279 F284 S285 V286A269-N282 HydrophobicContact CB-CB 4.08Å; G278-N282 WeakPolarHBondContact O-CB 2.92Å; G278-N282 PolarHBondContact O-N 3.36Å; H279-N282 PolarHBondContact O-N 3.41Å; N282-F284 VanDerWaalsContact C-N 3.34Å; N282-F284 PolarHBondContact O-N 2.86Å; N282-S285 WeakPolarHBondContact O-CB 3.33Å; N282-S285 PolarHBondContact O-N 2.98Å; N282-V286 WeakPolarHBondContact O-CB 3.36Å; N282-V286 VanDerWaalsContact O-CG2 3.28Å; N282-V286 WeakPolarHBondContact O-CG2 3.44Å; N282-V286 PolarHBondContact O-N 2.91Å
283A87.9Confident87.1Confident10 Ų1044.6 Ų44.68%0.08323%0.229CC..Hα-helixtrans-60.6-43.1176.900000112.6H279 V280 V286 A287 G329 I333H279-A283 WeakPolarHBondContact O-CB 3.25Å; H279-A283 PolarHBondContact O-N 3.4Å; V280-A283 PolarHBondContact O-N 2.84Å; A283-V286 PolarHBondContact O-N 3.19Å; A283-A287 VanDerWaalsContact O-CB 3.28Å; A283-A287 WeakPolarHBondContact O-CB 3.32Å; A283-A287 PolarHBondContact O-N 3.44Å; A283-G329 WeakPolarHBondContact CB-O 3.49Å; A283-G329 WeakPolarHBondContact O-CA 3.47Å; A283-I333 HydrophobicContact CB-CD1 3.49Å; A283-I333 VanDerWaalsContact CB-CD1 3.49Å; A283-I333 HydrophobicContact CB-CG1 3.44Å; A283-I333 VanDerWaalsContact CB-CG1 3.44Å
284F89.9Confident87.3Confident23 Ų2339.7 Ų39.710%0.10119%0.189CC..Hα-helixtrans-59.4-48.3173.6176.6-86.8000111W265 V280 T281 N282 V286 A287 F288 W318 L322 L381 L385W265-F284 HydrophobicContact CE3-CD1 4.21Å; W265-F284 AromaticContact CH2-CD1 3.86Å; W265-F284 HydrophobicContact CH2-CD1 3.86Å; W265-F284 AromaticContact CH2-CE1 3.66Å; W265-F284 HydrophobicContact CH2-CE1 3.66Å; W265-F284 HydrophobicContact CZ2-CD1 4.42Å; W265-F284 AromaticContact CZ2-CE1 3.97Å; W265-F284 HydrophobicContact CZ2-CE1 3.97Å; W265-F284 AromaticContact CZ3-CD1 3.74Å; W265-F284 HydrophobicContact CZ3-CD1 3.74Å; W265-F284 HydrophobicContact CZ3-CE1 4.05Å; V280-F284 WeakPolarHBondContact O-CB 3.34Å; V280-F284 PolarHBondContact O-N 2.91Å; T281-F284 PolarHBondContact O-N 3.39Å; N282-F284 VanDerWaalsContact C-N 3.34Å; N282-F284 PolarHBondContact O-N 2.86Å; F284-V286 PolarHBondContact O-N 3.45Å; F284-A287 PolarHBondContact O-N 3.25Å; F284-F288 VanDerWaalsContact O-CB 3.27Å; F284-F288 WeakPolarHBondContact O-CB 3.48Å; F284-F288 PolarHBondContact O-N 3.49Å; F284-W318 HydrophobicContact CE2-CZ3 4.29Å; F284-W318 HydrophobicContact CZ-CZ3 4.47Å; F284-L322 HydrophobicContact CD2-CD1 3.37Å; F284-L322 HydrophobicContact CD2-CD2 3.96Å; F284-L322 HydrophobicContact CD2-CG 4.3Å; F284-L322 HydrophobicContact CE2-CD1 3.49Å; F284-L322 VanDerWaalsContact CE2-CD1 3.49Å; F284-L322 HydrophobicContact CE2-CD2 3.59Å; F284-L322 HydrophobicContact CE2-CG 4.12Å; F284-L322 HydrophobicContact CG-CD1 4.17Å; F284-L322 HydrophobicContact CZ-CD1 4.33Å; F284-L381 HydrophobicContact CD2-CD2 4.32Å; F284-L381 HydrophobicContact CE2-CD1 4.43Å; F284-L381 HydrophobicContact CE2-CD2 4.02Å; F284-L381 HydrophobicContact CZ-CD2 4.4Å; F284-L385 HydrophobicContact CZ-CD1 4.22Å
285S88.2Confident87.2Confident0 Ų035.1 Ų35.10%016%0.164CC..Hα-helixtrans-58.1-49.6178.1-168.90000111.6Q262 W265 T281 N282 F288 L289Q262-S285 PolarHBondContact OE1-OG 3.37Å; W265-S285 WeakPolarHBondContact CB-OG 3.27Å; T281-S285 WeakPolarHBondContact O-CB 3.47Å; T281-S285 PolarHBondContact O-N 3.21Å; N282-S285 WeakPolarHBondContact O-CB 3.33Å; N282-S285 PolarHBondContact O-N 2.98Å; S285-F288 PolarHBondContact O-N 3.11Å; S285-L289 WeakPolarHBondContact O-CB 3.4Å; S285-L289 PolarHBondContact O-N 3.49Å
286V85.8Confident87.2Confident14 Ų1427.3 Ų27.39%0.08513%0.133CC..Hα-helixtrans-63.2-46.2-179.5170.70000111.2N282 A283 F284 F288 Y290 L346N282-V286 WeakPolarHBondContact O-CB 3.36Å; N282-V286 VanDerWaalsContact O-CG2 3.28Å; N282-V286 WeakPolarHBondContact O-CG2 3.44Å; N282-V286 PolarHBondContact O-N 2.91Å; A283-V286 PolarHBondContact O-N 3.19Å; F284-V286 PolarHBondContact O-N 3.45Å; V286-F288 PolarHBondContact O-N 2.9Å; V286-Y290 HydrophobicContact CG1-CD2 3.6Å; V286-Y290 HydrophobicContact CG1-CE2 3.59Å; V286-Y290 WeakPolarHBondContact O-CD2 3.2Å; V286-Y290 PolarHBondContact O-N 2.92Å; V286-Y290 VanDerWaalsContact O-N 3.08Å; V286-L346 HydrophobicContact CG1-CD2 4.4Å
287A90.4Very high86.6Confident1 Ų118.4 Ų18.41%0.00810%0.1CC..Hα-helixtrans-57.5-51.2175.900000111.1A283 F284 A291 L322 G325A283-A287 VanDerWaalsContact O-CB 3.28Å; A283-A287 WeakPolarHBondContact O-CB 3.32Å; A283-A287 PolarHBondContact O-N 3.44Å; F284-A287 PolarHBondContact O-N 3.25Å; A287-A291 WeakPolarHBondContact O-CB 3.31Å; A287-A291 PolarHBondContact O-N 2.94Å; A287-A291 VanDerWaalsContact O-N 3.1Å; A287-L322 HydrophobicContact CB-CD1 4.23Å; A287-G325 WeakPolarHBondContact CA-O 3.42Å; A287-G325 VanDerWaalsContact CB-C 3.48Å; A287-G325 WeakPolarHBondContact CB-O 3.39Å; A287-G325 WeakPolarHBondContact O-CA 3.32Å
288F90.6Very high86.1Confident4 Ų416.8 Ų16.82%0.0189%0.088CC..Hα-helixtrans-65.7-43.6-176.7-168.4-102.1000112.3F261 F284 S285 V286 A291 C292 I314 W318 F321 L385F261-F288 AromaticContact CE1-CD1 3.75Å; F261-F288 HydrophobicContact CE1-CD1 3.75Å; F261-F288 HydrophobicContact CE1-CE1 4.24Å; F261-F288 AromaticContact CZ-CD1 3.8Å; F261-F288 HydrophobicContact CZ-CD1 3.8Å; F261-F288 AromaticContact CZ-CE1 3.97Å; F261-F288 HydrophobicContact CZ-CE1 3.97Å; F284-F288 VanDerWaalsContact O-CB 3.27Å; F284-F288 WeakPolarHBondContact O-CB 3.48Å; F284-F288 PolarHBondContact O-N 3.49Å; S285-F288 PolarHBondContact O-N 3.11Å; V286-F288 PolarHBondContact O-N 2.9Å; F288-A291 PolarHBondContact O-N 2.71Å; F288-C292 WeakPolarHBondContact CE1-SG 3.2Å; F288-C292 VanDerWaalsContact CZ-SG 3.59Å; F288-C292 WeakPolarHBondContact O-CB 3.48Å; F288-C292 PolarHBondContact O-N 2.86Å; F288-C292 PolarHBondContact O-SG 3.39Å; F288-I314 HydrophobicContact CE1-CG2 4.08Å; F288-I314 HydrophobicContact CE2-CG2 4.2Å; F288-I314 HydrophobicContact CZ-CG2 3.33Å; F288-W318 HydrophobicContact CE2-CB 4.35Å; F288-F321 HydrophobicContact CD2-CB 4.13Å; F288-F321 HydrophobicContact CE2-CB 3.86Å; F288-L385 HydrophobicContact CD1-CD1 4.42Å; F288-L385 HydrophobicContact CD2-CD1 4.11Å; F288-L385 HydrophobicContact CE1-CD1 3.89Å; F288-L385 HydrophobicContact CE1-CG 4.49Å; F288-L385 HydrophobicContact CE2-CD1 3.57Å; F288-L385 HydrophobicContact CG-CD1 4.5Å; F288-L385 HydrophobicContact CZ-CD1 3.42Å; F288-L385 VanDerWaalsContact CZ-CD1 3.42Å; F288-L385 HydrophobicContact CZ-CD2 4.39Å; F288-L385 HydrophobicContact CZ-CG 4.24Å
289L88.1Confident85.7Confident3 Ų317.5 Ų17.52%0.0169%0.089CC..Hα-helixtrans-57.3-52.9177.2-177.174.3000111.3L183 F258 Q262 S285 A291 C292 Y293L183-L289 HydrophobicContact CD1-CD2 4.41Å; F258-L289 HydrophobicContact CB-CD1 3.88Å; F258-L289 HydrophobicContact CD1-CD1 4.04Å; F258-L289 HydrophobicContact CG-CD1 4.25Å; Q262-L289 HydrophobicContact CB-CD1 4.16Å; Q262-L289 HydrophobicContact CB-CD2 4.07Å; Q262-L289 HydrophobicContact CG-CD2 3.83Å; S285-L289 WeakPolarHBondContact O-CB 3.4Å; S285-L289 PolarHBondContact O-N 3.49Å; L289-A291 VanDerWaalsContact C-N 3.33Å; L289-A291 PolarHBondContact O-N 2.85Å; L289-C292 PolarHBondContact O-N 3.35Å; L289-Y293 HydrophobicContact CD1-CD2 3.9Å; L289-Y293 HydrophobicContact CD1-CE2 3.34Å; L289-Y293 HydrophobicContact CD2-CD2 4.36Å; L289-Y293 HydrophobicContact CD2-CE2 3.85Å; L289-Y293 HydrophobicContact CG-CD2 3.64Å; L289-Y293 HydrophobicContact CG-CE2 3.41Å; L289-Y293 VanDerWaalsContact CG-CE2 3.41Å; L289-Y293 VanDerWaalsContact O-CD2 3.26Å; L289-Y293 WeakPolarHBondContact O-CD2 3.43Å; L289-Y293 PolarHBondContact O-N 2.71Å
290Y86Confident85.2Confident21 Ų2117.6 Ų17.68%0.0829%0.087CC..Hα-helixtrans-65.9-36.3-177.7-79.7-57000112.8V286 A294 L328 L346 Y350 L353V286-Y290 HydrophobicContact CG1-CD2 3.6Å; V286-Y290 HydrophobicContact CG1-CE2 3.59Å; V286-Y290 WeakPolarHBondContact O-CD2 3.2Å; V286-Y290 PolarHBondContact O-N 2.92Å; V286-Y290 VanDerWaalsContact O-N 3.08Å; Y290-A294 WeakPolarHBondContact O-CB 3.39Å; Y290-A294 PolarHBondContact O-N 3.16Å; Y290-A294 VanDerWaalsContact O-N 3.08Å; Y290-L328 HydrophobicContact CD2-CB 4.28Å; Y290-L346 HydrophobicContact CD2-CD2 4.35Å; Y290-L346 HydrophobicContact CE2-CD1 4.2Å; Y290-L346 HydrophobicContact CE2-CD2 3.67Å; Y290-L346 HydrophobicContact CE2-CG 4.33Å; Y290-Y350 AromaticContact CD1-CD2 3.22Å; Y290-Y350 HydrophobicContact CD1-CD2 3.22Å; Y290-Y350 AromaticContact CD1-CE2 3.74Å; Y290-Y350 HydrophobicContact CD1-CE2 3.74Å; Y290-Y350 HydrophobicContact CD1-CG 4.05Å; Y290-Y350 AromaticContact CE1-CD2 3.64Å; Y290-Y350 HydrophobicContact CE1-CD2 3.64Å; Y290-Y350 HydrophobicContact CE1-CE2 4.26Å; Y290-Y350 HydrophobicContact CE1-CG 4.03Å; Y290-Y350 HydrophobicContact CG-CD2 4.28Å; Y290-L353 WeakPolarHBondContact O-CD2 3.15Å
291A89.7Confident84.3Confident0 Ų017.5 Ų17.50%08%0.081CC..Hα-helixtrans-63.8-50.617300000111.6A287 F288 L289 Y293 A294 F295 F321 Y324A287-A291 WeakPolarHBondContact O-CB 3.31Å; A287-A291 PolarHBondContact O-N 2.94Å; A287-A291 VanDerWaalsContact O-N 3.1Å; F288-A291 PolarHBondContact O-N 2.71Å; L289-A291 VanDerWaalsContact C-N 3.33Å; L289-A291 PolarHBondContact O-N 2.85Å; A291-Y293 VanDerWaalsContact C-N 3.33Å; A291-Y293 PolarHBondContact O-N 2.89Å; A291-A294 PolarHBondContact O-N 3.29Å; A291-F295 WeakPolarHBondContact O-CD2 3.35Å; A291-F295 PolarHBondContact O-N 3.5Å; A291-F321 HydrophobicContact CB-CB 4.12Å; A291-F321 HydrophobicContact CB-CD1 4.32Å; A291-F321 WeakPolarHBondContact CB-O 3.49Å; A291-Y324 HydrophobicContact CB-CD1 4.22Å
292C89Confident83.4Confident0 Ų020.4 Ų20.40%010%0.099CC..Hα-helixtrans-56.5-47.9177.9-75.40000111.3F258 F288 L289 A294 F295 E296 F310 I314F258-C292 HydrophobicContact CD1-CB 4.45Å; F258-C292 HydrophobicContact CE1-CB 3.5Å; F258-C292 HydrophobicContact CZ-CB 3.57Å; F288-C292 WeakPolarHBondContact CE1-SG 3.2Å; F288-C292 VanDerWaalsContact CZ-SG 3.59Å; F288-C292 WeakPolarHBondContact O-CB 3.48Å; F288-C292 PolarHBondContact O-N 2.86Å; F288-C292 PolarHBondContact O-SG 3.39Å; L289-C292 PolarHBondContact O-N 3.35Å; C292-A294 PolarHBondContact O-N 2.95Å; C292-F295 PolarHBondContact O-N 3.32Å; C292-E296 WeakPolarHBondContact O-CB 3.49Å; C292-E296 PolarHBondContact O-N 2.97Å; C292-F310 WeakPolarHBondContact O-CZ 3.47Å; C292-I314 HydrophobicContact CB-CD1 4.43Å
293Y83.7Confident82.4Confident6 Ų622.7 Ų22.72%0.02413%0.125CC..Hα-helixtrans-58.2-47.4177-82.6-52.3000112.7E187 F258 L289 A291 F295 E296 Y297E187-Y293 PolarHBondContact OE2-OH 3.33Å; F258-Y293 HydrophobicContact CB-CE1 3.66Å; F258-Y293 HydrophobicContact CB-CE2 4.13Å; F258-Y293 WeakPolarHBondContact CB-OH 3.43Å; F258-Y293 AromaticContact CD2-CD1 3.76Å; F258-Y293 HydrophobicContact CD2-CD1 3.76Å; F258-Y293 AromaticContact CD2-CE1 3.42Å; F258-Y293 HydrophobicContact CD2-CE1 3.42Å; F258-Y293 VanDerWaalsContact CD2-CE1 3.42Å; F258-Y293 HydrophobicContact CE2-CD1 4.23Å; F258-Y293 HydrophobicContact CE2-CE1 4.33Å; F258-Y293 HydrophobicContact CG-CD1 4.32Å; F258-Y293 AromaticContact CG-CE1 3.79Å; F258-Y293 HydrophobicContact CG-CE1 3.79Å; F258-Y293 AromaticContact CG-CZ 3.91Å; L289-Y293 HydrophobicContact CD1-CD2 3.9Å; L289-Y293 HydrophobicContact CD1-CE2 3.34Å; L289-Y293 HydrophobicContact CD2-CD2 4.36Å; L289-Y293 HydrophobicContact CD2-CE2 3.85Å; L289-Y293 HydrophobicContact CG-CD2 3.64Å; L289-Y293 HydrophobicContact CG-CE2 3.41Å; L289-Y293 VanDerWaalsContact CG-CE2 3.41Å; L289-Y293 VanDerWaalsContact O-CD2 3.26Å; L289-Y293 WeakPolarHBondContact O-CD2 3.43Å; L289-Y293 PolarHBondContact O-N 2.71Å; A291-Y293 VanDerWaalsContact C-N 3.33Å; A291-Y293 PolarHBondContact O-N 2.89Å; Y293-F295 VanDerWaalsContact C-N 3.34Å; Y293-F295 PolarHBondContact O-N 2.94Å; Y293-E296 VanDerWaalsContact O-CB 3.25Å; Y293-E296 WeakPolarHBondContact O-CB 3.31Å; Y293-E296 PolarHBondContact O-N 2.79Å; Y293-E296 VanDerWaalsContact O-N 3.15Å; Y293-Y297 WeakPolarHBondContact O-CD2 3.4Å; Y293-Y297 PolarHBondContact O-N 3.13Å
294A84Confident81.4Confident0 Ų026.3 Ų26.30%016%0.162CC..Hα-helixtrans-64-38.4-179.100000114.2Y290 A291 C292 E296 Y297 Y324 L353 V354 A357Y290-A294 WeakPolarHBondContact O-CB 3.39Å; Y290-A294 PolarHBondContact O-N 3.16Å; Y290-A294 VanDerWaalsContact O-N 3.08Å; A291-A294 PolarHBondContact O-N 3.29Å; C292-A294 PolarHBondContact O-N 2.95Å; A294-E296 VanDerWaalsContact C-N 3.33Å; A294-Y297 PolarHBondContact O-N 3.37Å; A294-Y324 HydrophobicContact CB-CE1 4.47Å; A294-L353 HydrophobicContact CB-CD2 3.03Å; A294-L353 HydrophobicContact CB-CG 4.41Å; A294-V354 HydrophobicContact CB-CB 4.32Å; A294-V354 HydrophobicContact CB-CG2 4.04Å; A294-A357 HydrophobicContact CB-CB 3.8Å
295F86.2Confident80.6Confident2 Ų226.8 Ų26.81%0.00917%0.167CC..Hα-helixtrans-73.6-26.4174.6-79-68.5000112.8A291 C292 Y293 Y297 R298 W299 F310 Y320 F321 Y324 A357 W362A291-F295 WeakPolarHBondContact O-CD2 3.35Å; A291-F295 PolarHBondContact O-N 3.5Å; C292-F295 PolarHBondContact O-N 3.32Å; Y293-F295 VanDerWaalsContact C-N 3.34Å; Y293-F295 PolarHBondContact O-N 2.94Å; F295-Y297 VanDerWaalsContact C-N 3.3Å; F295-Y297 PolarHBondContact O-N 2.96Å; F295-R298 WeakPolarHBondContact O-CB 3.33Å; F295-R298 PolarHBondContact O-N 3.44Å; F295-W299 VanDerWaalsContact O-CB 3.31Å; F295-W299 WeakPolarHBondContact O-CB 3.39Å; F295-W299 PolarHBondContact O-N 3.32Å; F295-F310 HydrophobicContact CB-CE2 4.2Å; F295-F310 HydrophobicContact CB-CZ 4.31Å; F295-Y320 HydrophobicContact CD2-CE1 4.46Å; F295-Y320 AromaticContact CE1-CE1 3.98Å; F295-Y320 HydrophobicContact CE1-CE1 3.98Å; F295-Y320 HydrophobicContact CE2-CD1 4.46Å; F295-Y320 AromaticContact CE2-CE1 3.59Å; F295-Y320 HydrophobicContact CE2-CE1 3.59Å; F295-Y320 AromaticContact CZ-CE1 3.34Å; F295-Y320 HydrophobicContact CZ-CE1 3.34Å; F295-Y320 AromaticContact CZ-CZ 3.7Å; F295-Y320 WeakPolarHBondContact CZ-OH 3.34Å; F295-F321 HydrophobicContact CB-CD1 4.38Å; F295-F321 HydrophobicContact CB-CE1 3.55Å; F295-F321 HydrophobicContact CB-CZ 4.28Å; F295-F321 AromaticContact CD2-CD1 3.66Å; F295-F321 HydrophobicContact CD2-CD1 3.66Å; F295-F321 AromaticContact CD2-CE1 3.57Å; F295-F321 HydrophobicContact CD2-CE1 3.57Å; F295-F321 HydrophobicContact CD2-CZ 4.43Å; F295-F321 HydrophobicContact CE2-CD1 4.45Å; F295-F321 HydrophobicContact CG-CD1 4.31Å; F295-F321 AromaticContact CG-CE1 3.74Å; F295-F321 HydrophobicContact CG-CE1 3.74Å; F295-F321 HydrophobicContact CG-CZ 4.38Å; F295-Y324 HydrophobicContact CD2-CD1 4.22Å; F295-Y324 AromaticContact CE2-CD1 3.34Å; F295-Y324 HydrophobicContact CE2-CD1 3.34Å; F295-Y324 HydrophobicContact CE2-CD2 4.38Å; F295-Y324 AromaticContact CE2-CE1 3.74Å; F295-Y324 HydrophobicContact CE2-CE1 3.74Å; F295-Y324 AromaticContact CE2-CG 3.7Å; F295-Y324 HydrophobicContact CE2-CG 3.7Å; F295-Y324 AromaticContact CZ-CD1 3.95Å; F295-Y324 HydrophobicContact CZ-CD1 3.95Å; F295-Y324 HydrophobicContact CZ-CD2 4.35Å; F295-Y324 HydrophobicContact CZ-CE1 4.03Å; F295-Y324 HydrophobicContact CZ-CG 4.12Å; F295-A357 HydrophobicContact CD1-CB 4.15Å; F295-A357 HydrophobicContact CE1-CB 3.99Å; F295-A357 HydrophobicContact CG-CB 4.45Å; F295-A357 HydrophobicContact CZ-CB 4.15Å; F295-W362 HydrophobicContact CD1-CD2 4.35Å; F295-W362 HydrophobicContact CD1-CG 4.18Å; F295-W362 HydrophobicContact CE1-CB 4.09Å; F295-W362 AromaticContact CE1-CD1 3.78Å; F295-W362 AromaticContact CE1-CG 3.89Å; F295-W362 HydrophobicContact CE1-CG 3.89Å
296E83.8Confident80.3Confident2 Ų230.6 Ų30.61%0.00919%0.191CC..Hα-helixtrans-59.4-44.1172-166.5-145.2141.400110.4R251 T254 C292 Y293 A294 R298 W299 R300 F310R251-E296 IonicContact CZ-OE1 2.8Å; R251-E296 IonicContact NH1-OE1 3.79Å; R251-E296 PolarHBondContact NH1-OE1 3.4Å; T254-E296 HydrophobicContact CG2-CG 3.85Å; T254-E296 WeakPolarHBondContact CG2-OE2 3.47Å; C292-E296 WeakPolarHBondContact O-CB 3.49Å; C292-E296 PolarHBondContact O-N 2.97Å; Y293-E296 VanDerWaalsContact O-CB 3.25Å; Y293-E296 WeakPolarHBondContact O-CB 3.31Å; Y293-E296 PolarHBondContact O-N 2.79Å; Y293-E296 VanDerWaalsContact O-N 3.15Å; A294-E296 VanDerWaalsContact C-N 3.33Å; E296-R298 VanDerWaalsContact C-N 3.31Å; E296-R298 PolarHBondContact O-N 3.27Å; E296-W299 WeakPolarHBondContact O-CB 3.09Å; E296-W299 PolarHBondContact O-N 2.92Å; E296-R300 HydrophobicContact CG-CG 4.47Å; E296-R300 WeakPolarHBondContact O-CG 3.26Å; E296-R300 PolarHBondContact O-N 3.48Å; E296-R300 VanDerWaalsContact O-N 3.07Å; E296-R300 IonicContact OE1-CZ 2.62Å; E296-R300 IonicContact OE1-NE 2.71Å; E296-R300 PolarHBondContact OE1-NE 2.97Å; E296-R300 IonicContact OE1-NH2 3.91Å; E296-R300 PolarHBondContact OE1-NH2 2.94Å; E296-F310 HydrophobicContact CB-CE1 3.7Å; E296-F310 HydrophobicContact CB-CZ 3.8Å; E296-F310 HydrophobicContact CG-CD1 4.33Å; E296-F310 HydrophobicContact CG-CE1 3.89Å; E296-F310 HydrophobicContact CG-CZ 4.41Å
297Y76.4Confident80.1Confident10 Ų1030.1 Ų30.14%0.03919%0.188CC..Hα-helixtrans-57.9-43.5175.3-80.6-87.8000112.8L191 L194 Y293 A294 F295 Y350 V354L191-Y297 WeakPolarHBondContact CA-OH 3.24Å; L191-Y297 HydrophobicContact CD2-CE1 3.52Å; L191-Y297 VanDerWaalsContact CD2-OH 3.29Å; L191-Y297 WeakPolarHBondContact CD2-OH 3.46Å; L191-Y297 HydrophobicContact CG-CE1 4.25Å; L191-Y297 WeakPolarHBondContact CG-OH 3.32Å; L191-Y297 PolarHBondContact N-OH 3.25Å; L191-Y297 VanDerWaalsContact N-OH 3.17Å; L194-Y297 HydrophobicContact CB-CD1 3.94Å; L194-Y297 HydrophobicContact CB-CE1 3.67Å; L194-Y297 HydrophobicContact CD1-CD1 4.26Å; L194-Y297 HydrophobicContact CD1-CE1 3.94Å; L194-Y297 HydrophobicContact CD1-CE2 4.44Å; L194-Y297 HydrophobicContact CD2-CD1 3.86Å; L194-Y297 HydrophobicContact CD2-CE1 4.3Å; L194-Y297 HydrophobicContact CD2-CG 4.16Å; L194-Y297 HydrophobicContact CG-CD1 4.23Å; L194-Y297 HydrophobicContact CG-CE1 4.16Å; Y293-Y297 WeakPolarHBondContact O-CD2 3.4Å; Y293-Y297 PolarHBondContact O-N 3.13Å; A294-Y297 PolarHBondContact O-N 3.37Å; F295-Y297 VanDerWaalsContact C-N 3.3Å; F295-Y297 PolarHBondContact O-N 2.96Å; Y297-Y350 VanDerWaalsContact CE2-OH 3.31Å; Y297-Y350 WeakPolarHBondContact CE2-OH 3.23Å; Y297-V354 HydrophobicContact CD1-CG1 4.49Å; Y297-V354 HydrophobicContact CD2-CG1 3.7Å; Y297-V354 HydrophobicContact CD2-CG2 4.42Å; Y297-V354 HydrophobicContact CE2-CG1 4.48Å; Y297-V354 HydrophobicContact CG-CG1 3.73Å
298R75.6Confident79.7Confident48 Ų4837.7 Ų37.718%0.18122%0.223CC..Hα-helixtrans-65.4-45.5176.2-173.8-154.4176.695.2-4.5111.3F295 E296 R300 Q301 A357 L358 S360 W362F295-R298 WeakPolarHBondContact O-CB 3.33Å; F295-R298 PolarHBondContact O-N 3.44Å; E296-R298 VanDerWaalsContact C-N 3.31Å; E296-R298 PolarHBondContact O-N 3.27Å; R298-R300 PolarHBondContact O-N 2.85Å; R298-Q301 WeakPolarHBondContact O-CB 3.35Å; R298-Q301 PolarHBondContact O-N 3.38Å; R298-Q301 VanDerWaalsContact O-N 3.08Å; R298-A357 WeakPolarHBondContact CD-O 3.48Å; R298-A357 PolarHBondContact NH1-O 2.91Å; R298-L358 HydrophobicContact CB-CD2 3.99Å; R298-L358 HydrophobicContact CG-CD2 4.44Å; R298-L358 PolarHBondContact NH1-O 3.12Å; R298-S360 PolarHBondContact NH1-O 3.18Å; R298-S360 PolarHBondContact NH1-OG 2.85Å; R298-S360 PolarHBondContact NH2-O 3.04Å; R298-W362 VanDerWaalsContact CZ-CB 3.5Å; R298-W362 PolarHBondContact NH2-O 3.29Å
299W78.9Confident79.3Confident23 Ų2339 Ų399%0.08724%0.237CC..Hα-helixtrans-53.9-44.3-178.9-177.2-112.9000111.3F295 E296 Q301 V302 T305 T306 F310 W362F295-W299 VanDerWaalsContact O-CB 3.31Å; F295-W299 WeakPolarHBondContact O-CB 3.39Å; F295-W299 PolarHBondContact O-N 3.32Å; E296-W299 WeakPolarHBondContact O-CB 3.09Å; E296-W299 PolarHBondContact O-N 2.92Å; W299-Q301 PolarHBondContact O-N 3.23Å; W299-V302 WeakPolarHBondContact O-CB 3.29Å; W299-V302 PolarHBondContact O-N 2.82Å; W299-T305 HydrophobicContact CD2-CG2 4.18Å; W299-T305 VanDerWaalsContact CE2-CB 3.44Å; W299-T305 HydrophobicContact CE3-CG2 4.42Å; W299-T305 HydrophobicContact CH2-CG2 3.85Å; W299-T305 HydrophobicContact CZ2-CG2 3.65Å; W299-T305 HydrophobicContact CZ3-CG2 4.2Å; W299-T305 PolarHBondContact O-OG1 3.17Å; W299-T306 PolarHBondContact NE1-O 3.48Å; W299-T306 VanDerWaalsContact NE1-O 3.11Å; W299-F310 HydrophobicContact CB-CD2 3.95Å; W299-F310 HydrophobicContact CB-CE2 4.18Å; W299-F310 AromaticContact CD1-CD2 3.91Å; W299-F310 AromaticContact CD1-CG 3.9Å; W299-F310 HydrophobicContact CD2-CB 4.41Å; W299-F310 AromaticContact CD2-CD2 3.99Å; W299-F310 HydrophobicContact CD2-CD2 3.99Å; W299-F310 HydrophobicContact CG-CB 4.24Å; W299-F310 AromaticContact CG-CD2 3.67Å; W299-F310 HydrophobicContact CG-CD2 3.67Å; W299-F310 HydrophobicContact CG-CE2 4.38Å; W299-F310 HydrophobicContact CG-CG 4.14Å; W299-W362 HydrophobicContact CE3-CZ3 4.03Å; W299-W362 HydrophobicContact CZ3-CZ3 4.21Å
300R74.7Confident79.1Confident44 Ų4438.9 Ų38.917%0.16624%0.237CC..THydrogen-bonded Turntrans-70.5-14.2-177.7-56.5-107.6-161.2-173.1-5114.5D250 R251 T254 E296 R298 V302D250-R300 VanDerWaalsContact C-NH1 3.32Å; D250-R300 VanDerWaalsContact CG-NH1 3.31Å; D250-R300 PolarHBondContact O-NH2 3.42Å; D250-R300 IonicContact OD2-CZ 3.91Å; D250-R300 IonicContact OD2-NH1 2.89Å; D250-R300 PolarHBondContact OD2-NH1 3.19Å; D250-R300 IonicContact OD2-NH2 2.94Å; R251-R300 VanDerWaalsContact CA-NH2 3.34Å; R251-R300 VanDerWaalsContact CZ-CG 3.42Å; R251-R300 VanDerWaalsContact NH1-NE 3.18Å; R251-R300 VanDerWaalsContact NH2-CD 3.34Å; T254-R300 VanDerWaalsContact CB-NH2 3.25Å; T254-R300 PolarHBondContact OG1-NH2 3.27Å; E296-R300 HydrophobicContact CG-CG 4.47Å; E296-R300 WeakPolarHBondContact O-CG 3.26Å; E296-R300 PolarHBondContact O-N 3.48Å; E296-R300 VanDerWaalsContact O-N 3.07Å; E296-R300 IonicContact OE1-CZ 2.62Å; E296-R300 IonicContact OE1-NE 2.71Å; E296-R300 PolarHBondContact OE1-NE 2.97Å; E296-R300 IonicContact OE1-NH2 3.91Å; E296-R300 PolarHBondContact OE1-NH2 2.94Å; R298-R300 PolarHBondContact O-N 2.85Å; R300-V302 PolarHBondContact O-N 3.38Å
301Q69.4Low79.2Confident84 Ų8438.8 Ų38.839%0.39324%0.237SC..THydrogen-bonded Turntrans-72.2-18.7172.1-64.6-177-10.900111.6C198 R298 W299C198-Q301 PolarHBondContact SG-NE2 3.08Å; R298-Q301 WeakPolarHBondContact O-CB 3.35Å; R298-Q301 PolarHBondContact O-N 3.38Å; R298-Q301 VanDerWaalsContact O-N 3.08Å; W299-Q301 PolarHBondContact O-N 3.23Å
302V69.1Low78.9Confident85 Ų8540.4 Ų40.452%0.51525%0.254SS..SBendtrans-90.3114.4175.2-173.50000108.6W299 R300 T305W299-V302 WeakPolarHBondContact O-CB 3.29Å; W299-V302 PolarHBondContact O-N 2.82Å; R300-V302 PolarHBondContact O-N 3.38Å; V302-T305 HydrophobicContact CB-CG2 3.84Å; V302-T305 HydrophobicContact CG1-CG2 3.84Å; V302-T305 WeakPolarHBondContact O-CG2 3.16Å; V302-T305 PolarHBondContact O-OG1 3.29Å
303A64.1Low78.6Confident97 Ų9744.6 Ų44.680%0.80227%0.27SS*.THydrogen-bonded Turntrans-61.4144.1179.500000111.8T305A303-T305 VanDerWaalsContact C-N 3.35Å
304G66.6Low78.8Confident85 Ų8544.4 Ų44.488%0.87627%0.269SS*.THydrogen-bonded Turntrans79.711.6176.900000115.1
305T72.2Confident78.9Confident33 Ų3345.7 Ų45.720%0.20228%0.277CS..  trans-89131.7177.856.70000111.6W299 V302 A303W299-T305 HydrophobicContact CD2-CG2 4.18Å; W299-T305 VanDerWaalsContact CE2-CB 3.44Å; W299-T305 HydrophobicContact CE3-CG2 4.42Å; W299-T305 HydrophobicContact CH2-CG2 3.85Å; W299-T305 HydrophobicContact CZ2-CG2 3.65Å; W299-T305 HydrophobicContact CZ3-CG2 4.2Å; W299-T305 PolarHBondContact O-OG1 3.17Å; V302-T305 HydrophobicContact CB-CG2 3.84Å; V302-T305 HydrophobicContact CG1-CG2 3.84Å; V302-T305 WeakPolarHBondContact O-CG2 3.16Å; V302-T305 PolarHBondContact O-OG1 3.29Å; A303-T305 VanDerWaalsContact C-N 3.35Å
306T81.5Confident78.8Confident80 Ų8050.1 Ų50.149%0.49130%0.301SS..  trans-97.3158.2176.9610000111.1W299 E308 G309 F310W299-T306 PolarHBondContact NE1-O 3.48Å; W299-T306 VanDerWaalsContact NE1-O 3.11Å; T306-E308 VanDerWaalsContact C-N 3.29Å; T306-E308 PolarHBondContact O-N 2.98Å; T306-G309 PolarHBondContact O-N 3.36Å; T306-G309 PolarHBondContact OG1-N 3.22Å; T306-F310 PolarHBondContact O-N 3.18Å; T306-F310 VanDerWaalsContact O-N 3.1Å
307F82Confident78.8Confident5 Ų550.9 Ų50.92%0.02231%0.305CS..Hα-helixtrans-60.5-36.9170.8172.4-96.2000112.6D250 Y253 T254 F257 G309 F310 L311 L393D250-F307 VanDerWaalsContact OD1-CB 3.29Å; D250-F307 WeakPolarHBondContact OD1-CB 3.26Å; Y253-F307 HydrophobicContact CD1-CB 4.4Å; Y253-F307 AromaticContact CD1-CD1 3.6Å; Y253-F307 HydrophobicContact CD1-CD1 3.6Å; Y253-F307 AromaticContact CD1-CE1 3.99Å; Y253-F307 HydrophobicContact CD1-CE1 3.99Å; Y253-F307 AromaticContact CD1-CG 3.96Å; Y253-F307 HydrophobicContact CD1-CG 3.96Å; Y253-F307 AromaticContact CE1-CD1 3.29Å; Y253-F307 HydrophobicContact CE1-CD1 3.29Å; Y253-F307 AromaticContact CE1-CE1 3.41Å; Y253-F307 HydrophobicContact CE1-CE1 3.41Å; Y253-F307 VanDerWaalsContact CE1-CE1 3.41Å; Y253-F307 HydrophobicContact CE1-CG 4.11Å; Y253-F307 HydrophobicContact CE1-CZ 4.34Å; T254-F307 HydrophobicContact CG2-CD2 3.67Å; T254-F307 HydrophobicContact CG2-CE2 3.69Å; T254-F307 WeakPolarHBondContact OG1-CD2 3.34Å; F257-F307 HydrophobicContact CB-CZ 4.03Å; F257-F307 AromaticContact CD1-CE2 3.94Å; F257-F307 HydrophobicContact CD1-CE2 3.94Å; F257-F307 AromaticContact CD1-CZ 3.43Å; F257-F307 HydrophobicContact CD1-CZ 3.43Å; F257-F307 VanDerWaalsContact CD1-CZ 3.43Å; F257-F307 HydrophobicContact CD2-CE1 4.47Å; F257-F307 HydrophobicContact CD2-CZ 4.04Å; F257-F307 HydrophobicContact CE1-CE2 4.45Å; F257-F307 AromaticContact CE1-CZ 3.84Å; F257-F307 HydrophobicContact CE1-CZ 3.84Å; F257-F307 HydrophobicContact CE2-CZ 4.4Å; F257-F307 HydrophobicContact CG-CE1 4.29Å; F257-F307 HydrophobicContact CG-CE2 4.32Å; F257-F307 AromaticContact CG-CZ 3.53Å; F257-F307 HydrophobicContact CG-CZ 3.53Å; F257-F307 HydrophobicContact CZ-CZ 4.3Å; F307-G309 VanDerWaalsContact C-N 3.33Å; F307-G309 PolarHBondContact O-N 3.46Å; F307-F310 HydrophobicContact CD2-CD1 4.31Å; F307-F310 HydrophobicContact CE2-CD1 4.42Å; F307-F310 WeakPolarHBondContact O-CA 3.36Å; F307-F310 VanDerWaalsContact O-CB 3.23Å; F307-F310 WeakPolarHBondContact O-CB 3.44Å; F307-F310 PolarHBondContact O-N 3.06Å; F307-F310 VanDerWaalsContact O-N 3.08Å; F307-L311 HydrophobicContact CE1-CD2 4.21Å; F307-L311 HydrophobicContact CZ-CD1 4.11Å; F307-L311 HydrophobicContact CZ-CD2 4.46Å; F307-L311 PolarHBondContact O-N 2.75Å; F307-L393 HydrophobicContact CE1-CD2 3.96Å
308E82.4Confident79.3Confident160 Ų16050.4 Ų50.475%0.74830%0.303SS*.Hα-helixtrans-61.1-42.7176.6-63.7-174.4162.800111.9T306 F310 L311 G312T306-E308 VanDerWaalsContact C-N 3.29Å; T306-E308 PolarHBondContact O-N 2.98Å; E308-F310 VanDerWaalsContact C-N 3.28Å; E308-F310 PolarHBondContact O-N 3.07Å; E308-L311 PolarHBondContact O-N 2.85Å; E308-G312 PolarHBondContact O-N 3.16Å
309G81.6Confident79.9Confident31 Ų3148.1 Ų48.132%0.3230%0.295SS..Hα-helixtrans-63.9-34.2173.900000112.7T306 F307 R313T306-G309 PolarHBondContact O-N 3.36Å; T306-G309 PolarHBondContact OG1-N 3.22Å; F307-G309 VanDerWaalsContact C-N 3.33Å; F307-G309 PolarHBondContact O-N 3.46Å; G309-R313 WeakPolarHBondContact O-CG 3.3Å; G309-R313 PolarHBondContact O-N 2.81Å
310F85.1Confident80.3Confident1 Ų147.2 Ų47.20%0.00429%0.291CS..Hα-helixtrans-63.3-45.9172.8-173.6-134000111.4F258 C292 F295 E296 W299 T306 F307 E308 G312 R313 I314 F321F258-F310 HydrophobicContact CE2-CE1 4.16Å; F258-F310 AromaticContact CZ-CE1 3.89Å; F258-F310 HydrophobicContact CZ-CE1 3.89Å; C292-F310 WeakPolarHBondContact O-CZ 3.47Å; F295-F310 HydrophobicContact CB-CE2 4.2Å; F295-F310 HydrophobicContact CB-CZ 4.31Å; E296-F310 HydrophobicContact CB-CE1 3.7Å; E296-F310 HydrophobicContact CB-CZ 3.8Å; E296-F310 HydrophobicContact CG-CD1 4.33Å; E296-F310 HydrophobicContact CG-CE1 3.89Å; E296-F310 HydrophobicContact CG-CZ 4.41Å; W299-F310 HydrophobicContact CB-CD2 3.95Å; W299-F310 HydrophobicContact CB-CE2 4.18Å; W299-F310 AromaticContact CD1-CD2 3.91Å; W299-F310 AromaticContact CD1-CG 3.9Å; W299-F310 HydrophobicContact CD2-CB 4.41Å; W299-F310 AromaticContact CD2-CD2 3.99Å; W299-F310 HydrophobicContact CD2-CD2 3.99Å; W299-F310 HydrophobicContact CG-CB 4.24Å; W299-F310 AromaticContact CG-CD2 3.67Å; W299-F310 HydrophobicContact CG-CD2 3.67Å; W299-F310 HydrophobicContact CG-CE2 4.38Å; W299-F310 HydrophobicContact CG-CG 4.14Å; T306-F310 PolarHBondContact O-N 3.18Å; T306-F310 VanDerWaalsContact O-N 3.1Å; F307-F310 HydrophobicContact CD2-CD1 4.31Å; F307-F310 HydrophobicContact CE2-CD1 4.42Å; F307-F310 WeakPolarHBondContact O-CA 3.36Å; F307-F310 VanDerWaalsContact O-CB 3.23Å; F307-F310 WeakPolarHBondContact O-CB 3.44Å; F307-F310 PolarHBondContact O-N 3.06Å; F307-F310 VanDerWaalsContact O-N 3.08Å; E308-F310 VanDerWaalsContact C-N 3.28Å; E308-F310 PolarHBondContact O-N 3.07Å; F310-G312 PolarHBondContact O-N 3.2Å; F310-R313 PolarHBondContact O-N 3.37Å; F310-R313 VanDerWaalsContact O-N 3.16Å; F310-I314 HydrophobicContact CD1-CD1 3.59Å; F310-I314 HydrophobicContact CD2-CD1 4.28Å; F310-I314 HydrophobicContact CD2-CG1 4.39Å; F310-I314 HydrophobicContact CE1-CD1 3.33Å; F310-I314 HydrophobicContact CE1-CG1 4.28Å; F310-I314 HydrophobicContact CE2-CD1 4.02Å; F310-I314 HydrophobicContact CE2-CG1 4.08Å; F310-I314 HydrophobicContact CG-CD1 4.06Å; F310-I314 HydrophobicContact CZ-CD1 3.54Å; F310-I314 HydrophobicContact CZ-CG1 4.01Å; F310-I314 WeakPolarHBondContact O-CG1 3.46Å; F310-I314 PolarHBondContact O-N 2.85Å; F310-F321 HydrophobicContact CE2-CE1 4.46Å
311L86.8Confident81Confident19 Ų1945.1 Ų45.110%0.09928%0.283CS..Hα-helixtrans-64.9-41.3-177.2-160.166.1000112.1F257 F307 E308 R313 I314 V315 L389 L393F257-L311 HydrophobicContact CE1-CD1 3.93Å; F257-L311 HydrophobicContact CZ-CD1 3.77Å; F307-L311 HydrophobicContact CE1-CD2 4.21Å; F307-L311 HydrophobicContact CZ-CD1 4.11Å; F307-L311 HydrophobicContact CZ-CD2 4.46Å; F307-L311 PolarHBondContact O-N 2.75Å; E308-L311 PolarHBondContact O-N 2.85Å; L311-R313 VanDerWaalsContact C-N 3.3Å; L311-R313 PolarHBondContact O-N 3.17Å; L311-I314 HydrophobicContact CD1-CD1 4.4Å; L311-I314 PolarHBondContact O-N 3.07Å; L311-V315 WeakPolarHBondContact O-CG2 3.35Å; L311-V315 PolarHBondContact O-N 2.79Å; L311-L389 HydrophobicContact CD1-CD2 3.37Å; L311-L389 HydrophobicContact CD1-CG 4.34Å; L311-L389 HydrophobicContact CD2-CD2 4.03Å; L311-L389 HydrophobicContact CG-CD2 3.64Å; L311-L393 HydrophobicContact CD2-CD1 3.69Å; L311-L393 HydrophobicContact CD2-CD2 3.8Å; L311-L393 HydrophobicContact CD2-CG 4Å
312G84.4Confident82Confident34 Ų3441.6 Ų41.635%0.35127%0.267SS..Hα-helixtrans-55.4-46.917200000111.6E308 F310 I314 V315 D316E308-G312 PolarHBondContact O-N 3.16Å; F310-G312 PolarHBondContact O-N 3.2Å; G312-I314 PolarHBondContact O-N 3.38Å; G312-V315 PolarHBondContact O-N 2.92Å; G312-D316 VanDerWaalsContact O-CG 3.27Å; G312-D316 PolarHBondContact O-N 3.43Å
313R83Confident82.9Confident87 Ų8737.6 Ų37.633%0.32824%0.243SC..Hα-helixtrans-67.4-34.1178.6-69.6-168.6-177.4-160.78.7114.2G309 F310 L311 V315 N317 W362G309-R313 WeakPolarHBondContact O-CG 3.3Å; G309-R313 PolarHBondContact O-N 2.81Å; F310-R313 PolarHBondContact O-N 3.37Å; F310-R313 VanDerWaalsContact O-N 3.16Å; L311-R313 VanDerWaalsContact C-N 3.3Å; L311-R313 PolarHBondContact O-N 3.17Å; R313-V315 VanDerWaalsContact C-N 3.33Å; R313-N317 PolarHBondContact O-N 3.24Å; R313-N317 VanDerWaalsContact O-N 3.07Å; R313-W362 HydrophobicContact CB-CH2 3.88Å; R313-W362 HydrophobicContact CB-CZ2 4.42Å; R313-W362 HydrophobicContact CG-CH2 4.34Å
314I87Confident84.2Confident2 Ų233 Ų331%0.0120%0.204CC..Hα-helixtrans-61-46.5172.8-73.9165.4000109.6F258 F288 C292 F310 L311 G312 D316 N317 W318 F321F258-I314 HydrophobicContact CZ-CD1 4.26Å; F288-I314 HydrophobicContact CE1-CG2 4.08Å; F288-I314 HydrophobicContact CE2-CG2 4.2Å; F288-I314 HydrophobicContact CZ-CG2 3.33Å; C292-I314 HydrophobicContact CB-CD1 4.43Å; F310-I314 HydrophobicContact CD1-CD1 3.59Å; F310-I314 HydrophobicContact CD2-CD1 4.28Å; F310-I314 HydrophobicContact CD2-CG1 4.39Å; F310-I314 HydrophobicContact CE1-CD1 3.33Å; F310-I314 HydrophobicContact CE1-CG1 4.28Å; F310-I314 HydrophobicContact CE2-CD1 4.02Å; F310-I314 HydrophobicContact CE2-CG1 4.08Å; F310-I314 HydrophobicContact CG-CD1 4.06Å; F310-I314 HydrophobicContact CZ-CD1 3.54Å; F310-I314 HydrophobicContact CZ-CG1 4.01Å; F310-I314 WeakPolarHBondContact O-CG1 3.46Å; F310-I314 PolarHBondContact O-N 2.85Å; L311-I314 HydrophobicContact CD1-CD1 4.4Å; L311-I314 PolarHBondContact O-N 3.07Å; G312-I314 PolarHBondContact O-N 3.38Å; I314-D316 PolarHBondContact O-N 2.85Å; I314-N317 CarbonylContact O-C 3.6Å; I314-N317 PolarHBondContact O-N 3.43Å; I314-W318 WeakPolarHBondContact O-CA 3.47Å; I314-W318 VanDerWaalsContact O-CB 3.26Å; I314-W318 WeakPolarHBondContact O-CB 3.41Å; I314-W318 PolarHBondContact O-N 3.16Å; I314-F321 HydrophobicContact CB-CE2 4.46Å; I314-F321 HydrophobicContact CB-CZ 4.48Å; I314-F321 HydrophobicContact CG1-CE1 3.9Å; I314-F321 HydrophobicContact CG1-CE2 4.19Å; I314-F321 HydrophobicContact CG1-CZ 3.74Å
315V86.4Confident85.3Confident27 Ų2728.9 Ų28.916%0.16416%0.163CC..Hα-helixtrans-66-38.5-179.5173.40000111.7L311 G312 R313 L385 I386 L389L311-V315 WeakPolarHBondContact O-CG2 3.35Å; L311-V315 PolarHBondContact O-N 2.79Å; G312-V315 PolarHBondContact O-N 2.92Å; R313-V315 VanDerWaalsContact C-N 3.33Å; V315-L385 HydrophobicContact CG2-CD2 4.47Å; V315-I386 HydrophobicContact CG1-CD1 3.99Å; V315-I386 HydrophobicContact CG1-CG1 3.94Å; V315-L389 HydrophobicContact CG2-CD2 3.79Å
316D83.5Confident86.2Confident95 Ų9529.7 Ų29.751%0.50817%0.166SC..Hα-helixtrans-70-37.4-179.7-67.8-24.4000112.7G312 I314G312-D316 VanDerWaalsContact O-CG 3.27Å; G312-D316 PolarHBondContact O-N 3.43Å; I314-D316 PolarHBondContact O-N 2.85Å
317N84.4Confident86.5Confident18 Ų1827.4 Ų27.410%0.09615%0.152CC..THydrogen-bonded Turntrans-114.124.7-175.2-65.8-68000113.5R313 I314 T319 Y320 F321R313-N317 PolarHBondContact O-N 3.24Å; R313-N317 VanDerWaalsContact O-N 3.07Å; I314-N317 CarbonylContact O-C 3.6Å; I314-N317 PolarHBondContact O-N 3.43Å; N317-T319 PolarHBondContact O-N 3.3Å; N317-Y320 WeakPolarHBondContact O-CB 3.47Å; N317-Y320 PolarHBondContact O-N 3.21Å; N317-F321 HydrophobicContact CB-CD2 4.44Å; N317-F321 HydrophobicContact CB-CE2 4.15Å; N317-F321 WeakPolarHBondContact O-CD2 3.41Å; N317-F321 PolarHBondContact O-N 2.64Å
318W87Confident86.7Confident1 Ų127.4 Ų27.40%0.00415%0.152CC..Hα-helixtrans-54.1-34.1-168.273.9-84.9000114.3F284 F288 I314 Y320 F321 L322 F378 L381 R382 L385F284-W318 HydrophobicContact CE2-CZ3 4.29Å; F284-W318 HydrophobicContact CZ-CZ3 4.47Å; F288-W318 HydrophobicContact CE2-CB 4.35Å; I314-W318 WeakPolarHBondContact O-CA 3.47Å; I314-W318 VanDerWaalsContact O-CB 3.26Å; I314-W318 WeakPolarHBondContact O-CB 3.41Å; I314-W318 PolarHBondContact O-N 3.16Å; W318-Y320 VanDerWaalsContact C-N 3.33Å; W318-Y320 PolarHBondContact O-N 3.49Å; W318-F321 PolarHBondContact O-N 3.18Å; W318-L322 HydrophobicContact CZ3-CD2 4.03Å; W318-L322 PolarHBondContact O-N 2.97Å; W318-F378 HydrophobicContact CH2-CB 4.14Å; W318-F378 AromaticContact CH2-CD1 3.55Å; W318-F378 HydrophobicContact CH2-CD1 3.55Å; W318-F378 HydrophobicContact CH2-CE1 4.49Å; W318-F378 HydrophobicContact CH2-CG 4.33Å; W318-F378 WeakPolarHBondContact CH2-O 3.34Å; W318-F378 HydrophobicContact CZ2-CB 3.89Å; W318-F378 AromaticContact CZ2-CD1 3.94Å; W318-F378 HydrophobicContact CZ2-CD1 3.94Å; W318-F378 HydrophobicContact CZ2-CG 4.38Å; W318-F378 WeakPolarHBondContact CZ2-O 3.44Å; W318-F378 HydrophobicContact CZ3-CD1 4.44Å; W318-L381 HydrophobicContact CH2-CB 3.56Å; W318-L381 HydrophobicContact CH2-CD1 4.3Å; W318-L381 HydrophobicContact CZ3-CB 3.92Å; W318-R382 HydrophobicContact CZ2-CB 3.87Å; W318-L385 HydrophobicContact CB-CD1 4.27Å; W318-L385 HydrophobicContact CE3-CD1 4.29Å
319T88.4Confident87Confident0 Ų019.9 Ų19.90%012%0.118CC..Hα-helixtrans-67.9-32.3178.548.70000113.3S3 C6 F7 N317 L322 G323 F378S3-T319 PolarHBondContact O-OG1 3.41Å; S3-T319 WeakPolarHBondContact OG-CG2 3.36Å; C6-T319 WeakPolarHBondContact CB-OG1 3.04Å; F7-T319 WeakPolarHBondContact CA-O 3.19Å; N317-T319 PolarHBondContact O-N 3.3Å; T319-L322 PolarHBondContact O-N 2.75Å; T319-G323 PolarHBondContact O-N 2.85Å; T319-F378 HydrophobicContact CG2-CD1 3.87Å; T319-F378 HydrophobicContact CG2-CE1 4.21Å
320Y87.1Confident87.2Confident3 Ų321 Ų211%0.01212%0.12CC..Hα-helixtrans-67.1-43.5173.9168.2-86.6000110.8C6 L9 G10 E13 F295 N317 W318 L322 G323 Y324 W362 F365C6-Y320 WeakPolarHBondContact O-CA 3.43Å; L9-Y320 HydrophobicContact CB-CD2 4.46Å; G10-Y320 VanDerWaalsContact CA-CD2 3.48Å; E13-Y320 HydrophobicContact CG-CE2 4.34Å; E13-Y320 WeakPolarHBondContact OE2-CE2 3.34Å; E13-Y320 PolarHBondContact OE2-OH 2.88Å; F295-Y320 HydrophobicContact CD2-CE1 4.46Å; F295-Y320 AromaticContact CE1-CE1 3.98Å; F295-Y320 HydrophobicContact CE1-CE1 3.98Å; F295-Y320 HydrophobicContact CE2-CD1 4.46Å; F295-Y320 AromaticContact CE2-CE1 3.59Å; F295-Y320 HydrophobicContact CE2-CE1 3.59Å; F295-Y320 AromaticContact CZ-CE1 3.34Å; F295-Y320 HydrophobicContact CZ-CE1 3.34Å; F295-Y320 AromaticContact CZ-CZ 3.7Å; F295-Y320 WeakPolarHBondContact CZ-OH 3.34Å; N317-Y320 WeakPolarHBondContact O-CB 3.47Å; N317-Y320 PolarHBondContact O-N 3.21Å; W318-Y320 VanDerWaalsContact C-N 3.33Å; W318-Y320 PolarHBondContact O-N 3.49Å; Y320-L322 VanDerWaalsContact C-N 3.33Å; Y320-L322 PolarHBondContact O-N 3.02Å; Y320-G323 PolarHBondContact O-N 3.18Å; Y320-Y324 WeakPolarHBondContact O-CB 3.37Å; Y320-Y324 PolarHBondContact O-N 2.81Å; Y320-W362 AromaticContact CD1-NE1 3.67Å; Y320-W362 AromaticContact CE1-CD1 3.29Å; Y320-W362 AromaticContact CE1-NE1 3.36Å; Y320-W362 AromaticContact CZ-CD1 3.57Å; Y320-F365 HydrophobicContact CE2-CE2 4.5Å
321F89Confident87.3Confident0 Ų021.7 Ų21.70%013%0.126CC..Hα-helixtrans-60-46174.6-72.6-96.4000111F288 A291 F295 F310 I314 N317 W318 G323 Y324 G325 W362F288-F321 HydrophobicContact CD2-CB 4.13Å; F288-F321 HydrophobicContact CE2-CB 3.86Å; A291-F321 HydrophobicContact CB-CB 4.12Å; A291-F321 HydrophobicContact CB-CD1 4.32Å; A291-F321 WeakPolarHBondContact CB-O 3.49Å; F295-F321 HydrophobicContact CB-CD1 4.38Å; F295-F321 HydrophobicContact CB-CE1 3.55Å; F295-F321 HydrophobicContact CB-CZ 4.28Å; F295-F321 AromaticContact CD2-CD1 3.66Å; F295-F321 HydrophobicContact CD2-CD1 3.66Å; F295-F321 AromaticContact CD2-CE1 3.57Å; F295-F321 HydrophobicContact CD2-CE1 3.57Å; F295-F321 HydrophobicContact CD2-CZ 4.43Å; F295-F321 HydrophobicContact CE2-CD1 4.45Å; F295-F321 HydrophobicContact CG-CD1 4.31Å; F295-F321 AromaticContact CG-CE1 3.74Å; F295-F321 HydrophobicContact CG-CE1 3.74Å; F295-F321 HydrophobicContact CG-CZ 4.38Å; F310-F321 HydrophobicContact CE2-CE1 4.46Å; I314-F321 HydrophobicContact CB-CE2 4.46Å; I314-F321 HydrophobicContact CB-CZ 4.48Å; I314-F321 HydrophobicContact CG1-CE1 3.9Å; I314-F321 HydrophobicContact CG1-CE2 4.19Å; I314-F321 HydrophobicContact CG1-CZ 3.74Å; N317-F321 HydrophobicContact CB-CD2 4.44Å; N317-F321 HydrophobicContact CB-CE2 4.15Å; N317-F321 WeakPolarHBondContact O-CD2 3.41Å; N317-F321 PolarHBondContact O-N 2.64Å; W318-F321 PolarHBondContact O-N 3.18Å; F321-G323 PolarHBondContact O-N 3.19Å; F321-Y324 PolarHBondContact O-N 3.07Å; F321-G325 PolarHBondContact O-N 3.27Å; F321-W362 HydrophobicContact CE2-CZ2 4.02Å; F321-W362 HydrophobicContact CZ-CH2 4.48Å; F321-W362 AromaticContact CZ-CZ2 3.77Å; F321-W362 HydrophobicContact CZ-CZ2 3.77Å
322L89.8Confident87Confident11 Ų1121.3 Ų21.36%0.05813%0.125CC..Hα-helixtrans-59.5-47177.4-176.265.6000112.1F7 F284 A287 W318 T319 Y320 Y324 G325 L326F7-L322 HydrophobicContact CD2-CD2 4.41Å; F7-L322 HydrophobicContact CD2-CG 4.47Å; F7-L322 HydrophobicContact CE2-CD2 4.26Å; F7-L322 HydrophobicContact CE2-CG 4.18Å; F284-L322 HydrophobicContact CD2-CD1 3.37Å; F284-L322 HydrophobicContact CD2-CD2 3.96Å; F284-L322 HydrophobicContact CD2-CG 4.3Å; F284-L322 HydrophobicContact CE2-CD1 3.49Å; F284-L322 VanDerWaalsContact CE2-CD1 3.49Å; F284-L322 HydrophobicContact CE2-CD2 3.59Å; F284-L322 HydrophobicContact CE2-CG 4.12Å; F284-L322 HydrophobicContact CG-CD1 4.17Å; F284-L322 HydrophobicContact CZ-CD1 4.33Å; A287-L322 HydrophobicContact CB-CD1 4.23Å; W318-L322 HydrophobicContact CZ3-CD2 4.03Å; W318-L322 PolarHBondContact O-N 2.97Å; T319-L322 PolarHBondContact O-N 2.75Å; Y320-L322 VanDerWaalsContact C-N 3.33Å; Y320-L322 PolarHBondContact O-N 3.02Å; L322-Y324 VanDerWaalsContact C-N 3.31Å; L322-Y324 PolarHBondContact O-N 2.85Å; L322-G325 PolarHBondContact O-N 2.84Å; L322-L326 WeakPolarHBondContact O-CB 3.27Å; L322-L326 PolarHBondContact O-N 3.49Å
323G89.3Confident87Confident0 Ų023 Ų230%013%0.125CC..Hα-helixtrans-62.8-37.1178.100000112.9F11 T319 Y320 F321F11-G323 WeakPolarHBondContact CA-O 3.49Å; F11-G323 PolarHBondContact N-O 2.77Å; T319-G323 PolarHBondContact O-N 2.85Å; Y320-G323 PolarHBondContact O-N 3.18Å; F321-G323 PolarHBondContact O-N 3.19Å
324Y90.2Very high87Confident0 Ų024.4 Ų24.40%014%0.138CC..Hα-helixtrans-67.3-40.2178.9-169-109.1000112.9G10 E13 F14 T17 A291 A294 F295 Y320 F321 L322 L353 G356 A357G10-Y324 WeakPolarHBondContact O-CA 3.37Å; G10-Y324 WeakPolarHBondContact O-CD2 3.36Å; E13-Y324 HydrophobicContact CB-CD2 4.13Å; E13-Y324 HydrophobicContact CB-CE2 4.18Å; F14-Y324 HydrophobicContact CB-CD2 4.01Å; F14-Y324 HydrophobicContact CB-CE2 4.12Å; F14-Y324 VanDerWaalsContact CD2-O 3.24Å; F14-Y324 WeakPolarHBondContact CD2-O 3.31Å; T17-Y324 PolarHBondContact OG1-OH 2.88Å; A291-Y324 HydrophobicContact CB-CD1 4.22Å; A294-Y324 HydrophobicContact CB-CE1 4.47Å; F295-Y324 HydrophobicContact CD2-CD1 4.22Å; F295-Y324 AromaticContact CE2-CD1 3.34Å; F295-Y324 HydrophobicContact CE2-CD1 3.34Å; F295-Y324 HydrophobicContact CE2-CD2 4.38Å; F295-Y324 AromaticContact CE2-CE1 3.74Å; F295-Y324 HydrophobicContact CE2-CE1 3.74Å; F295-Y324 AromaticContact CE2-CG 3.7Å; F295-Y324 HydrophobicContact CE2-CG 3.7Å; F295-Y324 AromaticContact CZ-CD1 3.95Å; F295-Y324 HydrophobicContact CZ-CD1 3.95Å; F295-Y324 HydrophobicContact CZ-CD2 4.35Å; F295-Y324 HydrophobicContact CZ-CE1 4.03Å; F295-Y324 HydrophobicContact CZ-CG 4.12Å; Y320-Y324 WeakPolarHBondContact O-CB 3.37Å; Y320-Y324 PolarHBondContact O-N 2.81Å; F321-Y324 PolarHBondContact O-N 3.07Å; L322-Y324 VanDerWaalsContact C-N 3.31Å; L322-Y324 PolarHBondContact O-N 2.85Å; Y324-L353 HydrophobicContact CD1-CD1 4.14Å; Y324-L353 HydrophobicContact CD1-CD2 3.81Å; Y324-L353 HydrophobicContact CD1-CG 3.97Å; Y324-L353 HydrophobicContact CE1-CD1 4.07Å; Y324-L353 HydrophobicContact CE1-CD2 3.3Å; Y324-L353 HydrophobicContact CE1-CG 3.4Å; Y324-L353 PolarHBondContact OH-O 3.04Å; Y324-G356 WeakPolarHBondContact OH-CA 3.45Å; Y324-A357 HydrophobicContact CE1-CB 4.08Å; Y324-A357 PolarHBondContact OH-N 2.94Å
325G90.8Very high86.7Confident0 Ų028.4 Ų28.40%016%0.155CC..Hα-helixtrans-88-10.5178.900000115.2A287 F321 L322 P327 L328 G329A287-G325 WeakPolarHBondContact CA-O 3.42Å; A287-G325 VanDerWaalsContact CB-C 3.48Å; A287-G325 WeakPolarHBondContact CB-O 3.39Å; A287-G325 WeakPolarHBondContact O-CA 3.32Å; F321-G325 PolarHBondContact O-N 3.27Å; L322-G325 PolarHBondContact O-N 2.84Å; G325-P327 VanDerWaalsContact C-CD 3.42Å; G325-P327 VanDerWaalsContact C-N 3.32Å; G325-P327 VanDerWaalsContact O-N 3.15Å; G325-L328 PolarHBondContact O-N 3.39Å; G325-L328 VanDerWaalsContact O-N 3.08Å; G325-G329 PolarHBondContact O-N 3.39Å
326L90.6Very high85.9Confident50 Ų5030.6 Ų30.626%0.26217%0.17SC..Hα-helixtrans-47.8-44.7-174.1-17092.7000113.4F7 F11 L322 L328 G329 C330F7-L326 HydrophobicContact CE2-CD1 4.02Å; F7-L326 HydrophobicContact CZ-CD1 3.87Å; F7-L326 HydrophobicContact CZ-CD2 3.92Å; F7-L326 HydrophobicContact CZ-CG 4.37Å; F11-L326 HydrophobicContact CD2-CD2 4.08Å; F11-L326 HydrophobicContact CE2-CD2 4.13Å; L322-L326 WeakPolarHBondContact O-CB 3.27Å; L322-L326 PolarHBondContact O-N 3.49Å; L326-L328 VanDerWaalsContact C-N 3.31Å; L326-L328 PolarHBondContact O-N 2.69Å; L326-G329 CarbonylContact O-C 3.57Å; L326-G329 WeakPolarHBondContact O-CA 3.45Å; L326-G329 PolarHBondContact O-N 2.94Å; L326-C330 PolarHBondContact O-N 3.28Å; L326-C330 PolarHBondContact O-SG 2.84Å
327P88.8Confident85.2Confident32 Ų3232.7 Ų32.721%0.20818%0.176CC..Hα-helixtrans-63.7-33.9-176.4-29.243.6000113.9F11 F14 G325 A331F11-P327 HydrophobicContact CD2-CG 4.11Å; F11-P327 HydrophobicContact CE2-CG 3.83Å; F14-P327 HydrophobicContact CD1-CB 4.02Å; F14-P327 HydrophobicContact CD1-CG 3.44Å; F14-P327 VanDerWaalsContact CD1-CG 3.44Å; F14-P327 HydrophobicContact CD2-CG 4.34Å; F14-P327 HydrophobicContact CE1-CB 3.49Å; F14-P327 VanDerWaalsContact CE1-CB 3.49Å; F14-P327 HydrophobicContact CE1-CG 3.48Å; F14-P327 VanDerWaalsContact CE1-CG 3.48Å; F14-P327 HydrophobicContact CE2-CB 4.27Å; F14-P327 HydrophobicContact CE2-CG 4.38Å; F14-P327 HydrophobicContact CG-CG 3.89Å; F14-P327 HydrophobicContact CZ-CB 3.63Å; F14-P327 HydrophobicContact CZ-CG 3.97Å; G325-P327 VanDerWaalsContact C-CD 3.42Å; G325-P327 VanDerWaalsContact C-N 3.32Å; G325-P327 VanDerWaalsContact O-N 3.15Å; P327-A331 WeakPolarHBondContact O-CB 3.42Å; P327-A331 PolarHBondContact O-N 2.72Å
328L86.1Confident84.3Confident5 Ų534 Ų343%0.02618%0.181CC..Hα-helixtrans-73.8-34.9173.3-75.5143.8000111.7F14 Y290 G325 L326 A331 S332 L346 L353F14-L328 HydrophobicContact CE2-CD1 4.46Å; Y290-L328 HydrophobicContact CD2-CB 4.28Å; G325-L328 PolarHBondContact O-N 3.39Å; G325-L328 VanDerWaalsContact O-N 3.08Å; L326-L328 VanDerWaalsContact C-N 3.31Å; L326-L328 PolarHBondContact O-N 2.69Å; L328-A331 PolarHBondContact O-N 3.47Å; L328-S332 PolarHBondContact O-N 2.8Å; L328-L346 HydrophobicContact CB-CD2 4.08Å; L328-L346 HydrophobicContact CD2-CD2 3.46Å; L328-L346 VanDerWaalsContact CD2-CD2 3.46Å; L328-L346 HydrophobicContact CG-CD2 4.38Å; L328-L353 HydrophobicContact CD1-CB 4.15Å; L328-L353 HydrophobicContact CD1-CD1 3.15Å; L328-L353 HydrophobicContact CD1-CG 4.19Å
329G87Confident83.3Confident2 Ų237.2 Ų37.22%0.02120%0.198CC..Hα-helixtrans-64.7-41.9171.100000112.5A283 G325 L326 A331 S332 I333A283-G329 WeakPolarHBondContact CB-O 3.49Å; A283-G329 WeakPolarHBondContact O-CA 3.47Å; G325-G329 PolarHBondContact O-N 3.39Å; L326-G329 CarbonylContact O-C 3.57Å; L326-G329 WeakPolarHBondContact O-CA 3.45Å; L326-G329 PolarHBondContact O-N 2.94Å; G329-A331 VanDerWaalsContact C-N 3.33Å; G329-S332 PolarHBondContact O-N 2.8Å; G329-S332 PolarHBondContact O-OG 3.43Å; G329-I333 PolarHBondContact O-N 2.93Å
330C87.5Confident82.4Confident54 Ų5438.6 Ų38.637%0.36521%0.212SC..Hα-helixtrans-65.1-39.5173.6-68.70000111.3L326 S332 I333 I334L326-C330 PolarHBondContact O-N 3.28Å; L326-C330 PolarHBondContact O-SG 2.84Å; C330-S332 PolarHBondContact O-N 2.83Å; C330-I333 WeakPolarHBondContact O-CB 3.41Å; C330-I333 PolarHBondContact O-N 3.37Å; C330-I333 VanDerWaalsContact O-N 3.09Å; C330-I334 WeakPolarHBondContact O-CG1 2.96Å; C330-I334 PolarHBondContact O-N 2.84Å; C330-I334 VanDerWaalsContact O-N 3.16Å
331A85.4Confident81.7Confident16 Ų1647.7 Ų47.713%0.13225%0.246CC..Hα-helixtrans-60.3-33.8174.600000112.3P327 L328 G329 I333 I334 F335 I345P327-A331 WeakPolarHBondContact O-CB 3.42Å; P327-A331 PolarHBondContact O-N 2.72Å; L328-A331 PolarHBondContact O-N 3.47Å; G329-A331 VanDerWaalsContact C-N 3.33Å; A331-I333 VanDerWaalsContact C-N 3.31Å; A331-I333 PolarHBondContact O-N 2.94Å; A331-I334 PolarHBondContact O-N 2.89Å; A331-F335 WeakPolarHBondContact O-CD2 3.41Å; A331-F335 PolarHBondContact O-N 2.9Å; A331-I345 HydrophobicContact CB-CG2 4.02Å
332S81.6Confident81.1Confident11 Ų1147.9 Ų47.98%0.07725%0.248CC..Hα-helixtrans-72.8-21176.475.70000113.8L328 G329 C330 F335 P336L328-S332 PolarHBondContact O-N 2.8Å; G329-S332 PolarHBondContact O-N 2.8Å; G329-S332 PolarHBondContact O-OG 3.43Å; C330-S332 PolarHBondContact O-N 2.83Å; S332-F335 CarbonylContact O-C 3.58Å; S332-P336 WeakPolarHBondContact O-CA 3.31Å
333I84.1Confident80.3Confident68 Ų6847.4 Ų47.435%0.34925%0.246SC..Hα-helixtrans-74.5-46.3169.7-58.1176.8000110.2A283 G329 C330 A331 F335A283-I333 HydrophobicContact CB-CD1 3.49Å; A283-I333 VanDerWaalsContact CB-CD1 3.49Å; A283-I333 HydrophobicContact CB-CG1 3.44Å; A283-I333 VanDerWaalsContact CB-CG1 3.44Å; G329-I333 PolarHBondContact O-N 2.93Å; C330-I333 WeakPolarHBondContact O-CB 3.41Å; C330-I333 PolarHBondContact O-N 3.37Å; C330-I333 VanDerWaalsContact O-N 3.09Å; A331-I333 VanDerWaalsContact C-N 3.31Å; A331-I333 PolarHBondContact O-N 2.94Å; I333-F335 VanDerWaalsContact C-N 3.34Å
334I84Confident79.8Confident117 Ų11749.1 Ų49.160%0.626%0.256SS*.Hα-helixtrans-68.2-38.6-177.1-60.4167.2000110.4C330 A331 P336C330-I334 WeakPolarHBondContact O-CG1 2.96Å; C330-I334 PolarHBondContact O-N 2.84Å; C330-I334 VanDerWaalsContact O-N 3.16Å; A331-I334 PolarHBondContact O-N 2.89Å; I334-P336 WeakPolarHBondContact O-CD 3.23Å
335F80.3Confident79.3Confident87 Ų8751.6 Ų51.638%0.38227%0.269SS..  trans-121.478.2-179-54.6-76.4000110.1A331 S332 I333 H337 W341 I345A331-F335 WeakPolarHBondContact O-CD2 3.41Å; A331-F335 PolarHBondContact O-N 2.9Å; S332-F335 CarbonylContact O-C 3.58Å; I333-F335 VanDerWaalsContact C-N 3.34Å; F335-H337 PolarHBondContact O-N 3.29Å; F335-W341 HydrophobicContact CD1-CB 4.31Å; F335-I345 HydrophobicContact CD1-CD1 4.4Å; F335-I345 HydrophobicContact CD2-CD1 3.31Å; F335-I345 HydrophobicContact CE1-CD1 4.4Å; F335-I345 HydrophobicContact CE2-CD1 3.31Å; F335-I345 HydrophobicContact CG-CD1 3.88Å; F335-I345 HydrophobicContact CZ-CD1 3.89Å
336P70.1Confident78.8Confident73 Ų7352.2 Ų52.247%0.47427%0.272SS..  trans-69-18.4-174.626.1-33.4000113.2S332 I334 F338S332-P336 WeakPolarHBondContact O-CA 3.31Å; I334-P336 WeakPolarHBondContact O-CD 3.23Å; P336-F338 PolarHBondContact O-N 3.18Å
337H68.4Low78.2Confident138 Ų13849.9 Ų49.964%0.63926%0.26SS*.  trans-82104.7-178.6-65.773000110.3F335 I339 G342F335-H337 PolarHBondContact O-N 3.29Å; H337-I339 VanDerWaalsContact C-N 3.32Å; H337-G342 WeakPolarHBondContact O-CA 3.45Å; H337-G342 PolarHBondContact O-N 3.33Å
338F65.4Low77.7Confident45 Ų4552.1 Ų52.120%0.19727%0.27CS..THydrogen-bonded Turntrans-65.3-38.8173-166.8-107.2000111.4H179 L182 P336 G340 G343 L346H179-F338 AromaticContact CD2-CD1 3.74Å; L182-F338 HydrophobicContact CD1-CE1 3.87Å; L182-F338 HydrophobicContact CD2-CE1 3.7Å; L182-F338 HydrophobicContact CD2-CZ 3.89Å; L182-F338 HydrophobicContact CG-CE1 4.26Å; P336-F338 PolarHBondContact O-N 3.18Å; F338-G340 VanDerWaalsContact C-N 3.29Å; F338-G340 PolarHBondContact O-N 2.99Å; F338-G343 WeakPolarHBondContact O-CA 3.48Å; F338-G343 PolarHBondContact O-N 3.07Å; F338-L346 HydrophobicContact CD2-CD1 3.95Å; F338-L346 HydrophobicContact CE2-CD1 3.88Å
339I65Low77.4Confident70 Ų7052.6 Ų52.636%0.35928%0.276SS..THydrogen-bonded Turntrans-79.280.3170.6-54.9171.3000107.7A142 H337A142-I339 HydrophobicContact CB-CG2 3.6Å; H337-I339 VanDerWaalsContact C-N 3.32Å
340G69.1Low77.1Confident28 Ų2853 Ų5329%0.28928%0.276SS..THydrogen-bonded Turntrans151.5-148.5-17900000113.3F338 G342 G343 V344F338-G340 VanDerWaalsContact C-N 3.29Å; F338-G340 PolarHBondContact O-N 2.99Å; G340-G342 PolarHBondContact O-N 3.47Å; G340-G343 PolarHBondContact O-N 2.85Å; G340-G343 VanDerWaalsContact O-N 3.16Å; G340-V344 PolarHBondContact O-N 2.67Å; G340-V344 VanDerWaalsContact O-N 3.15Å
341W73.5Confident76.7Confident195 Ų19550.5 Ų50.574%0.73926%0.26SS*.Hα-helixtrans-57.3-33.7-178.2-71.6104.2000113.7F335 V344 I345F335-W341 HydrophobicContact CD1-CB 4.31Å; W341-V344 PolarHBondContact O-N 2.96Å; W341-I345 WeakPolarHBondContact O-CG1 3.29Å; W341-I345 PolarHBondContact O-N 2.83Å
342G76.8Confident76.5Confident4 Ų451.3 Ų51.34%0.04126%0.263CS..Hα-helixtrans-62.2-48176.700000111.7H337 G340 V344 I345 L346H337-G342 WeakPolarHBondContact O-CA 3.45Å; H337-G342 PolarHBondContact O-N 3.33Å; G340-G342 PolarHBondContact O-N 3.47Å; G342-V344 VanDerWaalsContact C-N 3.33Å; G342-V344 PolarHBondContact O-N 3.17Å; G342-I345 PolarHBondContact O-N 2.62Å; G342-L346 VanDerWaalsContact O-CG 3.28Å; G342-L346 WeakPolarHBondContact O-CG 3.47Å; G342-L346 PolarHBondContact O-N 2.89Å
343G73.4Confident76.7Confident0 Ų050.8 Ų50.80%026%0.259CS..Hα-helixtrans-58.9-42.4173.600000112.5I138 F338 G340 L346 A347I138-G343 WeakPolarHBondContact CD1-O 3.46Å; F338-G343 WeakPolarHBondContact O-CA 3.48Å; F338-G343 PolarHBondContact O-N 3.07Å; G340-G343 PolarHBondContact O-N 2.85Å; G340-G343 VanDerWaalsContact O-N 3.16Å; G343-L346 PolarHBondContact O-N 3.39Å; G343-A347 VanDerWaalsContact O-CB 3.25Å; G343-A347 WeakPolarHBondContact O-CB 3.39Å; G343-A347 PolarHBondContact O-N 2.87Å
344V77.6Confident76.6Confident36 Ų3647.6 Ų47.622%0.21824%0.243CC..Hα-helixtrans-63.9-43178.7177.20000111.9V135 G340 W341 G342 A347 I348V135-V344 HydrophobicContact CG2-CG1 4.38Å; G340-V344 PolarHBondContact O-N 2.67Å; G340-V344 VanDerWaalsContact O-N 3.15Å; W341-V344 PolarHBondContact O-N 2.96Å; G342-V344 VanDerWaalsContact C-N 3.33Å; G342-V344 PolarHBondContact O-N 3.17Å; V344-A347 WeakPolarHBondContact O-CB 3.43Å; V344-A347 PolarHBondContact O-N 3.41Å; V344-I348 HydrophobicContact CG1-CD1 4.01Å; V344-I348 WeakPolarHBondContact O-CG1 3.42Å; V344-I348 PolarHBondContact O-N 2.84Å
345I80.6Confident76.3Confident53 Ų5342.1 Ų42.127%0.27222%0.215SC..Hα-helixtrans-65.3-43177.7-69.6164.9000110.5A331 F335 W341 G342 A347 I348 G349A331-I345 HydrophobicContact CB-CG2 4.02Å; F335-I345 HydrophobicContact CD1-CD1 4.4Å; F335-I345 HydrophobicContact CD2-CD1 3.31Å; F335-I345 HydrophobicContact CE1-CD1 4.4Å; F335-I345 HydrophobicContact CE2-CD1 3.31Å; F335-I345 HydrophobicContact CG-CD1 3.88Å; F335-I345 HydrophobicContact CZ-CD1 3.89Å; W341-I345 WeakPolarHBondContact O-CG1 3.29Å; W341-I345 PolarHBondContact O-N 2.83Å; G342-I345 PolarHBondContact O-N 2.62Å; I345-A347 VanDerWaalsContact C-N 3.32Å; I345-A347 PolarHBondContact O-N 3.45Å; I345-I348 PolarHBondContact O-N 3.26Å; I345-G349 PolarHBondContact O-N 3.17Å
346L79.3Confident76.4Confident12 Ų1238 Ų386%0.06320%0.197CC..Hα-helixtrans-63.8-39.1175.2-66.2176.5000111.3V286 Y290 L328 F338 G342 G343 I348 G349 Y350V286-L346 HydrophobicContact CG1-CD2 4.4Å; Y290-L346 HydrophobicContact CD2-CD2 4.35Å; Y290-L346 HydrophobicContact CE2-CD1 4.2Å; Y290-L346 HydrophobicContact CE2-CD2 3.67Å; Y290-L346 HydrophobicContact CE2-CG 4.33Å; L328-L346 HydrophobicContact CB-CD2 4.08Å; L328-L346 HydrophobicContact CD2-CD2 3.46Å; L328-L346 VanDerWaalsContact CD2-CD2 3.46Å; L328-L346 HydrophobicContact CG-CD2 4.38Å; F338-L346 HydrophobicContact CD2-CD1 3.95Å; F338-L346 HydrophobicContact CE2-CD1 3.88Å; G342-L346 VanDerWaalsContact O-CG 3.28Å; G342-L346 WeakPolarHBondContact O-CG 3.47Å; G342-L346 PolarHBondContact O-N 2.89Å; G343-L346 PolarHBondContact O-N 3.39Å; L346-I348 VanDerWaalsContact C-N 3.29Å; L346-I348 PolarHBondContact O-N 3.29Å; L346-G349 PolarHBondContact O-N 2.84Å; L346-Y350 VanDerWaalsContact O-CB 3.24Å; L346-Y350 WeakPolarHBondContact O-CB 3.18Å; L346-Y350 PolarHBondContact O-N 3.27Å
347A77.9Confident77Confident1 Ų134.6 Ų34.61%0.00818%0.175CC..Hα-helixtrans-62-34.1175.800000113.3N134 V135 I138 M186 G343 V344 I345 P351N134-A347 HydrophobicContact CB-CB 4.24Å; V135-A347 HydrophobicContact CG2-CB 4.23Å; I138-A347 HydrophobicContact CD1-CB 3.71Å; M186-A347 HydrophobicContact CE-CB 3.45Å; M186-A347 VanDerWaalsContact CE-CB 3.45Å; G343-A347 VanDerWaalsContact O-CB 3.25Å; G343-A347 WeakPolarHBondContact O-CB 3.39Å; G343-A347 PolarHBondContact O-N 2.87Å; V344-A347 WeakPolarHBondContact O-CB 3.43Å; V344-A347 PolarHBondContact O-N 3.41Å; I345-A347 VanDerWaalsContact C-N 3.32Å; I345-A347 PolarHBondContact O-N 3.45Å; A347-P351 WeakPolarHBondContact O-CD 3.32Å; A347-P351 VanDerWaalsContact O-CG 3.32Å; A347-P351 WeakPolarHBondContact O-CG 3.33Å
348I77.8Confident77.4Confident80 Ų8028.9 Ų28.941%0.4115%0.149SC..Hα-helixtrans-79.1-48.8175.2-68.3163.3000110.7W131 V344 I345 L346 Y350 P351 V352W131-I348 VanDerWaalsContact CD1-CG1 3.45Å; V344-I348 HydrophobicContact CG1-CD1 4.01Å; V344-I348 WeakPolarHBondContact O-CG1 3.42Å; V344-I348 PolarHBondContact O-N 2.84Å; I345-I348 PolarHBondContact O-N 3.26Å; L346-I348 VanDerWaalsContact C-N 3.29Å; L346-I348 PolarHBondContact O-N 3.29Å; I348-Y350 VanDerWaalsContact C-N 3.34Å; I348-Y350 PolarHBondContact O-N 2.86Å; I348-P351 WeakPolarHBondContact O-CD 3.29Å; I348-V352 WeakPolarHBondContact O-CG2 3.19Å
349G81.1Confident77.8Confident15 Ų1527.7 Ų27.716%0.15515%0.15CC..Hα-helixtrans-71-30.5-171.500000112.6I345 L346 V352 L353I345-G349 PolarHBondContact O-N 3.17Å; L346-G349 PolarHBondContact O-N 2.84Å; G349-V352 PolarHBondContact O-N 3.2Å; G349-L353 VanDerWaalsContact O-CB 3.26Å; G349-L353 WeakPolarHBondContact O-CB 3.47Å; G349-L353 PolarHBondContact O-N 3.42Å
350Y79.9Confident78.2Confident9 Ų924.6 Ų24.64%0.03513%0.134CC..Hα-helixtrans-64.9-55.9-179.1175.6-102.1000114N190 Y290 Y297 L346 I348 V352 L353 V354N190-Y350 HydrophobicContact CB-CE1 3.82Å; N190-Y350 WeakPolarHBondContact ND2-CD1 3.3Å; N190-Y350 WeakPolarHBondContact ND2-CE1 3.38Å; Y290-Y350 AromaticContact CD1-CD2 3.22Å; Y290-Y350 HydrophobicContact CD1-CD2 3.22Å; Y290-Y350 AromaticContact CD1-CE2 3.74Å; Y290-Y350 HydrophobicContact CD1-CE2 3.74Å; Y290-Y350 HydrophobicContact CD1-CG 4.05Å; Y290-Y350 AromaticContact CE1-CD2 3.64Å; Y290-Y350 HydrophobicContact CE1-CD2 3.64Å; Y290-Y350 HydrophobicContact CE1-CE2 4.26Å; Y290-Y350 HydrophobicContact CE1-CG 4.03Å; Y290-Y350 HydrophobicContact CG-CD2 4.28Å; Y297-Y350 VanDerWaalsContact CE2-OH 3.31Å; Y297-Y350 WeakPolarHBondContact CE2-OH 3.23Å; L346-Y350 VanDerWaalsContact O-CB 3.24Å; L346-Y350 WeakPolarHBondContact O-CB 3.18Å; L346-Y350 PolarHBondContact O-N 3.27Å; I348-Y350 VanDerWaalsContact C-N 3.34Å; I348-Y350 PolarHBondContact O-N 2.86Å; Y350-V352 PolarHBondContact O-N 2.82Å; Y350-L353 CarbonylContact O-C 3.53Å; Y350-L353 WeakPolarHBondContact O-CA 3.32Å; Y350-L353 WeakPolarHBondContact O-CB 3.39Å; Y350-L353 PolarHBondContact O-N 3.47Å; Y350-V354 HydrophobicContact CD1-CG2 4.14Å; Y350-V354 HydrophobicContact CD2-CG2 4.07Å; Y350-V354 HydrophobicContact CE1-CG2 3.63Å; Y350-V354 HydrophobicContact CE2-CG2 3.65Å; Y350-V354 HydrophobicContact CG-CG2 4.37Å; Y350-V354 VanDerWaalsContact CZ-CG2 3.44Å; Y350-V354 WeakPolarHBondContact O-CG2 3.35Å; Y350-V354 PolarHBondContact O-N 3.08Å
351P79.7Confident78.1Confident3 Ų332.7 Ų32.72%0.01916%0.156CC..Hα-helixtrans-53.6-40176.7-23.328.3000113.2L127 M130 A347 I348 V354 I355L127-P351 HydrophobicContact CD1-CB 3.39Å; M130-P351 HydrophobicContact CE-CB 3.7Å; M130-P351 HydrophobicContact CE-CG 3.74Å; M130-P351 HydrophobicContact CG-CG 4.42Å; M130-P351 HydrophobicContact SD-CB 3.87Å; M130-P351 HydrophobicContact SD-CG 4.11Å; A347-P351 WeakPolarHBondContact O-CD 3.32Å; A347-P351 VanDerWaalsContact O-CG 3.32Å; A347-P351 WeakPolarHBondContact O-CG 3.33Å; I348-P351 WeakPolarHBondContact O-CD 3.29Å; P351-V354 PolarHBondContact O-N 3.29Å; P351-I355 WeakPolarHBondContact O-CG1 3.29Å; P351-I355 PolarHBondContact O-N 3.46Å
352V82Confident77.3Confident33 Ų3324.4 Ų24.420%0.213%0.125CC..Hα-helixtrans-61.9-46.9176.2173.90000110.2T17 I348 G349 Y350 V354 I355 G356T17-V352 HydrophobicContact CG2-CG1 3.63Å; T17-V352 WeakPolarHBondContact CG2-O 3.29Å; I348-V352 WeakPolarHBondContact O-CG2 3.19Å; G349-V352 PolarHBondContact O-N 3.2Å; Y350-V352 PolarHBondContact O-N 2.82Å; V352-V354 PolarHBondContact O-N 3.11Å; V352-I355 PolarHBondContact O-N 3.08Å; V352-G356 PolarHBondContact O-N 2.9Å
353L84.6Confident76.4Confident0 Ų033 Ų330%016%0.156CC..Hα-helixtrans-63.1-40.8178.2-168154.2000111.4F14 Y290 A294 Y324 L328 G349 Y350 G356 A357F14-L353 HydrophobicContact CD2-CD1 3.96Å; F14-L353 HydrophobicContact CD2-CG 4.36Å; F14-L353 HydrophobicContact CE2-CD1 3.98Å; F14-L353 HydrophobicContact CE2-CG 4.45Å; Y290-L353 WeakPolarHBondContact O-CD2 3.15Å; A294-L353 HydrophobicContact CB-CD2 3.03Å; A294-L353 HydrophobicContact CB-CG 4.41Å; Y324-L353 HydrophobicContact CD1-CD1 4.14Å; Y324-L353 HydrophobicContact CD1-CD2 3.81Å; Y324-L353 HydrophobicContact CD1-CG 3.97Å; Y324-L353 HydrophobicContact CE1-CD1 4.07Å; Y324-L353 HydrophobicContact CE1-CD2 3.3Å; Y324-L353 HydrophobicContact CE1-CG 3.4Å; Y324-L353 PolarHBondContact OH-O 3.04Å; L328-L353 HydrophobicContact CD1-CB 4.15Å; L328-L353 HydrophobicContact CD1-CD1 3.15Å; L328-L353 HydrophobicContact CD1-CG 4.19Å; G349-L353 VanDerWaalsContact O-CB 3.26Å; G349-L353 WeakPolarHBondContact O-CB 3.47Å; G349-L353 PolarHBondContact O-N 3.42Å; Y350-L353 CarbonylContact O-C 3.53Å; Y350-L353 WeakPolarHBondContact O-CA 3.32Å; Y350-L353 WeakPolarHBondContact O-CB 3.39Å; Y350-L353 PolarHBondContact O-N 3.47Å; L353-G356 PolarHBondContact O-N 3.1Å; L353-A357 WeakPolarHBondContact O-CB 3.21Å; L353-A357 PolarHBondContact O-N 3.23Å
354V82.1Confident75.4Confident0 Ų036.4 Ų36.40%018%0.178CC..Hα-helixtrans-64.1-46.5175.9-168.40000111.7L194 A294 Y297 Y350 P351 V352 G356 A357 L358L194-V354 HydrophobicContact CD1-CB 3.9Å; L194-V354 HydrophobicContact CD1-CG1 3.63Å; L194-V354 HydrophobicContact CD1-CG2 4.08Å; L194-V354 HydrophobicContact CD2-CB 4.16Å; L194-V354 HydrophobicContact CD2-CG1 3.27Å; L194-V354 HydrophobicContact CG-CG1 4.06Å; A294-V354 HydrophobicContact CB-CB 4.32Å; A294-V354 HydrophobicContact CB-CG2 4.04Å; Y297-V354 HydrophobicContact CD1-CG1 4.49Å; Y297-V354 HydrophobicContact CD2-CG1 3.7Å; Y297-V354 HydrophobicContact CD2-CG2 4.42Å; Y297-V354 HydrophobicContact CE2-CG1 4.48Å; Y297-V354 HydrophobicContact CG-CG1 3.73Å; Y350-V354 HydrophobicContact CD1-CG2 4.14Å; Y350-V354 HydrophobicContact CD2-CG2 4.07Å; Y350-V354 HydrophobicContact CE1-CG2 3.63Å; Y350-V354 HydrophobicContact CE2-CG2 3.65Å; Y350-V354 HydrophobicContact CG-CG2 4.37Å; Y350-V354 VanDerWaalsContact CZ-CG2 3.44Å; Y350-V354 WeakPolarHBondContact O-CG2 3.35Å; Y350-V354 PolarHBondContact O-N 3.08Å; P351-V354 PolarHBondContact O-N 3.29Å; V352-V354 PolarHBondContact O-N 3.11Å; V354-G356 VanDerWaalsContact C-N 3.27Å; V354-G356 PolarHBondContact O-N 3.41Å; V354-A357 WeakPolarHBondContact O-CB 3.28Å; V354-A357 PolarHBondContact O-N 3.33Å; V354-A357 VanDerWaalsContact O-N 3.13Å; V354-L358 WeakPolarHBondContact O-CG 3.37Å; V354-L358 PolarHBondContact O-N 3.25Å
355I78.8Confident74Confident3 Ų338 Ų382%0.01518%0.182CC..Hα-helixtrans-65.8-35.2178.5-61.4162.3000111.1L21 M24 L123 L127 P351 V352 A357 L358 G359L21-I355 HydrophobicContact CD1-CB 3.99Å; L21-I355 HydrophobicContact CD1-CD1 3.84Å; L21-I355 HydrophobicContact CD1-CG1 4.49Å; L21-I355 HydrophobicContact CD1-CG2 3.37Å; M24-I355 HydrophobicContact SD-CG2 4.36Å; L123-I355 HydrophobicContact CD2-CD1 4.01Å; L123-I355 HydrophobicContact CD2-CG2 4.25Å; L127-I355 HydrophobicContact CD1-CD1 3.54Å; L127-I355 HydrophobicContact CD2-CD1 4.21Å; L127-I355 HydrophobicContact CG-CD1 4.39Å; P351-I355 WeakPolarHBondContact O-CG1 3.29Å; P351-I355 PolarHBondContact O-N 3.46Å; V352-I355 PolarHBondContact O-N 3.08Å; I355-A357 VanDerWaalsContact C-N 3.32Å; I355-A357 PolarHBondContact O-N 3.38Å; I355-L358 WeakPolarHBondContact O-CB 3.48Å; I355-L358 PolarHBondContact O-N 3.49Å; I355-G359 PolarHBondContact O-N 3.42Å
356G81.3Confident72.5Confident1 Ų143.1 Ų43.11%0.0121%0.21CC..Hα-helixtrans-58.7-43171.400000113Y324 V352 L353 V354 L358 G359 S360Y324-G356 WeakPolarHBondContact OH-CA 3.45Å; V352-G356 PolarHBondContact O-N 2.9Å; L353-G356 PolarHBondContact O-N 3.1Å; V354-G356 VanDerWaalsContact C-N 3.27Å; V354-G356 PolarHBondContact O-N 3.41Å; G356-L358 VanDerWaalsContact C-N 3.31Å; G356-L358 PolarHBondContact O-N 2.83Å; G356-G359 CarbonylContact O-C 3.59Å; G356-G359 PolarHBondContact O-N 3.03Å; G356-S360 PolarHBondContact O-N 2.69Å
357A83Confident71.3Confident0 Ų046.2 Ų46.20%023%0.229CC..Hα-helixtrans-67.7-31.5177.400000111.8A294 F295 R298 Y324 L353 V354 I355 S360A294-A357 HydrophobicContact CB-CB 3.8Å; F295-A357 HydrophobicContact CD1-CB 4.15Å; F295-A357 HydrophobicContact CE1-CB 3.99Å; F295-A357 HydrophobicContact CG-CB 4.45Å; F295-A357 HydrophobicContact CZ-CB 4.15Å; R298-A357 WeakPolarHBondContact CD-O 3.48Å; R298-A357 PolarHBondContact NH1-O 2.91Å; Y324-A357 HydrophobicContact CE1-CB 4.08Å; Y324-A357 PolarHBondContact OH-N 2.94Å; L353-A357 WeakPolarHBondContact O-CB 3.21Å; L353-A357 PolarHBondContact O-N 3.23Å; V354-A357 WeakPolarHBondContact O-CB 3.28Å; V354-A357 PolarHBondContact O-N 3.33Å; V354-A357 VanDerWaalsContact O-N 3.13Å; I355-A357 VanDerWaalsContact C-N 3.32Å; I355-A357 PolarHBondContact O-N 3.38Å; A357-S360 PolarHBondContact O-OG 2.78Å; A357-S360 VanDerWaalsContact O-OG 3.09Å
358L77.5Confident70.1Confident18 Ų1853.7 Ų53.79%0.09427%0.269CS..Hα-helixtrans-67.6-38.3170.9-62.6-177.5000112.1L194 I201 R298 V354 I355 G356L194-L358 HydrophobicContact CD2-CD1 4.05Å; I201-L358 HydrophobicContact CD1-CD1 3.76Å; R298-L358 HydrophobicContact CB-CD2 3.99Å; R298-L358 HydrophobicContact CG-CD2 4.44Å; R298-L358 PolarHBondContact NH1-O 3.12Å; V354-L358 WeakPolarHBondContact O-CG 3.37Å; V354-L358 PolarHBondContact O-N 3.25Å; I355-L358 WeakPolarHBondContact O-CB 3.48Å; I355-L358 PolarHBondContact O-N 3.49Å; G356-L358 VanDerWaalsContact C-N 3.31Å; G356-L358 PolarHBondContact O-N 2.83Å
359G73.3Confident69.2Low21 Ų2150.7 Ų50.722%0.21625%0.254CS..Hα-helixtrans-80.8-11.5178.800000115.2I355 G356I355-G359 PolarHBondContact O-N 3.42Å; G356-G359 CarbonylContact O-C 3.59Å; G356-G359 PolarHBondContact O-N 3.03Å
360S73.6Confident68.1Low5 Ų554.7 Ų54.74%0.03527%0.272CS..SBendtrans-67.5153.3-176.275.40000112E13 R20 R298 G356 A357 W362E13-S360 WeakPolarHBondContact OE2-CB 3.49Å; R20-S360 VanDerWaalsContact NH1-CA 3.29Å; R298-S360 PolarHBondContact NH1-O 3.18Å; R298-S360 PolarHBondContact NH1-OG 2.85Å; R298-S360 PolarHBondContact NH2-O 3.04Å; G356-S360 PolarHBondContact O-N 2.69Å; A357-S360 PolarHBondContact O-OG 2.78Å; A357-S360 VanDerWaalsContact O-OG 3.09Å; S360-W362 PolarHBondContact O-N 3.35Å
361R65.5Low67.3Low197 Ų19757.5 Ų57.574%0.74329%0.29SS*.  trans-90.359.2167.2-72.7-177179.2179.8-0.2107.2R363R361-R363 PolarHBondContact O-N 3.13Å
362W58.2Low66.4Low21 Ų2165.5 Ų65.58%0.0832%0.324CS..  trans-67.283.5166.7-155.671.3000107.6F295 R298 W299 R313 Y320 F321 S360F295-W362 HydrophobicContact CD1-CD2 4.35Å; F295-W362 HydrophobicContact CD1-CG 4.18Å; F295-W362 HydrophobicContact CE1-CB 4.09Å; F295-W362 AromaticContact CE1-CD1 3.78Å; F295-W362 AromaticContact CE1-CG 3.89Å; F295-W362 HydrophobicContact CE1-CG 3.89Å; R298-W362 VanDerWaalsContact CZ-CB 3.5Å; R298-W362 PolarHBondContact NH2-O 3.29Å; W299-W362 HydrophobicContact CE3-CZ3 4.03Å; W299-W362 HydrophobicContact CZ3-CZ3 4.21Å; R313-W362 HydrophobicContact CB-CH2 3.88Å; R313-W362 HydrophobicContact CB-CZ2 4.42Å; R313-W362 HydrophobicContact CG-CH2 4.34Å; Y320-W362 AromaticContact CD1-NE1 3.67Å; Y320-W362 AromaticContact CE1-CD1 3.29Å; Y320-W362 AromaticContact CE1-NE1 3.36Å; Y320-W362 AromaticContact CZ-CD1 3.57Å; F321-W362 HydrophobicContact CE2-CZ2 4.02Å; F321-W362 HydrophobicContact CZ-CH2 4.48Å; F321-W362 AromaticContact CZ-CZ2 3.77Å; F321-W362 HydrophobicContact CZ-CZ2 3.77Å; S360-W362 PolarHBondContact O-N 3.35Å
363R56.9Low65.6Low184 Ų18468.5 Ų68.569%0.69434%0.339SS*.  trans-83.6143.6156.3-69.9-172.2179.2177.7-1.5105.7R361 F365R361-R363 PolarHBondContact O-N 3.13Å; R363-F365 VanDerWaalsContact C-N 3.33Å; R363-F365 PolarHBondContact O-N 3.4Å
364P52.2Low65Low73 Ų7368.7 Ų68.747%0.47434%0.34SS..  trans-52.8110161.825-30.6000105.3D366P364-D366 PolarHBondContact O-N 2.84Å; P364-D366 VanDerWaalsContact O-N 3.07Å
365F49.7Very low64.8Low69 Ų6977 Ų7730%0.30337%0.372SS..  trans-68.7111.7173-72.1-76.6000104.3L9 Y320 R363 V367L9-F365 HydrophobicContact CD1-CZ 4.48Å; Y320-F365 HydrophobicContact CE2-CE2 4.5Å; R363-F365 VanDerWaalsContact C-N 3.33Å; R363-F365 PolarHBondContact O-N 3.4Å; F365-V367 HydrophobicContact CB-CB 4.22Å; F365-V367 HydrophobicContact CB-CG2 4.12Å; F365-V367 PolarHBondContact O-N 3.07Å
366D48.6Very low64.9Low160 Ų16085.4 Ų85.486%0.85641%0.408SS*.  trans-61.910.9165.7-72.7-35.1000112.2P364 N368P364-D366 PolarHBondContact O-N 2.84Å; P364-D366 VanDerWaalsContact O-N 3.07Å; D366-N368 PolarHBondContact O-N 2.87Å
367V53.5Low64.8Low77 Ų7791 Ų9147%0.46744%0.437SS..  trans-70.278.7164.9-171.50000106.3F365 I369F365-V367 HydrophobicContact CB-CB 4.22Å; F365-V367 HydrophobicContact CB-CG2 4.12Å; F365-V367 PolarHBondContact O-N 3.07Å; V367-I369 VanDerWaalsContact C-N 3.26Å; V367-I369 PolarHBondContact O-N 2.82Å
368N53.5Low64.7Low158 Ų15892.2 Ų92.285%0.84544%0.442SS*.  trans-56.497.8165.5-147.9-6.2000105.5D366 N370D366-N368 PolarHBondContact O-N 2.87Å; N368-N370 PolarHBondContact O-N 2.84Å
369I58.3Low65Low18 Ų1895.6 Ų95.69%0.09245%0.454CS..  trans-65.5105.6-178-60.7175.4000105C6 V367 V371 E374C6-I369 HydrophobicContact CB-CD1 4.24Å; V367-I369 VanDerWaalsContact C-N 3.26Å; V367-I369 PolarHBondContact O-N 2.82Å; I369-V371 PolarHBondContact O-N 3.28Å; I369-E374 HydrophobicContact CG2-CG 3.93Å
370N59.1Low65.5Low98 Ų9899.7 Ų99.752%0.52447%0.47SS..  trans-60.4111.9174-168.8-9.9000107.3N368 K372 D373N368-N370 PolarHBondContact O-N 2.84Å; N370-K372 PolarHBondContact O-N 3.38Å; N370-K372 PolarHBondContact OD1-N 3.24Å; N370-D373 PolarHBondContact O-N 2.85Å
371V61.5Low66Low68 Ų68101.4 Ų101.441%0.41248%0.479SS..G310 helixtrans-54-25.6-175.9-174.50000111.2I369 D373 E374I369-V371 PolarHBondContact O-N 3.28Å; V371-D373 VanDerWaalsContact C-N 3.29Å; V371-D373 PolarHBondContact O-N 3.46Å; V371-E374 PolarHBondContact O-N 2.83Å
372K61.4Low67Low172 Ų17294.2 Ų94.275%0.74845%0.452SS*.G310 helixtrans-65.2-27.9177.8-138.3173.2-176.2-179.70113.6N370N370-K372 PolarHBondContact O-N 3.38Å; N370-K372 PolarHBondContact OD1-N 3.24Å
373D65.3Low68.3Low96 Ų96100.1 Ų100.151%0.51348%0.475SS..G310 helixtrans-91.64-177.1-73.6-9.3000114M1 N370 V371M1-D373 PolarHBondContact N-O 2.88Å; N370-D373 PolarHBondContact O-N 2.85Å; V371-D373 VanDerWaalsContact C-N 3.29Å; V371-D373 PolarHBondContact O-N 3.46Å
374E71.7Confident69.8Low4 Ų493.9 Ų93.92%0.01946%0.459CS..SBendtrans-82133.7178.7-61.3-156.712300111.2S3 I369 V371 R379 R382S3-E374 WeakPolarHBondContact CB-OE1 3.35Å; S3-E374 PolarHBondContact OG-OE1 3.1Å; I369-E374 HydrophobicContact CG2-CG 3.93Å; V371-E374 PolarHBondContact O-N 2.83Å; E374-R379 HydrophobicContact CB-CG 3.7Å; E374-R379 PolarHBondContact O-NE 2.79Å; E374-R379 PolarHBondContact O-NH2 3.38Å; E374-R379 VanDerWaalsContact O-NH2 3.07Å; E374-R382 IonicContact OE2-NH1 3.35Å
375W77.1Confident71.4Confident175 Ų17590.4 Ų90.466%0.66344%0.436SS*.  trans-59.3148.7172.5-72.832.3000109.7L377 F378 R379W375-L377 PolarHBondContact O-N 2.73Å; W375-L377 VanDerWaalsContact O-N 3.14Å; W375-F378 HydrophobicContact CB-CD2 3.97Å; W375-F378 HydrophobicContact CG-CD2 4.47Å; W375-F378 PolarHBondContact O-N 3.41Å; W375-R379 PolarHBondContact O-N 3.35Å
376K81.3Confident73.3Confident178 Ų17889.6 Ų89.677%0.77443%0.434SS*.Hα-helixtrans-52.8-38.6-178.5-69.8-177.1-179.4179.40112.2R379 L380K376-R379 PolarHBondContact O-N 2.82Å; K376-L380 PolarHBondContact O-N 3.22Å
377L79Confident75.2Confident118 Ų11887.3 Ų87.362%0.61842%0.421SS*.Hα-helixtrans-64.1-46.8177.5-174.169.7000112.7W375 R379 L380 L381W375-L377 PolarHBondContact O-N 2.73Å; W375-L377 VanDerWaalsContact O-N 3.14Å; L377-R379 VanDerWaalsContact C-N 3.31Å; L377-R379 PolarHBondContact O-N 3.14Å; L377-L380 PolarHBondContact O-N 2.97Å; L377-L381 HydrophobicContact CG-CD1 4.28Å; L377-L381 WeakPolarHBondContact O-CG 3.19Å; L377-L381 PolarHBondContact O-N 3.47Å
378F82.5Confident76.8Confident27 Ų2784.5 Ų84.512%0.11841%0.405CS..Hα-helixtrans-63.5-39.1177.2-76-61.5000111.1W318 T319 W375 L380 L381 R382W318-F378 HydrophobicContact CH2-CB 4.14Å; W318-F378 AromaticContact CH2-CD1 3.55Å; W318-F378 HydrophobicContact CH2-CD1 3.55Å; W318-F378 HydrophobicContact CH2-CE1 4.49Å; W318-F378 HydrophobicContact CH2-CG 4.33Å; W318-F378 WeakPolarHBondContact CH2-O 3.34Å; W318-F378 HydrophobicContact CZ2-CB 3.89Å; W318-F378 AromaticContact CZ2-CD1 3.94Å; W318-F378 HydrophobicContact CZ2-CD1 3.94Å; W318-F378 HydrophobicContact CZ2-CG 4.38Å; W318-F378 WeakPolarHBondContact CZ2-O 3.44Å; W318-F378 HydrophobicContact CZ3-CD1 4.44Å; T319-F378 HydrophobicContact CG2-CD1 3.87Å; T319-F378 HydrophobicContact CG2-CE1 4.21Å; W375-F378 HydrophobicContact CB-CD2 3.97Å; W375-F378 HydrophobicContact CG-CD2 4.47Å; W375-F378 PolarHBondContact O-N 3.41Å; F378-L380 PolarHBondContact O-N 2.8Å; F378-L381 PolarHBondContact O-N 3.38Å; F378-R382 WeakPolarHBondContact O-CB 3.39Å; F378-R382 PolarHBondContact O-N 3.24Å
379R82.1Confident78.5Confident88 Ų8877.4 Ų77.433%0.33237%0.367SS..Hα-helixtrans-60-47.5173.2-79-175.9-82.1176.9-10.8112E374 W375 K376 L377 L381 R382 Y383E374-R379 HydrophobicContact CB-CG 3.7Å; E374-R379 PolarHBondContact O-NE 2.79Å; E374-R379 PolarHBondContact O-NH2 3.38Å; E374-R379 VanDerWaalsContact O-NH2 3.07Å; W375-R379 PolarHBondContact O-N 3.35Å; K376-R379 PolarHBondContact O-N 2.82Å; L377-R379 VanDerWaalsContact C-N 3.31Å; L377-R379 PolarHBondContact O-N 3.14Å; R379-L381 PolarHBondContact O-N 3.49Å; R379-R382 WeakPolarHBondContact O-CB 3.45Å; R379-R382 PolarHBondContact O-N 2.87Å; R379-Y383 HydrophobicContact CB-CE2 4.42Å; R379-Y383 WeakPolarHBondContact O-CD2 3.47Å; R379-Y383 PolarHBondContact O-N 3.41Å
380L84.3Confident80.1Confident108 Ų10885.3 Ų85.357%0.56540%0.396SS*.Hα-helixtrans-61.8-44.8179.6-168.2142.2000111.4K376 L377 F378 R382 Y383 C384K376-L380 PolarHBondContact O-N 3.22Å; L377-L380 PolarHBondContact O-N 2.97Å; F378-L380 PolarHBondContact O-N 2.8Å; L380-R382 VanDerWaalsContact C-N 3.35Å; L380-R382 PolarHBondContact O-N 3.1Å; L380-Y383 PolarHBondContact O-N 2.88Å; L380-C384 PolarHBondContact O-N 3.33Å; L380-C384 PolarHBondContact O-SG 3.46Å
381L84.5Confident81.5Confident40 Ų4083.5 Ų83.521%0.20939%0.389CS..Hα-helixtrans-60.9-41.3174.7-75.9170.3000112.5F284 W318 L377 F378 R379 C384 L385F284-L381 HydrophobicContact CD2-CD2 4.32Å; F284-L381 HydrophobicContact CE2-CD1 4.43Å; F284-L381 HydrophobicContact CE2-CD2 4.02Å; F284-L381 HydrophobicContact CZ-CD2 4.4Å; W318-L381 HydrophobicContact CH2-CB 3.56Å; W318-L381 HydrophobicContact CH2-CD1 4.3Å; W318-L381 HydrophobicContact CZ3-CB 3.92Å; L377-L381 HydrophobicContact CG-CD1 4.28Å; L377-L381 WeakPolarHBondContact O-CG 3.19Å; L377-L381 PolarHBondContact O-N 3.47Å; F378-L381 PolarHBondContact O-N 3.38Å; R379-L381 PolarHBondContact O-N 3.49Å; L381-C384 PolarHBondContact O-N 3.26Å; L381-L385 VanDerWaalsContact O-CB 3.25Å; L381-L385 WeakPolarHBondContact O-CB 3.41Å; L381-L385 PolarHBondContact O-N 3.39Å
382R85.9Confident82.8Confident47 Ų4780.2 Ų80.218%0.17737%0.369CS..Hα-helixtrans-61.5-43.9174.6-173-178.4-179.6178.30.1111.6W318 E374 F378 R379 L380 L385 I386W318-R382 HydrophobicContact CZ2-CB 3.87Å; E374-R382 IonicContact OE2-NH1 3.35Å; F378-R382 WeakPolarHBondContact O-CB 3.39Å; F378-R382 PolarHBondContact O-N 3.24Å; R379-R382 WeakPolarHBondContact O-CB 3.45Å; R379-R382 PolarHBondContact O-N 2.87Å; L380-R382 VanDerWaalsContact C-N 3.35Å; L380-R382 PolarHBondContact O-N 3.1Å; R382-L385 WeakPolarHBondContact O-CB 3.45Å; R382-L385 PolarHBondContact O-N 3.49Å; R382-I386 HydrophobicContact CG-CD1 3.9Å; R382-I386 HydrophobicContact CG-CG1 4.49Å; R382-I386 VanDerWaalsContact O-CG1 3.31Å; R382-I386 WeakPolarHBondContact O-CG1 3.3Å; R382-I386 PolarHBondContact O-N 3.28Å
383Y86.8Confident84.2Confident144 Ų14474.3 Ų74.357%0.56535%0.345SS*.Hα-helixtrans-63.1-46.9175.7-77.1-66.3000111.5R379 L380 L385 I386 I387R379-Y383 HydrophobicContact CB-CE2 4.42Å; R379-Y383 WeakPolarHBondContact O-CD2 3.47Å; R379-Y383 PolarHBondContact O-N 3.41Å; L380-Y383 PolarHBondContact O-N 2.88Å; Y383-L385 VanDerWaalsContact C-N 3.27Å; Y383-L385 PolarHBondContact O-N 2.86Å; Y383-I386 PolarHBondContact O-N 2.77Å; Y383-I387 VanDerWaalsContact O-CB 3.31Å; Y383-I387 WeakPolarHBondContact O-CB 3.46Å; Y383-I387 WeakPolarHBondContact O-CD1 3.37Å; Y383-I387 WeakPolarHBondContact O-CG1 3.47Å; Y383-I387 PolarHBondContact O-N 2.75Å
384C86.8Confident85.5Confident53 Ų5378 Ų7836%0.35835%0.352SS..Hα-helixtrans-56.7-43.3175.1-69.20000111.6W265 L380 L381 I387 S388W265-C384 HydrophobicContact CH2-CB 4.4Å; L380-C384 PolarHBondContact O-N 3.33Å; L380-C384 PolarHBondContact O-SG 3.46Å; L381-C384 PolarHBondContact O-N 3.26Å; C384-I387 PolarHBondContact O-N 2.94Å; C384-S388 WeakPolarHBondContact O-CB 3.06Å; C384-S388 PolarHBondContact O-N 3.48Å; C384-S388 PolarHBondContact O-OG 3.08Å
385L87.2Confident86.4Confident1 Ų180 Ų801%0.00536%0.364CS..Hα-helixtrans-60.7-58176.2-174.4144.1000110.6F284 F288 V315 W318 L381 R382 Y383 I387 S388 L389F284-L385 HydrophobicContact CZ-CD1 4.22Å; F288-L385 HydrophobicContact CD1-CD1 4.42Å; F288-L385 HydrophobicContact CD2-CD1 4.11Å; F288-L385 HydrophobicContact CE1-CD1 3.89Å; F288-L385 HydrophobicContact CE1-CG 4.49Å; F288-L385 HydrophobicContact CE2-CD1 3.57Å; F288-L385 HydrophobicContact CG-CD1 4.5Å; F288-L385 HydrophobicContact CZ-CD1 3.42Å; F288-L385 VanDerWaalsContact CZ-CD1 3.42Å; F288-L385 HydrophobicContact CZ-CD2 4.39Å; F288-L385 HydrophobicContact CZ-CG 4.24Å; V315-L385 HydrophobicContact CG2-CD2 4.47Å; W318-L385 HydrophobicContact CB-CD1 4.27Å; W318-L385 HydrophobicContact CE3-CD1 4.29Å; L381-L385 VanDerWaalsContact O-CB 3.25Å; L381-L385 WeakPolarHBondContact O-CB 3.41Å; L381-L385 PolarHBondContact O-N 3.39Å; R382-L385 WeakPolarHBondContact O-CB 3.45Å; R382-L385 PolarHBondContact O-N 3.49Å; Y383-L385 VanDerWaalsContact C-N 3.27Å; Y383-L385 PolarHBondContact O-N 2.86Å; L385-I387 VanDerWaalsContact C-N 3.26Å; L385-I387 PolarHBondContact O-N 3.04Å; L385-S388 WeakPolarHBondContact CA-OG 3.47Å; L385-S388 WeakPolarHBondContact O-CA 3.41Å; L385-S388 PolarHBondContact O-N 3.13Å; L385-S388 PolarHBondContact O-OG 3.27Å; L385-L389 HydrophobicContact CD2-CD1 3.45Å; L385-L389 VanDerWaalsContact CD2-CD1 3.45Å; L385-L389 HydrophobicContact CG-CD1 3.69Å; L385-L389 WeakPolarHBondContact O-CD1 3.07Å; L385-L389 PolarHBondContact O-N 3.46Å
386I88.5Confident87Confident51 Ų5171.6 Ų71.626%0.26233%0.333SS..Hα-helixtrans-56.4-41.1179.8-67.5167.9000111.8V315 R382 Y383 L389V315-I386 HydrophobicContact CG1-CD1 3.99Å; V315-I386 HydrophobicContact CG1-CG1 3.94Å; R382-I386 HydrophobicContact CG-CD1 3.9Å; R382-I386 HydrophobicContact CG-CG1 4.49Å; R382-I386 VanDerWaalsContact O-CG1 3.31Å; R382-I386 WeakPolarHBondContact O-CG1 3.3Å; R382-I386 PolarHBondContact O-N 3.28Å; Y383-I386 PolarHBondContact O-N 2.77Å; I386-L389 PolarHBondContact O-N 2.91Å
387I89.7Confident87.5Confident113 Ų11366.4 Ų66.458%0.57931%0.314SS*.Hα-helixtrans-64.4-41.8176.8-70.6166.6000110.5Y383 C384 L385 R390 P391Y383-I387 VanDerWaalsContact O-CB 3.31Å; Y383-I387 WeakPolarHBondContact O-CB 3.46Å; Y383-I387 WeakPolarHBondContact O-CD1 3.37Å; Y383-I387 WeakPolarHBondContact O-CG1 3.47Å; Y383-I387 PolarHBondContact O-N 2.75Å; C384-I387 PolarHBondContact O-N 2.94Å; L385-I387 VanDerWaalsContact C-N 3.26Å; L385-I387 PolarHBondContact O-N 3.04Å; I387-R390 PolarHBondContact O-N 3.02Å; I387-P391 WeakPolarHBondContact O-CD 3.05Å
388S87.2Confident88.1Confident17 Ų1764.1 Ų64.112%0.11930%0.302CS..Hα-helixtrans-70-28.8177.969.40000113.9F261 Q264 W265 C384 L385 R390 P391F261-S388 VanDerWaalsContact CE2-OG 3.32Å; F261-S388 WeakPolarHBondContact CE2-OG 3.41Å; Q264-S388 PolarHBondContact OE1-O 3Å; Q264-S388 VanDerWaalsContact OE1-O 3.11Å; W265-S388 PolarHBondContact NE1-OG 3.07Å; C384-S388 WeakPolarHBondContact O-CB 3.06Å; C384-S388 PolarHBondContact O-N 3.48Å; C384-S388 PolarHBondContact O-OG 3.08Å; L385-S388 WeakPolarHBondContact CA-OG 3.47Å; L385-S388 WeakPolarHBondContact O-CA 3.41Å; L385-S388 PolarHBondContact O-N 3.13Å; L385-S388 PolarHBondContact O-OG 3.27Å; S388-R390 VanDerWaalsContact C-N 3.29Å; S388-R390 PolarHBondContact O-N 3.09Å; S388-P391 WeakPolarHBondContact O-CD 3.4Å
389L89.5Confident88.4Confident10 Ų1065.2 Ų65.25%0.05231%0.31CS..Hα-helixtrans-65.3-32.7176.5-88.881.1000112.3F257 F261 L311 V315 L385 I386 A392 L393F257-L389 HydrophobicContact CZ-CG 4.11Å; F261-L389 HydrophobicContact CE2-CD1 3.88Å; F261-L389 HydrophobicContact CE2-CG 4.47Å; L311-L389 HydrophobicContact CD1-CD2 3.37Å; L311-L389 HydrophobicContact CD1-CG 4.34Å; L311-L389 HydrophobicContact CD2-CD2 4.03Å; L311-L389 HydrophobicContact CG-CD2 3.64Å; V315-L389 HydrophobicContact CG2-CD2 3.79Å; L385-L389 HydrophobicContact CD2-CD1 3.45Å; L385-L389 VanDerWaalsContact CD2-CD1 3.45Å; L385-L389 HydrophobicContact CG-CD1 3.69Å; L385-L389 WeakPolarHBondContact O-CD1 3.07Å; L385-L389 PolarHBondContact O-N 3.46Å; I386-L389 PolarHBondContact O-N 2.91Å; L389-A392 PolarHBondContact O-N 3.32Å; L389-L393 WeakPolarHBondContact O-CB 3.29Å; L389-L393 WeakPolarHBondContact O-CG 3.46Å; L389-L393 PolarHBondContact O-N 3.45Å
390R90.9Very high88.7Confident184 Ų18463.3 Ų63.369%0.69431%0.308SS*.Hα-helixtrans-66.5-51.6-174.7-72.4-178.2178.9-156.5-0.6113.2I387 S388 A392 L393 W394I387-R390 PolarHBondContact O-N 3.02Å; S388-R390 VanDerWaalsContact C-N 3.29Å; S388-R390 PolarHBondContact O-N 3.09Å; R390-A392 VanDerWaalsContact C-N 3.28Å; R390-A392 PolarHBondContact O-N 3.24Å; R390-L393 PolarHBondContact O-N 3.32Å; R390-W394 PolarHBondContact O-N 3.25Å
391P89.1Confident89Confident59 Ų5964.7 Ų64.738%0.38331%0.312SS..Hα-helixtrans-59.1-39.6173.4-2533.6000112.1I387 S388 L393 W394 V395I387-P391 WeakPolarHBondContact O-CD 3.05Å; S388-P391 WeakPolarHBondContact O-CD 3.4Å; P391-L393 PolarHBondContact O-N 2.96Å; P391-W394 PolarHBondContact O-N 2.81Å; P391-V395 WeakPolarHBondContact O-CB 3.27Å; P391-V395 VanDerWaalsContact O-CG2 3.27Å; P391-V395 WeakPolarHBondContact O-CG2 3.4Å; P391-V395 PolarHBondContact O-N 2.83Å
392A89.1Confident89.3Confident0 Ų065.6 Ų65.60%032%0.319CS..Hα-helixtrans-61.7-44.2178.200000112.4F257 I260 F261 L389 R390 S396F257-A392 HydrophobicContact CD2-CB 3.91Å; F257-A392 HydrophobicContact CE2-CB 3.56Å; F257-A392 HydrophobicContact CZ-CB 4.27Å; I260-A392 HydrophobicContact CG2-CB 4.1Å; F261-A392 HydrophobicContact CB-CB 4.15Å; F261-A392 HydrophobicContact CD2-CB 4.48Å; L389-A392 PolarHBondContact O-N 3.32Å; R390-A392 VanDerWaalsContact C-N 3.28Å; R390-A392 PolarHBondContact O-N 3.24Å; A392-S396 WeakPolarHBondContact O-CB 3.31Å; A392-S396 PolarHBondContact O-N 3.36Å; A392-S396 PolarHBondContact O-OG 3.12Å; A392-S396 VanDerWaalsContact O-OG 3.11Å
393L90.7Very high89.4Confident47 Ų4766.9 Ų66.925%0.24633%0.332CS..Hα-helixtrans-62.8-43173.3-79.3174.4000112.8Y253 F257 F307 L311 L389 R390 P391 S396 N397Y253-L393 WeakPolarHBondContact OH-CD2 3.31Å; F257-L393 HydrophobicContact CD2-CD2 3.97Å; F257-L393 HydrophobicContact CD2-CG 4.24Å; F257-L393 HydrophobicContact CE2-CD2 3.9Å; F257-L393 HydrophobicContact CE2-CG 3.78Å; F307-L393 HydrophobicContact CE1-CD2 3.96Å; L311-L393 HydrophobicContact CD2-CD1 3.69Å; L311-L393 HydrophobicContact CD2-CD2 3.8Å; L311-L393 HydrophobicContact CD2-CG 4Å; L389-L393 WeakPolarHBondContact O-CB 3.29Å; L389-L393 WeakPolarHBondContact O-CG 3.46Å; L389-L393 PolarHBondContact O-N 3.45Å; R390-L393 PolarHBondContact O-N 3.32Å; P391-L393 PolarHBondContact O-N 2.96Å; L393-S396 WeakPolarHBondContact CA-OG 3.14Å; L393-S396 PolarHBondContact O-OG 3.35Å; L393-N397 VanDerWaalsContact O-CB 3.28Å; L393-N397 WeakPolarHBondContact O-CB 3.37Å; L393-N397 PolarHBondContact O-N 3Å; L393-N397 PolarHBondContact O-ND2 3.19Å
394W92.4Very high89.4Confident174 Ų17462.8 Ų62.866%0.65933%0.328SS*.Hα-helixtrans-65.1-46.1-179.2-178.877.5000111.2R390 P391 N397 L398R390-W394 PolarHBondContact O-N 3.25Å; P391-W394 PolarHBondContact O-N 2.81Å; W394-N397 PolarHBondContact O-N 3.46Å; W394-L398 HydrophobicContact CH2-CD1 3.79Å; W394-L398 HydrophobicContact CZ2-CD1 3.86Å; W394-L398 HydrophobicContact CZ3-CD1 4.32Å; W394-L398 WeakPolarHBondContact O-CB 3.39Å; W394-L398 PolarHBondContact O-N 3.46Å
395V90.7Very high89.6Confident45 Ų4566.9 Ų66.927%0.27334%0.336SS..Hα-helixtrans-67.5-41.4177.7178.60000110.9I260 P391 N397 L398 V399I260-V395 HydrophobicContact CD1-CB 3.95Å; I260-V395 HydrophobicContact CD1-CG1 3.55Å; I260-V395 HydrophobicContact CG1-CG1 4.1Å; I260-V395 HydrophobicContact CG2-CB 4.08Å; I260-V395 HydrophobicContact CG2-CG1 4.2Å; P391-V395 WeakPolarHBondContact O-CB 3.27Å; P391-V395 VanDerWaalsContact O-CG2 3.27Å; P391-V395 WeakPolarHBondContact O-CG2 3.4Å; P391-V395 PolarHBondContact O-N 2.83Å; V395-N397 VanDerWaalsContact C-N 3.33Å; V395-N397 PolarHBondContact O-N 3.44Å; V395-L398 PolarHBondContact O-N 3.48Å; V395-V399 HydrophobicContact CG1-CG2 4.29Å; V395-V399 WeakPolarHBondContact O-CG2 3.33Å; V395-V399 PolarHBondContact O-N 2.88Å
396S88.8Confident89.6Confident0 Ų071.9 Ų71.90%036%0.358CS..Hα-helixtrans-63.1-41.5177.463.50000111.5Y253 A392 L393 L398 V399 V400Y253-S396 WeakPolarHBondContact CE2-OG 3.32Å; Y253-S396 PolarHBondContact OH-OG 3.39Å; A392-S396 WeakPolarHBondContact O-CB 3.31Å; A392-S396 PolarHBondContact O-N 3.36Å; A392-S396 PolarHBondContact O-OG 3.12Å; A392-S396 VanDerWaalsContact O-OG 3.11Å; L393-S396 WeakPolarHBondContact CA-OG 3.14Å; L393-S396 PolarHBondContact O-OG 3.35Å; S396-L398 VanDerWaalsContact C-N 3.34Å; S396-L398 PolarHBondContact O-N 2.81Å; S396-V399 PolarHBondContact O-N 3.34Å; S396-V400 WeakPolarHBondContact O-CG2 3.22Å; S396-V400 PolarHBondContact O-N 2.84Å
397N91.5Very high89.5Confident69 Ų6973 Ų7337%0.36937%0.367SS..Hα-helixtrans-61.2-43.2173.2-74.8-12.8000111.6Y253 L393 W394 V395 V400 Q401Y253-N397 WeakPolarHBondContact CE2-OD1 3.32Å; Y253-N397 VanDerWaalsContact CZ-OD1 3.3Å; Y253-N397 PolarHBondContact OH-OD1 3.4Å; L393-N397 VanDerWaalsContact O-CB 3.28Å; L393-N397 WeakPolarHBondContact O-CB 3.37Å; L393-N397 PolarHBondContact O-N 3Å; L393-N397 PolarHBondContact O-ND2 3.19Å; W394-N397 PolarHBondContact O-N 3.46Å; V395-N397 VanDerWaalsContact C-N 3.33Å; V395-N397 PolarHBondContact O-N 3.44Å; N397-V400 PolarHBondContact O-N 2.74Å; N397-Q401 VanDerWaalsContact O-CB 3.29Å; N397-Q401 WeakPolarHBondContact O-CB 3.36Å; N397-Q401 WeakPolarHBondContact O-CG 3.34Å; N397-Q401 PolarHBondContact O-N 2.94Å
398L92.4Very high89.2Confident70 Ų7073.6 Ų73.637%0.36636%0.363SS..Hα-helixtrans-64-42.7177.1-172.8147.3000111.6W394 V395 S396 Q401 T402W394-L398 HydrophobicContact CH2-CD1 3.79Å; W394-L398 HydrophobicContact CZ2-CD1 3.86Å; W394-L398 HydrophobicContact CZ3-CD1 4.32Å; W394-L398 WeakPolarHBondContact O-CB 3.39Å; W394-L398 PolarHBondContact O-N 3.46Å; V395-L398 PolarHBondContact O-N 3.48Å; S396-L398 VanDerWaalsContact C-N 3.34Å; S396-L398 PolarHBondContact O-N 2.81Å; L398-Q401 PolarHBondContact O-N 3.19Å; L398-T402 HydrophobicContact CD2-CG2 4.01Å; L398-T402 HydrophobicContact CG-CG2 4.41Å; L398-T402 WeakPolarHBondContact O-CB 3.41Å; L398-T402 VanDerWaalsContact O-CG2 3.23Å; L398-T402 WeakPolarHBondContact O-CG2 3.03Å; L398-T402 PolarHBondContact O-N 2.8Å; L398-T402 PolarHBondContact O-OG1 3.46Å
399V89.2Confident89.1Confident49 Ų4975.3 Ų75.330%0.29737%0.369SS..Hα-helixtrans-62.3-44.5175.9172.50000110.9I256 V395 S396 T402 T403I256-V399 HydrophobicContact CD1-CG1 4.33Å; I256-V399 HydrophobicContact CG2-CB 4.42Å; I256-V399 HydrophobicContact CG2-CG1 4.34Å; V395-V399 HydrophobicContact CG1-CG2 4.29Å; V395-V399 WeakPolarHBondContact O-CG2 3.33Å; V395-V399 PolarHBondContact O-N 2.88Å; S396-V399 PolarHBondContact O-N 3.34Å; V399-T402 WeakPolarHBondContact CA-OG1 3.33Å; V399-T402 PolarHBondContact O-OG1 3.39Å; V399-T403 VanDerWaalsContact O-CB 3.3Å; V399-T403 WeakPolarHBondContact O-CB 3.49Å; V399-T403 PolarHBondContact O-N 2.81Å; V399-T403 PolarHBondContact O-OG1 3.23Å
400V88.1Confident88.8Confident48 Ų4881.2 Ų81.229%0.29140%0.395SS..Hα-helixtrans-67.6-43.1178.2171.40000111.6Y253 S396 N397 T403 A404Y253-V400 HydrophobicContact CD2-CG2 3.81Å; Y253-V400 HydrophobicContact CE2-CG2 4.45Å; S396-V400 WeakPolarHBondContact O-CG2 3.22Å; S396-V400 PolarHBondContact O-N 2.84Å; N397-V400 PolarHBondContact O-N 2.74Å; V400-T403 PolarHBondContact O-N 3.43Å; V400-A404 VanDerWaalsContact O-CB 3.29Å; V400-A404 WeakPolarHBondContact O-CB 3.39Å; V400-A404 PolarHBondContact O-N 3.02Å
401Q90Very high88.3Confident137 Ų13779.5 Ų79.564%0.6439%0.388SS*.Hα-helixtrans-63.7-44.5177.5-75.9176.21.900112.1N397 L398 A404 W405N397-Q401 VanDerWaalsContact O-CB 3.29Å; N397-Q401 WeakPolarHBondContact O-CB 3.36Å; N397-Q401 WeakPolarHBondContact O-CG 3.34Å; N397-Q401 PolarHBondContact O-N 2.94Å; L398-Q401 PolarHBondContact O-N 3.19Å; Q401-A404 PolarHBondContact O-N 3.5Å; Q401-W405 VanDerWaalsContact O-CB 3.27Å; Q401-W405 WeakPolarHBondContact O-CB 3.24Å; Q401-W405 PolarHBondContact O-N 3.43Å
402T91.1Very high87.6Confident59 Ų5980.7 Ų80.736%0.36239%0.388SS..Hα-helixtrans-63.8-44.2176.749.60000110.8L398 V399 A404 W405 F406L398-T402 HydrophobicContact CD2-CG2 4.01Å; L398-T402 HydrophobicContact CG-CG2 4.41Å; L398-T402 WeakPolarHBondContact O-CB 3.41Å; L398-T402 VanDerWaalsContact O-CG2 3.23Å; L398-T402 WeakPolarHBondContact O-CG2 3.03Å; L398-T402 PolarHBondContact O-N 2.8Å; L398-T402 PolarHBondContact O-OG1 3.46Å; V399-T402 WeakPolarHBondContact CA-OG1 3.33Å; V399-T402 PolarHBondContact O-OG1 3.39Å; T402-A404 PolarHBondContact O-N 3.17Å; T402-W405 PolarHBondContact O-N 3.45Å; T402-F406 WeakPolarHBondContact O-CB 3.44Å; T402-F406 WeakPolarHBondContact O-CD2 3.18Å; T402-F406 PolarHBondContact O-N 2.85Å
403T88.7Confident86.8Confident75 Ų7589.1 Ų89.146%0.4642%0.42SS..Hα-helixtrans-61.5-45.3175.9-53.70000111.4V399 V400 W405 F406 V407V399-T403 VanDerWaalsContact O-CB 3.3Å; V399-T403 WeakPolarHBondContact O-CB 3.49Å; V399-T403 PolarHBondContact O-N 2.81Å; V399-T403 PolarHBondContact O-OG1 3.23Å; V400-T403 PolarHBondContact O-N 3.43Å; T403-W405 VanDerWaalsContact C-N 3.34Å; T403-W405 PolarHBondContact O-N 3.12Å; T403-F406 PolarHBondContact O-N 3.1Å; T403-V407 VanDerWaalsContact O-CG2 3.32Å; T403-V407 WeakPolarHBondContact O-CG2 3.21Å; T403-V407 PolarHBondContact O-N 3.33Å
404A86.4Confident86.1Confident58 Ų5894 Ų9448%0.47944%0.441SS..Hα-helixtrans-63-40.5176.700000112V400 Q401 T402 V407 Y408V400-A404 VanDerWaalsContact O-CB 3.29Å; V400-A404 WeakPolarHBondContact O-CB 3.39Å; V400-A404 PolarHBondContact O-N 3.02Å; Q401-A404 PolarHBondContact O-N 3.5Å; T402-A404 PolarHBondContact O-N 3.17Å; A404-V407 PolarHBondContact O-N 3.4Å; A404-Y408 VanDerWaalsContact O-CB 3.31Å; A404-Y408 WeakPolarHBondContact O-CB 3.23Å; A404-Y408 PolarHBondContact O-N 3.19Å
405W89.9Confident85.1Confident139 Ų13990 Ų9053%0.52743%0.433SS..Hα-helixtrans-63.4-43.9174.5179.490.1000111.6Q401 T402 T403 Y408 Q409Q401-W405 VanDerWaalsContact O-CB 3.27Å; Q401-W405 WeakPolarHBondContact O-CB 3.24Å; Q401-W405 PolarHBondContact O-N 3.43Å; T402-W405 PolarHBondContact O-N 3.45Å; T403-W405 VanDerWaalsContact C-N 3.34Å; T403-W405 PolarHBondContact O-N 3.12Å; W405-Y408 PolarHBondContact O-N 2.89Å; W405-Q409 HydrophobicContact CD2-CG 3.88Å; W405-Q409 HydrophobicContact CE3-CG 4.21Å; W405-Q409 HydrophobicContact CG-CG 4.46Å; W405-Q409 HydrophobicContact CH2-CG 4.05Å; W405-Q409 HydrophobicContact CZ2-CG 3.7Å; W405-Q409 HydrophobicContact CZ3-CG 4.28Å; W405-Q409 WeakPolarHBondContact O-CB 3.25Å; W405-Q409 VanDerWaalsContact O-CG 3.29Å; W405-Q409 WeakPolarHBondContact O-CG 3.45Å; W405-Q409 PolarHBondContact O-N 3.19Å
406F88.7Confident83.9Confident106 Ų10693 Ų9347%0.46544%0.44SS..Hα-helixtrans-62-47.6175.8-90.5-69.8000111.6T402 T403 Y408 Q409 F410T402-F406 WeakPolarHBondContact O-CB 3.44Å; T402-F406 WeakPolarHBondContact O-CD2 3.18Å; T402-F406 PolarHBondContact O-N 2.85Å; T403-F406 PolarHBondContact O-N 3.1Å; F406-Y408 VanDerWaalsContact C-N 3.27Å; F406-Y408 PolarHBondContact O-N 2.88Å; F406-Q409 PolarHBondContact O-N 3.01Å; F406-F410 AromaticContact CD1-CD2 3.94Å; F406-F410 HydrophobicContact CD1-CD2 3.94Å; F406-F410 AromaticContact CD1-CE2 3.68Å; F406-F410 HydrophobicContact CD1-CE2 3.68Å; F406-F410 HydrophobicContact CE1-CE2 4.05Å; F406-F410 WeakPolarHBondContact O-CB 3.5Å; F406-F410 WeakPolarHBondContact O-CD2 3.37Å; F406-F410 PolarHBondContact O-N 3.18Å
407V86.2Confident82.5Confident74 Ų7497.3 Ų97.345%0.44847%0.468SS..Hα-helixtrans-59.8-41.1175.2172.50000110.4T403 A404 W411T403-V407 VanDerWaalsContact O-CG2 3.32Å; T403-V407 WeakPolarHBondContact O-CG2 3.21Å; T403-V407 PolarHBondContact O-N 3.33Å; A404-V407 PolarHBondContact O-N 3.4Å; V407-W411 HydrophobicContact CG1-CB 4.28Å; V407-W411 WeakPolarHBondContact O-CA 2.98Å; V407-W411 WeakPolarHBondContact O-CB 3.34Å; V407-W411 PolarHBondContact O-N 3.28Å
408Y83.7Confident81Confident125 Ų125100.5 Ų100.549%0.4948%0.483SS..Iπ-helixtrans-62.9-47.7176.2-176.7-96.6000112.8A404 W405 F406 F412 R413A404-Y408 VanDerWaalsContact O-CB 3.31Å; A404-Y408 WeakPolarHBondContact O-CB 3.23Å; A404-Y408 PolarHBondContact O-N 3.19Å; W405-Y408 PolarHBondContact O-N 2.89Å; F406-Y408 VanDerWaalsContact C-N 3.27Å; F406-Y408 PolarHBondContact O-N 2.88Å; Y408-F412 HydrophobicContact CD2-CB 4.17Å; Y408-F412 AromaticContact CD2-CD2 3.93Å; Y408-F412 HydrophobicContact CD2-CD2 3.93Å; Y408-F412 HydrophobicContact CD2-CG 4.3Å; Y408-F412 HydrophobicContact CE2-CB 4.3Å; Y408-F412 WeakPolarHBondContact O-CB 3.39Å; Y408-F412 PolarHBondContact O-N 2.95Å; Y408-R413 PolarHBondContact O-N 3.48Å
409Q84.2Confident79.4Confident54 Ų54102.8 Ų102.825%0.25250%0.496SS..Iπ-helixtrans-67.2-41.2-179.2-71.3-67.5-7.300113W405 F406 R413W405-Q409 HydrophobicContact CD2-CG 3.88Å; W405-Q409 HydrophobicContact CE3-CG 4.21Å; W405-Q409 HydrophobicContact CG-CG 4.46Å; W405-Q409 HydrophobicContact CH2-CG 4.05Å; W405-Q409 HydrophobicContact CZ2-CG 3.7Å; W405-Q409 HydrophobicContact CZ3-CG 4.28Å; W405-Q409 WeakPolarHBondContact O-CB 3.25Å; W405-Q409 VanDerWaalsContact O-CG 3.29Å; W405-Q409 WeakPolarHBondContact O-CG 3.45Å; W405-Q409 PolarHBondContact O-N 3.19Å; F406-Q409 PolarHBondContact O-N 3.01Å; Q409-R413 WeakPolarHBondContact O-CB 3.05Å
410F83.9Confident78Confident134 Ų134108.5 Ų108.559%0.58853%0.525SS*.Iπ-helixtrans-86.1-42.9-177.1-80.9-82.2000112.2F406 Q414F406-F410 AromaticContact CD1-CD2 3.94Å; F406-F410 HydrophobicContact CD1-CD2 3.94Å; F406-F410 AromaticContact CD1-CE2 3.68Å; F406-F410 HydrophobicContact CD1-CE2 3.68Å; F406-F410 HydrophobicContact CE1-CE2 4.05Å; F406-F410 WeakPolarHBondContact O-CB 3.5Å; F406-F410 WeakPolarHBondContact O-CD2 3.37Å; F406-F410 PolarHBondContact O-N 3.18Å; F410-Q414 WeakPolarHBondContact O-CB 3.03Å
411W80Confident76.7Confident147 Ų147113.3 Ų113.356%0.55755%0.549SS*.Iπ-helixtrans-86.4-48.1-171.8-16159.6000112.4V407 N415V407-W411 HydrophobicContact CG1-CB 4.28Å; V407-W411 WeakPolarHBondContact O-CA 2.98Å; V407-W411 WeakPolarHBondContact O-CB 3.34Å; V407-W411 PolarHBondContact O-N 3.28Å; W411-N415 VanDerWaalsContact CD1-ND2 3.26Å; W411-N415 PolarHBondContact NE1-ND2 3Å; W411-N415 VanDerWaalsContact O-CB 3.25Å; W411-N415 WeakPolarHBondContact O-CB 3.48Å; W411-N415 VanDerWaalsContact O-CG 3.29Å; W411-N415 PolarHBondContact O-N 3.37Å; W411-N415 PolarHBondContact O-ND2 3.44Å
412F75Confident75.2Confident85 Ų85109.7 Ų109.737%0.37355%0.548SS..Iπ-helixtrans-79.2-40.6-177.7-75.7-76.9000112.5Y408 Q414 Y416Y408-F412 HydrophobicContact CD2-CB 4.17Å; Y408-F412 AromaticContact CD2-CD2 3.93Å; Y408-F412 HydrophobicContact CD2-CD2 3.93Å; Y408-F412 HydrophobicContact CD2-CG 4.3Å; Y408-F412 HydrophobicContact CE2-CB 4.3Å; Y408-F412 WeakPolarHBondContact O-CB 3.39Å; Y408-F412 PolarHBondContact O-N 2.95Å; F412-Q414 VanDerWaalsContact C-N 3.34Å; F412-Q414 PolarHBondContact O-N 3.15Å; F412-Y416 AromaticContact CD1-CD2 3.95Å; F412-Y416 HydrophobicContact CD1-CD2 3.95Å; F412-Y416 AromaticContact CD1-CE2 3.91Å; F412-Y416 HydrophobicContact CD1-CE2 3.91Å; F412-Y416 HydrophobicContact CE1-CE2 4.29Å; F412-Y416 WeakPolarHBondContact O-CB 3.36Å; F412-Y416 PolarHBondContact O-N 3.32Å
413R72.3Confident73.3Confident177 Ų177114 Ų11467%0.66857%0.569SS**Hα-helixtrans-68.2-33.4-179.7-159.4179.8174.6-178-3.6112.9Y408 Q409Y408-R413 PolarHBondContact O-N 3.48Å; Q409-R413 WeakPolarHBondContact O-CB 3.05Å
414Q74.2Confident71.4Confident149 Ų149118.6 Ų118.670%0.69658%0.578SS**Hα-helixtrans-80.7-36.7-179.8-163.51764.300112.2F410 F412F410-Q414 WeakPolarHBondContact O-CB 3.03Å; F412-Q414 VanDerWaalsContact C-N 3.34Å; F412-Q414 PolarHBondContact O-N 3.15Å
415N71.5Confident69.8Low90 Ų90124.1 Ų124.148%0.48159%0.594SS.*Hα-helixtrans-85.5-21.5-178.4-66.1-37.7000113.7W411 P417W411-N415 VanDerWaalsContact CD1-ND2 3.26Å; W411-N415 PolarHBondContact NE1-ND2 3Å; W411-N415 VanDerWaalsContact O-CB 3.25Å; W411-N415 WeakPolarHBondContact O-CB 3.48Å; W411-N415 VanDerWaalsContact O-CG 3.29Å; W411-N415 PolarHBondContact O-N 3.37Å; W411-N415 PolarHBondContact O-ND2 3.44Å; N415-P417 VanDerWaalsContact C-CD 3.5Å
416Y65.6Low68.1Low108 Ų108128 Ų12842%0.42462%0.615SS.*SBendtrans-126.771177.5-56.8-89.7000109.9F412 I418 Q425F412-Y416 AromaticContact CD1-CD2 3.95Å; F412-Y416 HydrophobicContact CD1-CD2 3.95Å; F412-Y416 AromaticContact CD1-CE2 3.91Å; F412-Y416 HydrophobicContact CD1-CE2 3.91Å; F412-Y416 HydrophobicContact CE1-CE2 4.29Å; F412-Y416 WeakPolarHBondContact O-CB 3.36Å; F412-Y416 PolarHBondContact O-N 3.32Å; Y416-I418 PolarHBondContact O-N 3.36Å; Y416-Q425 WeakPolarHBondContact CD1-O 3.49Å; Y416-Q425 WeakPolarHBondContact CE1-O 3.42Å
417P59.3Low67.1Low90 Ų90129.1 Ų129.158%0.58462%0.622SS**  trans-55.7127.4167.125.2-31.6000107.8N415 N419N415-P417 VanDerWaalsContact C-CD 3.5Å; P417-N419 PolarHBondContact O-N 3.2Å
418I59.9Low66.1Low136 Ų136132 Ų13270%0.69763%0.632SS**  trans-63.3103.6172-62.6167.8000105.4Y416Y416-I418 PolarHBondContact O-N 3.36Å
419N59.6Low65.1Low119 Ų119132.4 Ų132.464%0.63664%0.639SS**  trans-63.7136.1163.2-84.9-10.9000107.1P417 D421 G422P417-N419 PolarHBondContact O-N 3.2Å; N419-D421 PolarHBondContact O-N 3.48Å; N419-G422 PolarHBondContact O-N 3.38Å; N419-G422 VanDerWaalsContact O-N 3.1Å
420D59.5Low64Low169 Ų169137 Ų13790%0.90466%0.662SS**THydrogen-bonded Turntrans-55.2-10.4-176.1-94.3-31.6000114.2G422D420-G422 PolarHBondContact O-N 3.16Å
421D61.4Low62.7Low149 Ų149137.2 Ų137.280%0.79767%0.667SS**THydrogen-bonded Turntrans-80.98.5175.7-62.3-23.3000114.1N419 N423N419-D421 PolarHBondContact O-N 3.48Å; D421-N423 PolarHBondContact O-N 3.44Å
422G59.2Low61.6Low61 Ų61136.5 Ų136.563%0.62967%0.674SS**  trans70.1-2.2167.300000116.3N419 D420N419-G422 PolarHBondContact O-N 3.38Å; N419-G422 VanDerWaalsContact O-N 3.1Å; D420-G422 PolarHBondContact O-N 3.16Å
423N49.5Very low60.6Low148 Ų148140.2 Ų140.279%0.79170%0.696SS**  trans-94.8110.2178.4-97.8-11.4000111.6D421 Q425D421-N423 PolarHBondContact O-N 3.44Å; N423-Q425 PolarHBondContact O-N 3.42Å
424R49.4Very low59.7Low172 Ų172137.4 Ų137.465%0.64970%0.698SS**  trans-71.7112.8168.7-69.1-174.9-171-168.72.4109.2F426R424-F426 HydrophobicContact CB-CD2 4.31Å; R424-F426 HydrophobicContact CB-CE2 4.07Å; R424-F426 PolarHBondContact O-N 3.31Å
425Q52.1Low58.5Low174 Ų174136.4 Ų136.481%0.81370%0.698SS**  trans-74115.3160.1-74.6-175-11.500107.7Y416 N423Y416-Q425 WeakPolarHBondContact CD1-O 3.49Å; Y416-Q425 WeakPolarHBondContact CE1-O 3.42Å; N423-Q425 PolarHBondContact O-N 3.42Å
426F55.1Low57.3Low221 Ų221140.6 Ų140.697%0.96972%0.718SS**  trans-86.60171.6-83.5-80.4000110.8R424R424-F426 HydrophobicContact CB-CD2 4.31Å; R424-F426 HydrophobicContact CB-CE2 4.07Å; R424-F426 PolarHBondContact O-N 3.31Å

Retrieved 426 of 426 residues in 77.8 ms (Link to these results)

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