A0A5K4F210_SCHMA Loading...

Cyclin-H AlphaSync

AlphaFold DB , UniProt , Accession A0A5K4F210, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 360 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
1A83.4Confident92.8Very high92 Ų9260.2 Ų60.276%0.7637%0.366SS*.  0-63.6000000111.4V3 T4 Y168A1-V3 PolarHBondContact O-N 3.44Å; A1-T4 PolarHBondContact O-N 3.01Å; A1-T4 PolarHBondContact O-OG1 3.23Å; A1-Y168 HydrophobicContact CB-CE1 3.99Å
2Y90.2Very high93.1Very high28 Ų2859.8 Ų59.811%0.1136%0.356CS..G310 helixtrans-56.2-47.1-178.4178-105000115.1T4 S5 Q7 F8 Y168 H231 P232Y2-T4 PolarHBondContact O-N 3.49Å; Y2-S5 VanDerWaalsContact O-CB 3.23Å; Y2-S5 WeakPolarHBondContact O-CB 3.35Å; Y2-S5 PolarHBondContact O-N 3.22Å; Y2-S5 PolarHBondContact O-OG 3.39Å; Y2-Q7 HydrophobicContact CE2-CB 4.23Å; Y2-Q7 HydrophobicContact CE2-CG 3.73Å; Y2-F8 HydrophobicContact CD1-CB 4.41Å; Y2-F8 HydrophobicContact CD1-CD2 4.31Å; Y2-F8 HydrophobicContact CE1-CB 4.01Å; Y2-F8 AromaticContact CE1-CD2 3.54Å; Y2-F8 HydrophobicContact CE1-CD2 3.54Å; Y2-F8 HydrophobicContact CE1-CE2 4.44Å; Y2-F8 HydrophobicContact CE1-CG 4.14Å; Y2-F8 HydrophobicContact CE2-CB 4.37Å; Y2-F8 VanDerWaalsContact O-CB 3.29Å; Y2-F8 WeakPolarHBondContact O-CB 3.31Å; Y2-Y168 AromaticContact CD2-CD2 3.83Å; Y2-Y168 HydrophobicContact CD2-CD2 3.83Å; Y2-Y168 HydrophobicContact CD2-CG 4.03Å; Y2-H231 AromaticContact CD1-ND1 3.72Å; Y2-H231 HydrophobicContact CE1-CB 4.12Å; Y2-H231 AromaticContact CE1-CD2 3.71Å; Y2-H231 AromaticContact CE1-CE1 3.75Å; Y2-H231 AromaticContact CE1-CG 3.55Å; Y2-H231 AromaticContact CE1-ND1 3.58Å; Y2-H231 AromaticContact CE1-NE2 3.82Å; Y2-P232 HydrophobicContact CD2-CG 3.85Å; Y2-P232 HydrophobicContact CE2-CG 3.68Å; Y2-P232 VanDerWaalsContact CZ-CD 3.47Å
3V90.8Very high93.5Very high91 Ų9158 Ų5855%0.55234%0.341SS*.G310 helixtrans-62.7-14.2-177.1-68.30000115A1 F8A1-V3 PolarHBondContact O-N 3.44Å; V3-F8 WeakPolarHBondContact O-CD1 3.36Å
4T91.8Very high93.7Very high118 Ų11858.2 Ų58.272%0.72434%0.344SS*.G310 helixtrans-111.314176.158.10000112A1 Y2A1-T4 PolarHBondContact O-N 3.01Å; A1-T4 PolarHBondContact O-OG1 3.23Å; Y2-T4 PolarHBondContact O-N 3.49Å
5S94.1Very high93.8Very high13 Ų1358.3 Ų58.39%0.09135%0.347CS..SBendtrans-95.2156.2-176.572.80000112.5Y2 Q7 F8 C9 Y168Y2-S5 VanDerWaalsContact O-CB 3.23Å; Y2-S5 WeakPolarHBondContact O-CB 3.35Å; Y2-S5 PolarHBondContact O-N 3.22Å; Y2-S5 PolarHBondContact O-OG 3.39Å; S5-Q7 PolarHBondContact O-N 2.87Å; S5-F8 PolarHBondContact O-N 3.13Å; S5-F8 VanDerWaalsContact O-N 3.08Å; S5-F8 PolarHBondContact OG-N 2.98Å; S5-C9 PolarHBondContact O-N 3.29Å; S5-C9 PolarHBondContact O-SG 3.03Å; S5-C9 VanDerWaalsContact O-SG 3.42Å; S5-Y168 VanDerWaalsContact CB-CE2 3.41Å
6T93.2Very high94.1Very high59 Ų5959.4 Ų59.436%0.36236%0.358SS..Hα-helixtrans-62.2-30.517457.70000112.3F8 C9 N10 D164T6-F8 VanDerWaalsContact C-N 3.33Å; T6-F8 PolarHBondContact O-N 3.43Å; T6-C9 PolarHBondContact O-N 3.36Å; T6-N10 VanDerWaalsContact O-CB 3.32Å; T6-N10 WeakPolarHBondContact O-CB 3.37Å; T6-N10 PolarHBondContact O-N 2.91Å; T6-D164 WeakPolarHBondContact CB-OD1 3.48Å; T6-D164 VanDerWaalsContact CG2-OD1 3.29Å; T6-D164 WeakPolarHBondContact CG2-OD1 3.34Å; T6-D164 PolarHBondContact OG1-OD1 3.4Å
7Q94.8Very high94.3Very high4 Ų461.3 Ų61.32%0.01936%0.362CS..Hα-helixtrans-58-44.5171.5177.8174.46.400112.1Y2 S5 W11 H12 R99Y2-Q7 HydrophobicContact CE2-CB 4.23Å; Y2-Q7 HydrophobicContact CE2-CG 3.73Å; S5-Q7 PolarHBondContact O-N 2.87Å; Q7-W11 CarbonylContact O-C 3.58Å; Q7-W11 VanDerWaalsContact O-CA 3.27Å; Q7-W11 WeakPolarHBondContact O-CA 3.33Å; Q7-W11 WeakPolarHBondContact O-CB 3.48Å; Q7-W11 PolarHBondContact O-N 2.89Å; Q7-H12 PolarHBondContact O-N 3.43Å; Q7-R99 VanDerWaalsContact CG-NH2 3.3Å
8F95.1Very high94.5Very high70 Ų7057.9 Ų57.931%0.30734%0.342SS..Hα-helixtrans-72.4-41.1178.2-179.4-105.1000111.9Y2 V3 S5 T6 H12 H231Y2-F8 HydrophobicContact CD1-CB 4.41Å; Y2-F8 HydrophobicContact CD1-CD2 4.31Å; Y2-F8 HydrophobicContact CE1-CB 4.01Å; Y2-F8 AromaticContact CE1-CD2 3.54Å; Y2-F8 HydrophobicContact CE1-CD2 3.54Å; Y2-F8 HydrophobicContact CE1-CE2 4.44Å; Y2-F8 HydrophobicContact CE1-CG 4.14Å; Y2-F8 HydrophobicContact CE2-CB 4.37Å; Y2-F8 VanDerWaalsContact O-CB 3.29Å; Y2-F8 WeakPolarHBondContact O-CB 3.31Å; V3-F8 WeakPolarHBondContact O-CD1 3.36Å; S5-F8 PolarHBondContact O-N 3.13Å; S5-F8 VanDerWaalsContact O-N 3.08Å; S5-F8 PolarHBondContact OG-N 2.98Å; T6-F8 VanDerWaalsContact C-N 3.33Å; T6-F8 PolarHBondContact O-N 3.43Å; F8-H12 HydrophobicContact CD2-CB 4.22Å; F8-H12 AromaticContact CE2-CD2 3.92Å; F8-H12 WeakPolarHBondContact O-CB 3.3Å; F8-H231 AromaticContact CD2-NE2 3.9Å; F8-H231 AromaticContact CE2-CE1 3.9Å; F8-H231 AromaticContact CE2-NE2 3.46Å; F8-H231 WeakPolarHBondContact CE2-NE2 3.31Å
9C95Very high94.6Very high87 Ų8760.5 Ų60.559%0.58835%0.353SS*.Hα-helixtrans-71.6-36.4-176.5-64.70000113.8S5 T6S5-C9 PolarHBondContact O-N 3.29Å; S5-C9 PolarHBondContact O-SG 3.03Å; S5-C9 VanDerWaalsContact O-SG 3.42Å; T6-C9 PolarHBondContact O-N 3.36Å
10N95.9Very high94.8Very high84 Ų8461.3 Ų61.345%0.44936%0.359SS..Hα-helixtrans-115.4-20.7-169.1-56.9-19.8000113.2T6 F13 D164T6-N10 VanDerWaalsContact O-CB 3.32Å; T6-N10 WeakPolarHBondContact O-CB 3.37Å; T6-N10 PolarHBondContact O-N 2.91Å; N10-F13 VanDerWaalsContact O-CZ 3.29Å; N10-F13 WeakPolarHBondContact O-CZ 3.35Å; N10-D164 PolarHBondContact ND2-OD2 3Å
11W96.8Very high94.9Very high16 Ų1660.8 Ų60.86%0.06136%0.355CS..SBendtrans-128.822.6-168.6-57.6102000114Q7 F13 R99 L102 L161 D164Q7-W11 CarbonylContact O-C 3.58Å; Q7-W11 VanDerWaalsContact O-CA 3.27Å; Q7-W11 WeakPolarHBondContact O-CA 3.33Å; Q7-W11 WeakPolarHBondContact O-CB 3.48Å; Q7-W11 PolarHBondContact O-N 2.89Å; W11-F13 HydrophobicContact CB-CE2 4.46Å; W11-F13 HydrophobicContact CE3-CE2 4.04Å; W11-F13 HydrophobicContact CE3-CZ 4.19Å; W11-R99 HydrophobicContact CD2-CB 4.39Å; W11-R99 VanDerWaalsContact CD2-CD 3.43Å; W11-R99 HydrophobicContact CD2-CG 3.76Å; W11-R99 HydrophobicContact CE3-CB 3.79Å; W11-R99 HydrophobicContact CE3-CG 3.4Å; W11-R99 HydrophobicContact CG-CG 4.31Å; W11-R99 VanDerWaalsContact CG-NE 3.33Å; W11-R99 HydrophobicContact CH2-CB 3.99Å; W11-R99 HydrophobicContact CH2-CG 4.41Å; W11-R99 HydrophobicContact CZ3-CB 3.56Å; W11-R99 HydrophobicContact CZ3-CG 3.76Å; W11-L102 HydrophobicContact CE3-CD1 4.44Å; W11-L102 HydrophobicContact CZ3-CD1 4.34Å; W11-L161 WeakPolarHBondContact CZ2-O 3.34Å; W11-D164 VanDerWaalsContact NE1-CB 3.31Å; W11-D164 PolarHBondContact NE1-OD2 3.47Å
12H96.3Very high95.6Very high55 Ų5558.4 Ų58.426%0.25533%0.326SS..  trans-112.1119.3173.2-17067.6000109.9Q7 F8 L228 T229 H231Q7-H12 PolarHBondContact O-N 3.43Å; F8-H12 HydrophobicContact CD2-CB 4.22Å; F8-H12 AromaticContact CE2-CD2 3.92Å; F8-H12 WeakPolarHBondContact O-CB 3.3Å; H12-L228 WeakPolarHBondContact CA-O 3.46Å; H12-T229 PolarHBondContact CE1-O 3.37Å; H12-H231 AromaticContact CE1-CD2 3.67Å
13F97.5Very high95.9Very high37 Ų3759.2 Ų59.216%0.16234%0.336CS..  trans-130.9152.5-172-54.8-80.6000111.7N10 W11 E17 L18 L21 L102 L228 T229N10-F13 VanDerWaalsContact O-CZ 3.29Å; N10-F13 WeakPolarHBondContact O-CZ 3.35Å; W11-F13 HydrophobicContact CB-CE2 4.46Å; W11-F13 HydrophobicContact CE3-CE2 4.04Å; W11-F13 HydrophobicContact CE3-CZ 4.19Å; F13-E17 HydrophobicContact CB-CB 4.31Å; F13-E17 HydrophobicContact CD1-CB 4.46Å; F13-L18 HydrophobicContact CB-CD2 3.62Å; F13-L18 HydrophobicContact CB-CG 3.77Å; F13-L18 HydrophobicContact CD2-CD2 3.65Å; F13-L18 HydrophobicContact CE2-CD2 4.46Å; F13-L18 HydrophobicContact CG-CD2 3.71Å; F13-L18 HydrophobicContact CG-CG 4.41Å; F13-L21 HydrophobicContact CD1-CD1 3.9Å; F13-L21 HydrophobicContact CE1-CD1 3.74Å; F13-L21 HydrophobicContact CZ-CD1 4.24Å; F13-L102 HydrophobicContact CD2-CD1 4.19Å; F13-L102 HydrophobicContact CE2-CD1 3.62Å; F13-L102 HydrophobicContact CZ-CD1 4.14Å; F13-L228 HydrophobicContact CD2-CB 4.3Å; F13-L228 PolarHBondContact N-O 3.18Å; F13-T229 WeakPolarHBondContact O-CA 3.39Å; F13-T229 WeakPolarHBondContact O-CG2 3.19Å
14T96.9Very high96.3Very high61 Ų6159.4 Ų59.437%0.37433%0.334SS..  trans-76155162.863.50000110.5S16 E17 L18T14-S16 PolarHBondContact O-N 2.98Å; T14-S16 PolarHBondContact OG1-OG 3.5Å; T14-S16 VanDerWaalsContact OG1-OG 3.07Å; T14-E17 WeakPolarHBondContact CB-OE2 3.38Å; T14-E17 PolarHBondContact N-OE2 2.92Å; T14-E17 PolarHBondContact O-N 3.42Å; T14-E17 VanDerWaalsContact O-N 3.13Å; T14-E17 WeakPolarHBondContact OG1-CB 3.49Å; T14-E17 WeakPolarHBondContact OG1-CG 3.25Å; T14-E17 PolarHBondContact OG1-N 3.44Å; T14-E17 PolarHBondContact OG1-OE2 3.28Å; T14-L18 PolarHBondContact O-N 3.05Å; T14-L18 VanDerWaalsContact O-N 3.16Å
15P95.9Very high96.5Very high60 Ų6054.5 Ų54.539%0.3930%0.304SS..Hα-helixtrans-55-37.2175.3-26.234.2000113.4L18 I19 F306P15-L18 PolarHBondContact O-N 2.92Å; P15-I19 WeakPolarHBondContact O-CG1 3.47Å; P15-I19 PolarHBondContact O-N 3.39Å; P15-F306 HydrophobicContact CG-CE1 4.36Å; P15-F306 HydrophobicContact CG-CZ 3.89Å
16S97.1Very high96.6Very high75 Ų7554.4 Ų54.452%0.52430%0.302SS..Hα-helixtrans-65.2-42.2176.440.80000113T14 L18 I19 T20T14-S16 PolarHBondContact O-N 2.98Å; T14-S16 PolarHBondContact OG1-OG 3.5Å; T14-S16 VanDerWaalsContact OG1-OG 3.07Å; S16-L18 VanDerWaalsContact C-N 3.3Å; S16-L18 PolarHBondContact O-N 2.94Å; S16-I19 PolarHBondContact O-N 3.19Å; S16-T20 PolarHBondContact O-N 3.01Å; S16-T20 VanDerWaalsContact O-N 3.1Å; S16-T20 PolarHBondContact O-OG1 2.8Å
17E97.8Very high96.8Very high92 Ų9254.2 Ų54.243%0.4331%0.307SS..Hα-helixtrans-63.1-39.2177.1-75.4161.6160.200111.2F13 T14 I19 T20 L21F13-E17 HydrophobicContact CB-CB 4.31Å; F13-E17 HydrophobicContact CD1-CB 4.46Å; T14-E17 WeakPolarHBondContact CB-OE2 3.38Å; T14-E17 PolarHBondContact N-OE2 2.92Å; T14-E17 PolarHBondContact O-N 3.42Å; T14-E17 VanDerWaalsContact O-N 3.13Å; T14-E17 WeakPolarHBondContact OG1-CB 3.49Å; T14-E17 WeakPolarHBondContact OG1-CG 3.25Å; T14-E17 PolarHBondContact OG1-N 3.44Å; T14-E17 PolarHBondContact OG1-OE2 3.28Å; E17-I19 PolarHBondContact O-N 3.45Å; E17-T20 PolarHBondContact O-N 2.9Å; E17-L21 WeakPolarHBondContact O-CB 3.07Å; E17-L21 WeakPolarHBondContact O-CG 3.16Å; E17-L21 PolarHBondContact O-N 2.83Å
18L97.7Very high96.8Very high1 Ų157.8 Ų57.81%0.00533%0.329CS..Hα-helixtrans-63.1-40.1176.1-66.9-177.7000112.6F13 T14 P15 S16 T20 R22 L102 D225 L228 T229F13-L18 HydrophobicContact CB-CD2 3.62Å; F13-L18 HydrophobicContact CB-CG 3.77Å; F13-L18 HydrophobicContact CD2-CD2 3.65Å; F13-L18 HydrophobicContact CE2-CD2 4.46Å; F13-L18 HydrophobicContact CG-CD2 3.71Å; F13-L18 HydrophobicContact CG-CG 4.41Å; T14-L18 PolarHBondContact O-N 3.05Å; T14-L18 VanDerWaalsContact O-N 3.16Å; P15-L18 PolarHBondContact O-N 2.92Å; S16-L18 VanDerWaalsContact C-N 3.3Å; S16-L18 PolarHBondContact O-N 2.94Å; L18-T20 VanDerWaalsContact C-N 3.35Å; L18-R22 WeakPolarHBondContact O-CB 3.28Å; L18-R22 VanDerWaalsContact O-CG 3.28Å; L18-R22 WeakPolarHBondContact O-CG 3.23Å; L18-R22 PolarHBondContact O-N 3.26Å; L18-L102 HydrophobicContact CD2-CD1 4.01Å; L18-L102 HydrophobicContact CD2-CD2 3.78Å; L18-D225 HydrophobicContact CD1-CB 3.73Å; L18-L228 HydrophobicContact CD1-CB 4.24Å; L18-L228 HydrophobicContact CD1-CD1 4.41Å; L18-L228 HydrophobicContact CD2-CB 4.47Å; L18-L228 HydrophobicContact CD2-CD1 4.09Å; L18-T229 HydrophobicContact CD1-CG2 3.49Å; L18-T229 VanDerWaalsContact CD1-CG2 3.49Å
19I97.1Very high96.7Very high106 Ų10654.4 Ų54.454%0.54431%0.314SS..Hα-helixtrans-62.4-44.7175.9-67.7165.9000110.3P15 S16 E17 S23P15-I19 WeakPolarHBondContact O-CG1 3.47Å; P15-I19 PolarHBondContact O-N 3.39Å; S16-I19 PolarHBondContact O-N 3.19Å; E17-I19 PolarHBondContact O-N 3.45Å; I19-S23 WeakPolarHBondContact O-CB 3.46Å; I19-S23 PolarHBondContact O-N 2.99Å; I19-S23 PolarHBondContact O-OG 3.47Å
20T98Very high96.6Very high77 Ų7752.9 Ų52.947%0.47230%0.3SS..Hα-helixtrans-63.2-49.7177.5-59.10000111.6S16 E17 L18 R22 S23 D24S16-T20 PolarHBondContact O-N 3.01Å; S16-T20 VanDerWaalsContact O-N 3.1Å; S16-T20 PolarHBondContact O-OG1 2.8Å; E17-T20 PolarHBondContact O-N 2.9Å; L18-T20 VanDerWaalsContact C-N 3.35Å; T20-R22 VanDerWaalsContact C-N 3.32Å; T20-R22 PolarHBondContact O-N 3.31Å; T20-S23 PolarHBondContact O-N 3.47Å; T20-S23 VanDerWaalsContact O-N 3.13Å; T20-D24 PolarHBondContact O-N 3.23Å
21L97.9Very high96.5Very high51 Ų5156.3 Ų56.327%0.26731%0.311SS..Hα-helixtrans-56.1-45.3178.7-74.9169.9000112.1F13 E17 D24 C25F13-L21 HydrophobicContact CD1-CD1 3.9Å; F13-L21 HydrophobicContact CE1-CD1 3.74Å; F13-L21 HydrophobicContact CZ-CD1 4.24Å; E17-L21 WeakPolarHBondContact O-CB 3.07Å; E17-L21 WeakPolarHBondContact O-CG 3.16Å; E17-L21 PolarHBondContact O-N 2.83Å; L21-D24 PolarHBondContact O-N 2.98Å; L21-C25 VanDerWaalsContact O-CB 3.23Å; L21-C25 WeakPolarHBondContact O-CB 3.35Å; L21-C25 PolarHBondContact O-N 3.43Å
22R97.7Very high96.2Very high41 Ų4158.7 Ų58.716%0.15532%0.32CS..Hα-helixtrans-64.2-42.4177.5-72.4171.5-177.5147.25.6112.3L18 T20 N26 P59 D225L18-R22 WeakPolarHBondContact O-CB 3.28Å; L18-R22 VanDerWaalsContact O-CG 3.28Å; L18-R22 WeakPolarHBondContact O-CG 3.23Å; L18-R22 PolarHBondContact O-N 3.26Å; T20-R22 VanDerWaalsContact C-N 3.32Å; T20-R22 PolarHBondContact O-N 3.31Å; R22-N26 WeakPolarHBondContact O-CB 3.24Å; R22-N26 PolarHBondContact O-N 3.25Å; R22-P59 HydrophobicContact CB-CB 4.41Å; R22-D225 IonicContact CZ-OD1 2.63Å; R22-D225 IonicContact CZ-OD2 3.67Å; R22-D225 IonicContact NH1-OD2 2.81Å; R22-D225 PolarHBondContact NH1-OD2 3.04Å; R22-D225 IonicContact NH2-OD1 3.74Å; R22-D225 PolarHBondContact NH2-OD1 2.83Å; R22-D225 IonicContact NH2-OD2 3.81Å; R22-D225 PolarHBondContact NH2-OD2 2.92Å
23S97.5Very high95.8Very high46 Ų4656.6 Ų56.632%0.32231%0.311SS..Hα-helixtrans-63.9-43.2178.7-59.10000111.6I19 T20 A27I19-S23 WeakPolarHBondContact O-CB 3.46Å; I19-S23 PolarHBondContact O-N 2.99Å; I19-S23 PolarHBondContact O-OG 3.47Å; T20-S23 PolarHBondContact O-N 3.47Å; T20-S23 VanDerWaalsContact O-N 3.13Å; S23-A27 WeakPolarHBondContact O-CB 3.31Å; S23-A27 PolarHBondContact O-N 3.24Å
24D97.8Very high95.4Very high95 Ų9559.1 Ų59.151%0.50832%0.323SS..Hα-helixtrans-68.6-42.2178.9-69.7-15.9000111.9T20 L21 T28T20-D24 PolarHBondContact O-N 3.23Å; L21-D24 PolarHBondContact O-N 2.98Å; D24-T28 WeakPolarHBondContact O-CB 3Å; D24-T28 PolarHBondContact O-N 3.41Å; D24-T28 PolarHBondContact O-OG1 3.34Å
25C97.2Very high95Very high14 Ų1459 Ų5910%0.09533%0.325CS..Hα-helixtrans-60.4-49.1174.4178.40000111.2L21 T28 A29 N103 H104L21-C25 VanDerWaalsContact O-CB 3.23Å; L21-C25 WeakPolarHBondContact O-CB 3.35Å; L21-C25 PolarHBondContact O-N 3.43Å; C25-T28 WeakPolarHBondContact O-CB 3.36Å; C25-T28 PolarHBondContact O-N 3.36Å; C25-A29 PolarHBondContact O-N 3.43Å; C25-N103 VanDerWaalsContact SG-C 3.52Å; C25-H104 PolarHBondContact SG-N 3.43Å; C25-H104 VanDerWaalsContact SG-N 3.4Å
26N96.4Very high94.4Very high11 Ų1157 Ų576%0.05931%0.311CS..Hα-helixtrans-60.8-47.6178.3177.3-96.2000111.8R22 T28 A29 L30 L57 P59 E62R22-N26 WeakPolarHBondContact O-CB 3.24Å; R22-N26 PolarHBondContact O-N 3.25Å; N26-T28 VanDerWaalsContact C-N 3.26Å; N26-T28 PolarHBondContact O-N 3.4Å; N26-A29 PolarHBondContact O-N 2.81Å; N26-A29 VanDerWaalsContact O-N 3.1Å; N26-L30 WeakPolarHBondContact O-CG 3.48Å; N26-L30 PolarHBondContact O-N 3.27Å; N26-L30 WeakPolarHBondContact OD1-CD1 3.47Å; N26-L57 PolarHBondContact ND2-O 2.75Å; N26-P59 HydrophobicContact CB-CG 3.92Å; N26-E62 PolarHBondContact ND2-OE1 3.11Å
27A95.8Very high93.7Very high56 Ų5656 Ų5646%0.46330%0.298SS..Hα-helixtrans-59.5-38.617700000112.2S23 K31S23-A27 WeakPolarHBondContact O-CB 3.31Å; S23-A27 PolarHBondContact O-N 3.24Å; A27-K31 WeakPolarHBondContact O-CB 3.43Å; A27-K31 PolarHBondContact O-N 3.29Å
28T95.3Very high93Very high78 Ų7854.9 Ų54.948%0.47929%0.292SS..Hα-helixtrans-66.4-38.9176.2-59.30000111.9D24 C25 N26 R32D24-T28 WeakPolarHBondContact O-CB 3Å; D24-T28 PolarHBondContact O-N 3.41Å; D24-T28 PolarHBondContact O-OG1 3.34Å; C25-T28 WeakPolarHBondContact O-CB 3.36Å; C25-T28 PolarHBondContact O-N 3.36Å; N26-T28 VanDerWaalsContact C-N 3.26Å; N26-T28 PolarHBondContact O-N 3.4Å; T28-R32 WeakPolarHBondContact O-CG 3.38Å; T28-R32 PolarHBondContact O-N 3.01Å; T28-R32 PolarHBondContact O-NE 3.5Å
29A94.1Very high92.2Very high0 Ų058.6 Ų58.60%032%0.315CS..Hα-helixtrans-68.1-46.8175.800000112.1C25 N26 K31 R32 L33 M107C25-A29 PolarHBondContact O-N 3.43Å; N26-A29 PolarHBondContact O-N 2.81Å; N26-A29 VanDerWaalsContact O-N 3.1Å; A29-K31 VanDerWaalsContact C-N 3.29Å; A29-K31 PolarHBondContact O-N 3.2Å; A29-R32 WeakPolarHBondContact O-CB 3.5Å; A29-R32 PolarHBondContact O-N 3.49Å; A29-L33 PolarHBondContact O-N 3.06Å; A29-M107 HydrophobicContact CB-CE 3.91Å
30L93.1Very high91.3Very high54 Ų5456.8 Ų56.828%0.28330%0.304SS..Hα-helixtrans-58-41.1176.4-70.2175.4000112.1N26 R32 L33 Q34 M107N26-L30 WeakPolarHBondContact O-CG 3.48Å; N26-L30 PolarHBondContact O-N 3.27Å; N26-L30 WeakPolarHBondContact OD1-CD1 3.47Å; L30-R32 VanDerWaalsContact C-N 3.32Å; L30-R32 PolarHBondContact O-N 3.32Å; L30-L33 PolarHBondContact O-N 3Å; L30-Q34 WeakPolarHBondContact O-CB 3.38Å; L30-Q34 PolarHBondContact O-N 2.92Å; L30-M107 HydrophobicContact CD2-CE 3.83Å; L30-M107 HydrophobicContact CD2-SD 4.15Å; L30-M107 HydrophobicContact CG-CE 4.09Å
31K92.5Very high90.5Very high156 Ų15655 Ų5568%0.67829%0.293SS*.Hα-helixtrans-62.7-38.3175.9-169.3177.4-177.2178.40112.2A27 A29 S35A27-K31 WeakPolarHBondContact O-CB 3.43Å; A27-K31 PolarHBondContact O-N 3.29Å; A29-K31 VanDerWaalsContact C-N 3.29Å; A29-K31 PolarHBondContact O-N 3.2Å; K31-S35 PolarHBondContact O-N 3.13Å; K31-S35 PolarHBondContact O-OG 3.26Å
32R90.5Very high89.5Confident66 Ų6661.2 Ų61.225%0.24931%0.313CS..Hα-helixtrans-67.9-44.2176.2-76.2-178.9-72.7123.7-6111.6T28 A29 L30 Q34 S35 T36 D108T28-R32 WeakPolarHBondContact O-CG 3.38Å; T28-R32 PolarHBondContact O-N 3.01Å; T28-R32 PolarHBondContact O-NE 3.5Å; A29-R32 WeakPolarHBondContact O-CB 3.5Å; A29-R32 PolarHBondContact O-N 3.49Å; L30-R32 VanDerWaalsContact C-N 3.32Å; L30-R32 PolarHBondContact O-N 3.32Å; R32-Q34 VanDerWaalsContact C-N 3.34Å; R32-Q34 PolarHBondContact O-N 3.4Å; R32-S35 PolarHBondContact O-N 2.88Å; R32-S35 PolarHBondContact O-OG 3.5Å; R32-T36 PolarHBondContact O-N 3.29Å; R32-T36 PolarHBondContact O-OG1 2.55Å; R32-D108 IonicContact CZ-OD1 3.23Å; R32-D108 IonicContact CZ-OD2 3.23Å; R32-D108 IonicContact NH1-OD1 2.64Å; R32-D108 PolarHBondContact NH1-OD1 2.9Å; R32-D108 IonicContact NH1-OD2 3.95Å; R32-D108 PolarHBondContact NH1-OD2 3.43Å; R32-D108 IonicContact NH2-OD2 2.76Å; R32-D108 PolarHBondContact NH2-OD2 3.3Å
33L89Confident88.5Confident12 Ų1265.2 Ų65.26%0.06334%0.337CS..Hα-helixtrans-60.2-44.4174.3-69.7175.1000111.7A29 L30 S35 T36 K37 V54 M107 N335A29-L33 PolarHBondContact O-N 3.06Å; L30-L33 PolarHBondContact O-N 3Å; L33-S35 PolarHBondContact O-N 3.47Å; L33-T36 PolarHBondContact O-N 3.06Å; L33-K37 PolarHBondContact O-N 3.11Å; L33-V54 HydrophobicContact CB-CG1 3.8Å; L33-V54 HydrophobicContact CB-CG2 4.38Å; L33-V54 HydrophobicContact CD1-CG1 4.06Å; L33-M107 HydrophobicContact CD1-CB 4.16Å; L33-M107 HydrophobicContact CD1-CE 4.39Å; L33-M107 HydrophobicContact CD1-CG 4.5Å; L33-M107 HydrophobicContact CD1-SD 3.62Å; L33-N335 HydrophobicContact CD2-CB 3.63Å
34Q88.9Confident87.5Confident90 Ų9068.6 Ų68.642%0.42135%0.352SS..Hα-helixtrans-60.8-45.9177.5-174.2178.8-16.300111.5L30 R32 T36 K37 E38 V54L30-Q34 WeakPolarHBondContact O-CB 3.38Å; L30-Q34 PolarHBondContact O-N 2.92Å; R32-Q34 VanDerWaalsContact C-N 3.34Å; R32-Q34 PolarHBondContact O-N 3.4Å; Q34-T36 VanDerWaalsContact C-N 3.27Å; Q34-T36 PolarHBondContact O-N 2.85Å; Q34-K37 PolarHBondContact O-N 3.25Å; Q34-E38 HydrophobicContact CG-CG 4.49Å; Q34-E38 WeakPolarHBondContact CG-OE1 3.29Å; Q34-E38 PolarHBondContact NE2-OE1 3.02Å; Q34-E38 WeakPolarHBondContact O-CB 3.33Å; Q34-E38 WeakPolarHBondContact O-CG 3.42Å; Q34-E38 PolarHBondContact O-N 3.29Å; Q34-V54 HydrophobicContact CB-CG2 4.06Å
35S87.1Confident86.2Confident59 Ų5970.9 Ų70.941%0.41336%0.364SS..Hα-helixtrans-62.4-35177.7700000113K31 R32 L33 V39K31-S35 PolarHBondContact O-N 3.13Å; K31-S35 PolarHBondContact O-OG 3.26Å; R32-S35 PolarHBondContact O-N 2.88Å; R32-S35 PolarHBondContact O-OG 3.5Å; L33-S35 PolarHBondContact O-N 3.47Å; S35-V39 WeakPolarHBondContact O-CG2 3.32Å; S35-V39 PolarHBondContact O-N 3.12Å
36T83.4Confident84.6Confident18 Ų1875.4 Ų75.411%0.1139%0.387CS..Hα-helixtrans-68.4-47.7178-530000110.3R32 L33 Q34 E38 V39 E40 P336 L337R32-T36 PolarHBondContact O-N 3.29Å; R32-T36 PolarHBondContact O-OG1 2.55Å; L33-T36 PolarHBondContact O-N 3.06Å; Q34-T36 VanDerWaalsContact C-N 3.27Å; Q34-T36 PolarHBondContact O-N 2.85Å; T36-E38 VanDerWaalsContact C-N 3.34Å; T36-E38 PolarHBondContact O-N 3.22Å; T36-V39 PolarHBondContact O-N 2.9Å; T36-V39 VanDerWaalsContact O-N 3.13Å; T36-E40 PolarHBondContact O-N 3.1Å; T36-P336 HydrophobicContact CG2-CG 3.89Å; T36-L337 HydrophobicContact CG2-CD1 4.33Å; T36-L337 HydrophobicContact CG2-CG 4.37Å
37K82.5Confident82.8Confident54 Ų5483.5 Ų83.524%0.23543%0.425CS..Hα-helixtrans-61.5-38.9176.4-170.3171.3-179.4177.90112.7L33 Q34 V39 E40 V41 N51 L53 V54L33-K37 PolarHBondContact O-N 3.11Å; Q34-K37 PolarHBondContact O-N 3.25Å; K37-V39 VanDerWaalsContact C-N 3.32Å; K37-V39 PolarHBondContact O-N 3.1Å; K37-E40 PolarHBondContact O-N 3.5Å; K37-V41 VanDerWaalsContact O-CG2 3.28Å; K37-V41 WeakPolarHBondContact O-CG2 3.32Å; K37-V41 PolarHBondContact O-N 2.92Å; K37-N51 WeakPolarHBondContact CE-O 3.41Å; K37-N51 PolarHBondContact NZ-O 2.92Å; K37-L53 PolarHBondContact NZ-O 3.4Å; K37-V54 HydrophobicContact CB-CG2 4.25Å; K37-V54 HydrophobicContact CD-CG2 3.76Å
38E84.3Confident81Confident67 Ų6787.2 Ų87.231%0.31344%0.437SS..Hα-helixtrans-63-36.9175.3-76175.6-166.400112.4Q34 T36 R42 T52Q34-E38 HydrophobicContact CG-CG 4.49Å; Q34-E38 WeakPolarHBondContact CG-OE1 3.29Å; Q34-E38 PolarHBondContact NE2-OE1 3.02Å; Q34-E38 WeakPolarHBondContact O-CB 3.33Å; Q34-E38 WeakPolarHBondContact O-CG 3.42Å; Q34-E38 PolarHBondContact O-N 3.29Å; T36-E38 VanDerWaalsContact C-N 3.34Å; T36-E38 PolarHBondContact O-N 3.22Å; E38-R42 WeakPolarHBondContact O-CB 3.32Å; E38-R42 VanDerWaalsContact O-CG 3.24Å; E38-R42 WeakPolarHBondContact O-CG 3.37Å; E38-R42 PolarHBondContact O-N 2.63Å; E38-R42 VanDerWaalsContact O-N 3.17Å; E38-T52 HydrophobicContact CG-CG2 4.04Å
39V81Confident79.1Confident79 Ų7990.3 Ų90.348%0.47945%0.448SS..Hα-helixtrans-69.2-42.5175.51720000111.2S35 T36 K37 R42 N43S35-V39 WeakPolarHBondContact O-CG2 3.32Å; S35-V39 PolarHBondContact O-N 3.12Å; T36-V39 PolarHBondContact O-N 2.9Å; T36-V39 VanDerWaalsContact O-N 3.13Å; K37-V39 VanDerWaalsContact C-N 3.32Å; K37-V39 PolarHBondContact O-N 3.1Å; V39-R42 PolarHBondContact O-N 2.97Å; V39-N43 PolarHBondContact O-N 2.83Å
40E78.4Confident77.3Confident69 Ų6998.1 Ų98.132%0.32249%0.489SS..Hα-helixtrans-61.2-46.7176.2-71.6170.3-166.200112.4T36 K37 R42 N43 N44T36-E40 PolarHBondContact O-N 3.1Å; K37-E40 PolarHBondContact O-N 3.5Å; E40-R42 VanDerWaalsContact C-N 3.31Å; E40-R42 PolarHBondContact O-N 2.83Å; E40-N43 PolarHBondContact O-N 3.05Å; E40-N44 WeakPolarHBondContact O-CB 3.28Å; E40-N44 PolarHBondContact O-N 3.35Å
41V79.6Confident75.6Confident40 Ų40101.5 Ų101.524%0.24251%0.507CS..Hα-helixtrans-60.9-41.5178.3170.80000111K37 N44 N45 N46K37-V41 VanDerWaalsContact O-CG2 3.28Å; K37-V41 WeakPolarHBondContact O-CG2 3.32Å; K37-V41 PolarHBondContact O-N 2.92Å; V41-N44 PolarHBondContact O-N 3.33Å; V41-N45 PolarHBondContact O-N 3.13Å; V41-N46 VanDerWaalsContact CG1-O 3.28Å; V41-N46 WeakPolarHBondContact CG1-O 3.28Å; V41-N46 PolarHBondContact O-N 3.34Å
42R78.1Confident74Confident181 Ų18195.3 Ų95.368%0.68348%0.483SS*.Hα-helixtrans-63.7-42.9175.6-75.7174.8-174-179.57.2112.4E38 V39 E40 N44E38-R42 WeakPolarHBondContact O-CB 3.32Å; E38-R42 VanDerWaalsContact O-CG 3.24Å; E38-R42 WeakPolarHBondContact O-CG 3.37Å; E38-R42 PolarHBondContact O-N 2.63Å; E38-R42 VanDerWaalsContact O-N 3.17Å; V39-R42 PolarHBondContact O-N 2.97Å; E40-R42 VanDerWaalsContact C-N 3.31Å; E40-R42 PolarHBondContact O-N 2.83Å; R42-N44 VanDerWaalsContact C-N 3.35Å
43N76.9Confident72.9Confident125 Ų12599.5 Ų99.567%0.66851%0.51SS*.Hα-helixtrans-69.2-32.8-179.9-74.4-11.8000112.7V39 E40V39-N43 PolarHBondContact O-N 2.83Å; E40-N43 PolarHBondContact O-N 3.05Å
44N75.4Confident71.9Confident116 Ų116101 Ų10162%0.6252%0.519SS*.THydrogen-bonded Turntrans-87.45.4-177.8-73.9-20.2000114.5E40 V41 R42 N46E40-N44 WeakPolarHBondContact O-CB 3.28Å; E40-N44 PolarHBondContact O-N 3.35Å; V41-N44 PolarHBondContact O-N 3.33Å; R42-N44 VanDerWaalsContact C-N 3.35Å; N44-N46 PolarHBondContact O-N 2.95Å
45N70.7Confident71.5Confident144 Ų144101 Ų10177%0.7753%0.525SS*.THydrogen-bonded Turntrans50.125.7-177-71.7-18.2000114.4V41 E47V41-N45 PolarHBondContact O-N 3.13Å; N45-E47 PolarHBondContact O-N 3.39Å
46N62.6Low71.5Confident109 Ų10999.2 Ų99.258%0.58352%0.516SS*.  trans-86.9101.1-179.3-99.5-23.4000109.5V41 N44 N48V41-N46 VanDerWaalsContact CG1-O 3.28Å; V41-N46 WeakPolarHBondContact CG1-O 3.28Å; V41-N46 PolarHBondContact O-N 3.34Å; N44-N46 PolarHBondContact O-N 2.95Å; N46-N48 PolarHBondContact O-N 3.2Å; N46-N48 VanDerWaalsContact O-N 3.1Å
47E58.9Low72Confident181 Ų18198.4 Ų98.485%0.84651%0.511SS*.  trans-748.6-179.1-67.6-168.9155.400115N45 M49N45-E47 PolarHBondContact O-N 3.39Å; E47-M49 PolarHBondContact O-N 3.01Å
48N59.3Low72.6Confident133 Ų13399.1 Ų99.171%0.71152%0.517SS*.  trans-76.371.6174.8-84.8-6.8000111.6N46 N50 N51N46-N48 PolarHBondContact O-N 3.2Å; N46-N48 VanDerWaalsContact O-N 3.1Å; N48-N50 PolarHBondContact O-N 3.17Å; N48-N50 VanDerWaalsContact O-N 3.09Å; N48-N51 PolarHBondContact O-N 3.22Å; N48-N51 VanDerWaalsContact O-N 3.16Å
49M55.5Low73.1Confident144 Ų14497.5 Ų97.571%0.70951%0.512SS*.G310 helixtrans-54.4-24175.5-77.7-74-159.200114E47 N51 T52E47-M49 PolarHBondContact O-N 3.01Å; M49-N51 PolarHBondContact O-N 3.45Å; M49-T52 WeakPolarHBondContact O-CB 3.41Å; M49-T52 PolarHBondContact O-N 3.49Å; M49-T52 PolarHBondContact O-OG1 3.11Å
50N55.7Low73.7Confident163 Ų16399.4 Ų99.487%0.87252%0.52SS*.G310 helixtrans-68.7-15.9179.9-72.6-1.8000113.5N48N48-N50 PolarHBondContact O-N 3.17Å; N48-N50 VanDerWaalsContact O-N 3.09Å
51N58Low74.5Confident125 Ų12598 Ų9867%0.66851%0.513SS*.G310 helixtrans-93.813.4179.4-145.129.6000113.6K37 N48 M49K37-N51 WeakPolarHBondContact CE-O 3.41Å; K37-N51 PolarHBondContact NZ-O 2.92Å; N48-N51 PolarHBondContact O-N 3.22Å; N48-N51 VanDerWaalsContact O-N 3.16Å; M49-N51 PolarHBondContact O-N 3.45Å
52T58.8Low75.3Confident26 Ų2696.7 Ų96.716%0.1651%0.505CS..  trans-79.2-18.6-172.4-46.30000113.6E38 M49 V54E38-T52 HydrophobicContact CG-CG2 4.04Å; M49-T52 WeakPolarHBondContact O-CB 3.41Å; M49-T52 PolarHBondContact O-N 3.49Å; M49-T52 PolarHBondContact O-OG1 3.11Å; T52-V54 PolarHBondContact O-N 2.96Å; T52-V54 VanDerWaalsContact O-N 3.14Å
53L66.2Low76.2Confident155 Ų15589.8 Ų89.881%0.81248%0.48SS*.PPolyproline II helixtrans-59.9122.3175.6-71.4168.2000109.2K37K37-L53 PolarHBondContact NZ-O 3.4Å
54V69.1Low77Confident42 Ų4288.4 Ų88.426%0.25547%0.468SS..PPolyproline II helixtrans-78.9124.7173.2175.40000107.2L33 Q34 K37 T52 G56L33-V54 HydrophobicContact CB-CG1 3.8Å; L33-V54 HydrophobicContact CB-CG2 4.38Å; L33-V54 HydrophobicContact CD1-CG1 4.06Å; Q34-V54 HydrophobicContact CB-CG2 4.06Å; K37-V54 HydrophobicContact CB-CG2 4.25Å; K37-V54 HydrophobicContact CD-CG2 3.76Å; T52-V54 PolarHBondContact O-N 2.96Å; T52-V54 VanDerWaalsContact O-N 3.14Å; V54-G56 PolarHBondContact O-N 3.45Å
55V80.1Confident78Confident91 Ų9183 Ų8355%0.55244%0.439SS*.PPolyproline II helixtrans-74.7119.8162.7-1800000105.5I329 C333V55-I329 HydrophobicContact CG1-CG2 4.27Å; V55-C333 WeakPolarHBondContact O-CB 3.32Å
56G88.1Confident79.2Confident22 Ų2276.5 Ų76.523%0.22741%0.405CS..  trans-141166.5178.300000109.6V54V54-G56 PolarHBondContact O-N 3.45Å
57L93.4Very high80.8Confident1 Ų172.6 Ų72.61%0.00538%0.382CS..  trans-76.8146.5179.5-63.8163.7000110.2N26 Q61 E62 I65 V106 M107 I329 L330N26-L57 PolarHBondContact ND2-O 2.75Å; L57-Q61 HydrophobicContact CB-CB 4.18Å; L57-Q61 HydrophobicContact CD2-CB 3.88Å; L57-E62 HydrophobicContact CB-CG 3.85Å; L57-E62 HydrophobicContact CD1-CG 4.25Å; L57-I65 HydrophobicContact CD1-CD1 3.53Å; L57-I65 HydrophobicContact CD2-CD1 4.13Å; L57-I65 HydrophobicContact CG-CD1 4.49Å; L57-V106 HydrophobicContact CD1-CG2 3.66Å; L57-M107 HydrophobicContact CB-CG 4.47Å; L57-M107 HydrophobicContact CB-SD 4.23Å; L57-M107 HydrophobicContact CD1-CG 3.91Å; L57-M107 HydrophobicContact CG-CG 4.37Å; L57-M107 HydrophobicContact CG-SD 4.5Å; L57-M107 PolarHBondContact N-SD 2.86Å; L57-I329 HydrophobicContact CD2-CB 3.82Å; L57-I329 HydrophobicContact CD2-CG2 3.53Å; L57-I329 HydrophobicContact CG-CG2 4.1Å; L57-L330 HydrophobicContact CD1-CB 4.06Å; L57-L330 HydrophobicContact CD1-CD1 3.84Å; L57-L330 HydrophobicContact CD1-CG 4.49Å
58D94.3Very high82.5Confident68 Ų6865.8 Ų65.836%0.36435%0.35SS..  trans-80.6164.5163.973.556000111.3D60 Q61 E62D58-D60 VanDerWaalsContact C-N 3.26Å; D58-D60 PolarHBondContact O-N 2.88Å; D58-D60 WeakPolarHBondContact OD1-CA 3.49Å; D58-D60 WeakPolarHBondContact OD1-CB 3.48Å; D58-D60 PolarHBondContact OD1-N 2.92Å; D58-Q61 WeakPolarHBondContact O-CB 3.44Å; D58-Q61 PolarHBondContact O-N 3.35Å; D58-Q61 PolarHBondContact OD1-N 3.48Å; D58-Q61 VanDerWaalsContact OD2-CD 3.22Å; D58-Q61 VanDerWaalsContact OD2-CG 3.28Å; D58-Q61 WeakPolarHBondContact OD2-CG 3.23Å; D58-Q61 PolarHBondContact OD2-OE1 2.85Å; D58-E62 PolarHBondContact O-N 2.89Å
59P95.2Very high84.3Confident33 Ų3359.5 Ų59.521%0.21432%0.317CS..Hα-helixtrans-58.2-32.7-178.7-25.834.8000114.7R22 N26 F63R22-P59 HydrophobicContact CB-CB 4.41Å; N26-P59 HydrophobicContact CB-CG 3.92Å; P59-F63 WeakPolarHBondContact O-CB 3.25Å; P59-F63 PolarHBondContact O-N 3.23Å
60D94.7Very high86.4Confident119 Ų11952.6 Ų52.664%0.63628%0.283SS*.Hα-helixtrans-74.9-37.7179.4-67.7-38.3000110.8D58 F63 K64D58-D60 VanDerWaalsContact C-N 3.26Å; D58-D60 PolarHBondContact O-N 2.88Å; D58-D60 WeakPolarHBondContact OD1-CA 3.49Å; D58-D60 WeakPolarHBondContact OD1-CB 3.48Å; D58-D60 PolarHBondContact OD1-N 2.92Å; D60-F63 PolarHBondContact O-N 2.95Å; D60-K64 WeakPolarHBondContact O-CG 3.13Å; D60-K64 PolarHBondContact O-N 3.2Å
61Q94.9Very high88.3Confident39 Ų3946.9 Ų46.918%0.18225%0.249CC..Hα-helixtrans-62.8-45.5171.8-69.5176.9-36.500111.5L57 D58 F63 K64 I65 E326L57-Q61 HydrophobicContact CB-CB 4.18Å; L57-Q61 HydrophobicContact CD2-CB 3.88Å; D58-Q61 WeakPolarHBondContact O-CB 3.44Å; D58-Q61 PolarHBondContact O-N 3.35Å; D58-Q61 PolarHBondContact OD1-N 3.48Å; D58-Q61 VanDerWaalsContact OD2-CD 3.22Å; D58-Q61 VanDerWaalsContact OD2-CG 3.28Å; D58-Q61 WeakPolarHBondContact OD2-CG 3.23Å; D58-Q61 PolarHBondContact OD2-OE1 2.85Å; Q61-F63 VanDerWaalsContact C-N 3.29Å; Q61-F63 PolarHBondContact O-N 2.63Å; Q61-K64 PolarHBondContact O-N 2.88Å; Q61-I65 WeakPolarHBondContact O-CG1 3.4Å; Q61-I65 PolarHBondContact O-N 2.88Å; Q61-I65 VanDerWaalsContact O-N 3.08Å; Q61-E326 HydrophobicContact CB-CB 4.49Å; Q61-E326 HydrophobicContact CB-CG 3.97Å; Q61-E326 HydrophobicContact CG-CG 3.86Å
62E96.3Very high90.1Very high14 Ų1442 Ų427%0.06522%0.223CC..Hα-helixtrans-57.4-44.9173.1-68-156.5-157.700111.2N26 L57 D58 K64 I65 V66 S105 V106 M107N26-E62 PolarHBondContact ND2-OE1 3.11Å; L57-E62 HydrophobicContact CB-CG 3.85Å; L57-E62 HydrophobicContact CD1-CG 4.25Å; D58-E62 PolarHBondContact O-N 2.89Å; E62-K64 PolarHBondContact O-N 3.46Å; E62-I65 WeakPolarHBondContact O-CB 3.35Å; E62-I65 PolarHBondContact O-N 2.88Å; E62-V66 WeakPolarHBondContact O-CG2 3.42Å; E62-V66 PolarHBondContact O-N 3.19Å; E62-S105 PolarHBondContact OE1-OG 2.88Å; E62-S105 WeakPolarHBondContact OE2-CA 3.4Å; E62-S105 PolarHBondContact OE2-OG 3.3Å; E62-S105 VanDerWaalsContact OE2-OG 3.1Å; E62-V106 HydrophobicContact CB-CG2 3.96Å; E62-V106 HydrophobicContact CG-CG2 3.62Å; E62-V106 PolarHBondContact OE2-N 2.92Å; E62-M107 VanDerWaalsContact OE1-CE 3.23Å; E62-M107 WeakPolarHBondContact OE1-CE 3.23Å
63F95.6Very high91.9Very high36 Ų3640.8 Ų40.816%0.15822%0.216CC..Hα-helixtrans-63.6-38.6179.2-176.3-111.9000113P59 D60 Q61 I65 V66 K67 D225 F314P59-F63 WeakPolarHBondContact O-CB 3.25Å; P59-F63 PolarHBondContact O-N 3.23Å; D60-F63 PolarHBondContact O-N 2.95Å; Q61-F63 VanDerWaalsContact C-N 3.29Å; Q61-F63 PolarHBondContact O-N 2.63Å; F63-I65 VanDerWaalsContact C-N 3.34Å; F63-V66 PolarHBondContact O-N 3.06Å; F63-K67 WeakPolarHBondContact O-CB 3.38Å; F63-K67 PolarHBondContact O-N 3.25Å; F63-D225 VanDerWaalsContact CE2-OD1 3.26Å; F63-D225 WeakPolarHBondContact CE2-OD1 3.4Å; F63-F314 HydrophobicContact CE1-CE2 4.02Å; F63-F314 HydrophobicContact CE1-CZ 4.42Å; F63-F314 HydrophobicContact CZ-CE2 4.19Å
64K94.7Very high93.4Very high95 Ų9535 Ų3541%0.41318%0.184SC..Hα-helixtrans-61.7-41.6173.7-74175.1-175.7174.30112D60 Q61 E62 K67 H68 E326D60-K64 WeakPolarHBondContact O-CG 3.13Å; D60-K64 PolarHBondContact O-N 3.2Å; Q61-K64 PolarHBondContact O-N 2.88Å; E62-K64 PolarHBondContact O-N 3.46Å; K64-K67 WeakPolarHBondContact O-CB 3.25Å; K64-K67 PolarHBondContact O-N 3Å; K64-H68 PolarHBondContact O-N 2.85Å; K64-E326 HydrophobicContact CD-CG 4.27Å; K64-E326 WeakPolarHBondContact CD-OE1 3.39Å; K64-E326 IonicContact NZ-OE1 3.68Å; K64-E326 PolarHBondContact NZ-OE1 3.29Å
65I95.6Very high94.7Very high3 Ų335.2 Ų35.22%0.01518%0.183CC..Hα-helixtrans-63.3-48.9176-66.4168.1000109.9L57 Q61 E62 F63 K67 H68 Y69 V106 P111 E326 L330L57-I65 HydrophobicContact CD1-CD1 3.53Å; L57-I65 HydrophobicContact CD2-CD1 4.13Å; L57-I65 HydrophobicContact CG-CD1 4.49Å; Q61-I65 WeakPolarHBondContact O-CG1 3.4Å; Q61-I65 PolarHBondContact O-N 2.88Å; Q61-I65 VanDerWaalsContact O-N 3.08Å; E62-I65 WeakPolarHBondContact O-CB 3.35Å; E62-I65 PolarHBondContact O-N 2.88Å; F63-I65 VanDerWaalsContact C-N 3.34Å; I65-K67 VanDerWaalsContact C-N 3.28Å; I65-K67 PolarHBondContact O-N 3.34Å; I65-H68 WeakPolarHBondContact O-CB 3.48Å; I65-H68 PolarHBondContact O-N 3.2Å; I65-H68 VanDerWaalsContact O-N 3.1Å; I65-Y69 HydrophobicContact CG2-CD2 3.92Å; I65-Y69 HydrophobicContact CG2-CE2 4.08Å; I65-Y69 WeakPolarHBondContact O-CD2 3.44Å; I65-Y69 PolarHBondContact O-N 3.35Å; I65-V106 HydrophobicContact CD1-CG2 4.27Å; I65-V106 HydrophobicContact CG2-CG1 4.25Å; I65-P111 HydrophobicContact CG2-CB 4.3Å; I65-P111 HydrophobicContact CG2-CG 3.7Å; I65-E326 HydrophobicContact CD1-CB 4.01Å; I65-E326 HydrophobicContact CG1-CB 3.88Å; I65-L330 HydrophobicContact CD1-CB 4.05Å; I65-L330 HydrophobicContact CD1-CD2 4.13Å; I65-L330 HydrophobicContact CG2-CD2 4.14Å
66V97Very high95.4Very high8 Ų831.7 Ų31.75%0.04816%0.161CC..Hα-helixtrans-56.2-45.3176.2172.70000110.7E62 F63 H68 Y69 V70 F97 K98 Y101 V106E62-V66 WeakPolarHBondContact O-CG2 3.42Å; E62-V66 PolarHBondContact O-N 3.19Å; F63-V66 PolarHBondContact O-N 3.06Å; V66-H68 PolarHBondContact O-N 2.85Å; V66-Y69 PolarHBondContact O-N 3.09Å; V66-V70 WeakPolarHBondContact O-CG2 3.28Å; V66-V70 PolarHBondContact O-N 2.88Å; V66-F97 HydrophobicContact CB-CE1 4.32Å; V66-F97 HydrophobicContact CG1-CD1 3.97Å; V66-F97 HydrophobicContact CG1-CE1 3.7Å; V66-F97 WeakPolarHBondContact O-CE1 3.29Å; V66-K98 HydrophobicContact CG1-CD 4.07Å; V66-Y101 HydrophobicContact CG1-CD2 4.4Å; V66-Y101 HydrophobicContact CG2-CD1 4.23Å; V66-Y101 HydrophobicContact CG2-CD2 3.81Å; V66-Y101 HydrophobicContact CG2-CG 3.67Å; V66-V106 HydrophobicContact CG2-CG1 3.82Å
67K95.6Very high95.8Very high26 Ų2631.1 Ų31.111%0.11315%0.153CC..Hα-helixtrans-58.4-45.8175.7-178.3-178.964.4174.80112.2F63 K64 I65 Y69 V70 Y71 Q223 F314 Q315 V317F63-K67 WeakPolarHBondContact O-CB 3.38Å; F63-K67 PolarHBondContact O-N 3.25Å; K64-K67 WeakPolarHBondContact O-CB 3.25Å; K64-K67 PolarHBondContact O-N 3Å; I65-K67 VanDerWaalsContact C-N 3.28Å; I65-K67 PolarHBondContact O-N 3.34Å; K67-Y69 VanDerWaalsContact C-N 3.33Å; K67-Y69 PolarHBondContact O-N 3.16Å; K67-V70 PolarHBondContact O-N 3.41Å; K67-Y71 PolarHBondContact O-N 2.84Å; K67-Q223 HydrophobicContact CG-CB 4.1Å; K67-Q223 HydrophobicContact CG-CG 4.47Å; K67-F314 HydrophobicContact CD-CE1 3.58Å; K67-F314 HydrophobicContact CD-CZ 3.43Å; K67-F314 VanDerWaalsContact CD-CZ 3.43Å; K67-F314 HydrophobicContact CG-CE1 4.36Å; K67-F314 HydrophobicContact CG-CZ 4.16Å; K67-Q315 PolarHBondContact NZ-O 3.28Å; K67-V317 HydrophobicContact CD-CG2 4.09Å; K67-V317 HydrophobicContact CG-CG2 3.99Å
68H95.5Very high95.9Very high38 Ų3835.4 Ų35.418%0.17618%0.175CC..Hα-helixtrans-60.1-43.2176.7-17669.3000111.4K64 I65 V66 V70 Y71 L72 E327K64-H68 PolarHBondContact O-N 2.85Å; I65-H68 WeakPolarHBondContact O-CB 3.48Å; I65-H68 PolarHBondContact O-N 3.2Å; I65-H68 VanDerWaalsContact O-N 3.1Å; V66-H68 PolarHBondContact O-N 2.85Å; H68-V70 PolarHBondContact O-N 2.79Å; H68-Y71 WeakPolarHBondContact O-CB 3.24Å; H68-Y71 PolarHBondContact O-N 2.94Å; H68-Y71 VanDerWaalsContact O-N 3.13Å; H68-L72 WeakPolarHBondContact O-CG 3.47Å; H68-L72 PolarHBondContact O-N 2.64Å; H68-E327 IonicContact CD2-OE1 3.02Å; H68-E327 PolarHBondContact CD2-OE1 2.95Å; H68-E327 VanDerWaalsContact CD2-OE1 3.24Å; H68-E327 IonicContact NE2-OE1 3.14Å
69Y97.1Very high95.9Very high1 Ų137.2 Ų37.20%0.00418%0.18CC..Hα-helixtrans-72.5-26179.3-85.8-93.7000114.2I65 V66 K67 Y71 L72 M73 F97 P111 R112 M115 E327I65-Y69 HydrophobicContact CG2-CD2 3.92Å; I65-Y69 HydrophobicContact CG2-CE2 4.08Å; I65-Y69 WeakPolarHBondContact O-CD2 3.44Å; I65-Y69 PolarHBondContact O-N 3.35Å; V66-Y69 PolarHBondContact O-N 3.09Å; K67-Y69 VanDerWaalsContact C-N 3.33Å; K67-Y69 PolarHBondContact O-N 3.16Å; Y69-Y71 VanDerWaalsContact C-N 3.32Å; Y69-L72 HydrophobicContact CD1-CD1 3.93Å; Y69-L72 HydrophobicContact CE1-CD1 3.85Å; Y69-L72 HydrophobicContact CE2-CD1 4.47Å; Y69-L72 HydrophobicContact CG-CD1 4.26Å; Y69-L72 PolarHBondContact O-N 3.12Å; Y69-M73 WeakPolarHBondContact O-CB 3.26Å; Y69-M73 PolarHBondContact O-N 3.05Å; Y69-F97 HydrophobicContact CG-CZ 4.42Å; Y69-P111 HydrophobicContact CD1-CB 3.87Å; Y69-P111 HydrophobicContact CD1-CG 4.28Å; Y69-P111 HydrophobicContact CD2-CB 3.58Å; Y69-P111 HydrophobicContact CD2-CG 3.56Å; Y69-P111 HydrophobicContact CE1-CB 4.19Å; Y69-P111 HydrophobicContact CE1-CG 4.13Å; Y69-P111 HydrophobicContact CE2-CB 3.91Å; Y69-P111 HydrophobicContact CE2-CG 3.37Å; Y69-P111 HydrophobicContact CG-CB 3.55Å; Y69-P111 HydrophobicContact CG-CG 4.01Å; Y69-R112 HydrophobicContact CD1-CB 4.42Å; Y69-R112 HydrophobicContact CE1-CB 3.55Å; Y69-R112 HydrophobicContact CE1-CG 4.19Å; Y69-R112 PolarHBondContact OH-NH2 3.15Å; Y69-M115 HydrophobicContact CD1-SD 4.02Å; Y69-M115 VanDerWaalsContact O-SD 3.38Å; Y69-E327 VanDerWaalsContact CE2-OE1 3.29Å; Y69-E327 WeakPolarHBondContact CE2-OE1 3.41Å
70V97.8Very high95.9Very high0 Ų035.9 Ų35.90%017%0.171CC..Hα-helixtrans-62.5-42166.6171.20000110.7V66 K67 H68 M73 K74 Y90 F97 Q223V66-V70 WeakPolarHBondContact O-CG2 3.28Å; V66-V70 PolarHBondContact O-N 2.88Å; K67-V70 PolarHBondContact O-N 3.41Å; H68-V70 PolarHBondContact O-N 2.79Å; V70-M73 WeakPolarHBondContact O-CB 3.41Å; V70-M73 PolarHBondContact O-N 3.44Å; V70-K74 PolarHBondContact O-N 3.32Å; V70-K74 VanDerWaalsContact O-N 3.08Å; V70-Y90 WeakPolarHBondContact CG1-OH 3.47Å; V70-F97 HydrophobicContact CG2-CD1 3.69Å; V70-F97 HydrophobicContact CG2-CE1 4.09Å; V70-Q223 HydrophobicContact CG1-CG 4.22Å
71Y96.6Very high95.7Very high42 Ų4235.1 Ų35.117%0.16517%0.17CC..Hα-helixtrans-64.2-44.2174.4173.6-100.2000112.2K67 H68 Y69 M73 K74 I75 V317 T318 D319 L320K67-Y71 PolarHBondContact O-N 2.84Å; H68-Y71 WeakPolarHBondContact O-CB 3.24Å; H68-Y71 PolarHBondContact O-N 2.94Å; H68-Y71 VanDerWaalsContact O-N 3.13Å; Y69-Y71 VanDerWaalsContact C-N 3.32Å; Y71-M73 VanDerWaalsContact C-N 3.3Å; Y71-M73 PolarHBondContact O-N 3.35Å; Y71-K74 WeakPolarHBondContact O-CB 3.37Å; Y71-K74 PolarHBondContact O-N 2.89Å; Y71-K74 VanDerWaalsContact O-N 3.15Å; Y71-I75 HydrophobicContact CD1-CD1 3.85Å; Y71-I75 HydrophobicContact CE1-CD1 3.29Å; Y71-I75 HydrophobicContact CE1-CG1 4.35Å; Y71-I75 HydrophobicContact CE2-CD1 4.39Å; Y71-I75 PolarHBondContact O-N 3.34Å; Y71-I75 VanDerWaalsContact O-N 3.11Å; Y71-V317 HydrophobicContact CD1-CG1 3.74Å; Y71-V317 HydrophobicContact CD2-CG1 4.35Å; Y71-V317 WeakPolarHBondContact CD2-O 3.48Å; Y71-V317 HydrophobicContact CE1-CG1 4.23Å; Y71-V317 HydrophobicContact CG-CB 4.25Å; Y71-V317 HydrophobicContact CG-CG1 3.8Å; Y71-T318 PolarHBondContact OH-O 3.47Å; Y71-D319 WeakPolarHBondContact OH-CA 3.46Å; Y71-D319 PolarHBondContact OH-N 3.45Å; Y71-L320 HydrophobicContact CD1-CD2 4.35Å; Y71-L320 HydrophobicContact CE1-CD2 3.81Å; Y71-L320 HydrophobicContact CE1-CG 4.06Å
72L95.9Very high95.4Very high24 Ų2438.6 Ų38.613%0.12619%0.194CC..Hα-helixtrans-61.2-37.8173.8-64.5-176.8000112.6H68 Y69 K74 I75 L76 M115 L320H68-L72 WeakPolarHBondContact O-CG 3.47Å; H68-L72 PolarHBondContact O-N 2.64Å; Y69-L72 HydrophobicContact CD1-CD1 3.93Å; Y69-L72 HydrophobicContact CE1-CD1 3.85Å; Y69-L72 HydrophobicContact CE2-CD1 4.47Å; Y69-L72 HydrophobicContact CG-CD1 4.26Å; Y69-L72 PolarHBondContact O-N 3.12Å; L72-K74 VanDerWaalsContact C-N 3.29Å; L72-K74 PolarHBondContact O-N 3.45Å; L72-I75 PolarHBondContact O-N 3.11Å; L72-L76 PolarHBondContact O-N 3.47Å; L72-M115 HydrophobicContact CB-SD 4.03Å; L72-L320 HydrophobicContact CD2-CD2 3.24Å
73M97.5Very high95.2Very high0 Ų039.9 Ų39.90%020%0.204CC..Hα-helixtrans-59.2-43.3175-171.4-174.4-74.900110.4Y69 V70 Y71 L76 F77 Y90 A93 F97 M115 C118Y69-M73 WeakPolarHBondContact O-CB 3.26Å; Y69-M73 PolarHBondContact O-N 3.05Å; V70-M73 WeakPolarHBondContact O-CB 3.41Å; V70-M73 PolarHBondContact O-N 3.44Å; Y71-M73 VanDerWaalsContact C-N 3.3Å; Y71-M73 PolarHBondContact O-N 3.35Å; M73-L76 PolarHBondContact O-N 2.78Å; M73-F77 VanDerWaalsContact O-CB 3.29Å; M73-F77 WeakPolarHBondContact O-CB 3.34Å; M73-F77 PolarHBondContact O-N 2.71Å; M73-Y90 HydrophobicContact CB-CE2 4.41Å; M73-Y90 HydrophobicContact CG-CD2 4.44Å; M73-Y90 HydrophobicContact CG-CE2 4.27Å; M73-Y90 HydrophobicContact SD-CD2 4.41Å; M73-Y90 HydrophobicContact SD-CE2 4.31Å; M73-A93 HydrophobicContact CE-CB 4.27Å; M73-A93 HydrophobicContact SD-CB 3.53Å; M73-A93 VanDerWaalsContact SD-CB 3.53Å; M73-F97 HydrophobicContact CE-CB 3.85Å; M73-F97 HydrophobicContact CE-CD2 4.08Å; M73-F97 HydrophobicContact CE-CG 3.96Å; M73-M115 VanDerWaalsContact CA-SD 3.55Å; M73-M115 HydrophobicContact CB-CG 3.64Å; M73-M115 HydrophobicContact CB-SD 3.78Å; M73-M115 HydrophobicContact CE-CB 4.12Å; M73-M115 HydrophobicContact CE-CG 3.48Å; M73-M115 VanDerWaalsContact CE-CG 3.48Å; M73-M115 HydrophobicContact CG-CG 3.87Å; M73-M115 HydrophobicContact CG-SD 4.5Å; M73-M115 PolarHBondContact N-SD 3.47Å; M73-M115 VanDerWaalsContact N-SD 3.39Å; M73-C118 HydrophobicContact CE-CB 4.16Å
74K97.2Very high95.1Very high33 Ų3345.6 Ų45.614%0.14323%0.231CC..Hα-helixtrans-63.5-43.9177.9-175.455.817178.20112V70 Y71 L72 L76 F77 D78 Y90 N219V70-K74 PolarHBondContact O-N 3.32Å; V70-K74 VanDerWaalsContact O-N 3.08Å; Y71-K74 WeakPolarHBondContact O-CB 3.37Å; Y71-K74 PolarHBondContact O-N 2.89Å; Y71-K74 VanDerWaalsContact O-N 3.15Å; L72-K74 VanDerWaalsContact C-N 3.29Å; L72-K74 PolarHBondContact O-N 3.45Å; K74-L76 VanDerWaalsContact C-N 3.29Å; K74-L76 PolarHBondContact O-N 2.9Å; K74-F77 HydrophobicContact CD-CD1 4.12Å; K74-F77 WeakPolarHBondContact O-CB 3.06Å; K74-F77 PolarHBondContact O-N 3.31Å; K74-D78 IonicContact NZ-OD1 2.66Å; K74-D78 PolarHBondContact NZ-OD1 3.25Å; K74-D78 IonicContact NZ-OD2 3.41Å; K74-D78 PolarHBondContact NZ-OD2 3.43Å; K74-D78 PolarHBondContact O-N 3.03Å; K74-Y90 HydrophobicContact CB-CE2 3.7Å; K74-Y90 HydrophobicContact CD-CD1 4.43Å; K74-Y90 HydrophobicContact CD-CD2 4.06Å; K74-Y90 HydrophobicContact CD-CE1 4.23Å; K74-Y90 HydrophobicContact CD-CE2 3.84Å; K74-Y90 HydrophobicContact CD-CG 4.34Å; K74-Y90 HydrophobicContact CG-CE2 4.33Å; K74-N219 HydrophobicContact CD-CB 4.33Å; K74-N219 VanDerWaalsContact CE-CG 3.42Å; K74-N219 WeakPolarHBondContact CE-ND2 3.3Å
75I95.7Very high95.2Very high46 Ų4641.5 Ų41.524%0.23621%0.214CC..Hα-helixtrans-60.1-41.6175.6-69167.6000111Y71 L72 K79 L320Y71-I75 HydrophobicContact CD1-CD1 3.85Å; Y71-I75 HydrophobicContact CE1-CD1 3.29Å; Y71-I75 HydrophobicContact CE1-CG1 4.35Å; Y71-I75 HydrophobicContact CE2-CD1 4.39Å; Y71-I75 PolarHBondContact O-N 3.34Å; Y71-I75 VanDerWaalsContact O-N 3.11Å; L72-I75 PolarHBondContact O-N 3.11Å; I75-K79 WeakPolarHBondContact O-CG 3.39Å; I75-L320 HydrophobicContact CD1-CD1 4.04Å; I75-L320 HydrophobicContact CD1-CD2 3.68Å; I75-L320 HydrophobicContact CD1-CG 3.86Å
76L95.2Very high95.2Very high18 Ų1843.7 Ų43.79%0.09423%0.228CC..Hα-helixtrans-67-45.7176.4175.662.3000111.3L72 M73 K74 D78 K79 F80 M115 L116 L119 I139L72-L76 PolarHBondContact O-N 3.47Å; M73-L76 PolarHBondContact O-N 2.78Å; K74-L76 VanDerWaalsContact C-N 3.29Å; K74-L76 PolarHBondContact O-N 2.9Å; L76-D78 VanDerWaalsContact C-N 3.25Å; L76-D78 PolarHBondContact O-N 3.3Å; L76-K79 WeakPolarHBondContact O-CB 3.49Å; L76-K79 PolarHBondContact O-N 2.64Å; L76-F80 HydrophobicContact CD1-CE2 4.2Å; L76-F80 HydrophobicContact CG-CE2 4.09Å; L76-F80 VanDerWaalsContact O-CD2 3.3Å; L76-F80 WeakPolarHBondContact O-CD2 3.42Å; L76-M115 HydrophobicContact CD2-CE 4.11Å; L76-L116 HydrophobicContact CD2-CD2 3.28Å; L76-L119 HydrophobicContact CD2-CD2 4.02Å; L76-L119 HydrophobicContact CG-CD2 4.21Å; L76-I139 HydrophobicContact CD1-CG1 4.46Å
77F96.9Very high95.2Very high10 Ų1046.3 Ų46.34%0.04424%0.242CC..Hα-helixtrans-53.4-43.3176.7171.9-90.5000111.3M73 K74 K79 F80 L85 P86 V89 Y90 L119M73-F77 VanDerWaalsContact O-CB 3.29Å; M73-F77 WeakPolarHBondContact O-CB 3.34Å; M73-F77 PolarHBondContact O-N 2.71Å; K74-F77 HydrophobicContact CD-CD1 4.12Å; K74-F77 WeakPolarHBondContact O-CB 3.06Å; K74-F77 PolarHBondContact O-N 3.31Å; F77-K79 PolarHBondContact O-N 3.31Å; F77-F80 WeakPolarHBondContact O-CB 3.06Å; F77-F80 PolarHBondContact O-N 3.01Å; F77-F80 VanDerWaalsContact O-N 3.08Å; F77-L85 HydrophobicContact CD2-CB 4.01Å; F77-L85 HydrophobicContact CD2-CD1 3.77Å; F77-L85 HydrophobicContact CE2-CB 3.38Å; F77-L85 HydrophobicContact CE2-CD1 4Å; F77-L85 HydrophobicContact CE2-CG 4.35Å; F77-L85 HydrophobicContact CZ-CB 3.92Å; F77-P86 WeakPolarHBondContact CE2-O 3.49Å; F77-P86 WeakPolarHBondContact CZ-O 3.37Å; F77-V89 HydrophobicContact CE2-CB 4.25Å; F77-Y90 HydrophobicContact CB-CD2 4.23Å; F77-Y90 HydrophobicContact CD2-CD2 4.49Å; F77-Y90 HydrophobicContact CG-CD2 4.23Å; F77-Y90 HydrophobicContact CG-CG 4.49Å; F77-L119 HydrophobicContact CD2-CD1 4.2Å
78D95.3Very high95.3Very high90 Ų9047.6 Ų47.648%0.48125%0.248SC..THydrogen-bonded Turntrans-67.8-16.5178.9-70.4-25.8000114.4K74 L76 F80K74-D78 IonicContact NZ-OD1 2.66Å; K74-D78 PolarHBondContact NZ-OD1 3.25Å; K74-D78 IonicContact NZ-OD2 3.41Å; K74-D78 PolarHBondContact NZ-OD2 3.43Å; K74-D78 PolarHBondContact O-N 3.03Å; L76-D78 VanDerWaalsContact C-N 3.25Å; L76-D78 PolarHBondContact O-N 3.3Å; D78-F80 VanDerWaalsContact C-N 3.3Å
79K93.9Very high95.5Very high106 Ų10645.8 Ų45.846%0.46124%0.24SC..THydrogen-bonded Turntrans-77.9-16.5174.1-67176.6-178.6-178.30112.7I75 L76 F77 T81I75-K79 WeakPolarHBondContact O-CG 3.39Å; L76-K79 WeakPolarHBondContact O-CB 3.49Å; L76-K79 PolarHBondContact O-N 2.64Å; F77-K79 PolarHBondContact O-N 3.31Å; K79-T81 PolarHBondContact O-N 2.98Å
80F94.5Very high95.5Very high6 Ų645.8 Ų45.83%0.02624%0.24CC..  trans-7493.9174.9-73.5-96.2000109.7L76 F77 D78 P83 Q84 L85 L119 I130 F135 H138L76-F80 HydrophobicContact CD1-CE2 4.2Å; L76-F80 HydrophobicContact CG-CE2 4.09Å; L76-F80 VanDerWaalsContact O-CD2 3.3Å; L76-F80 WeakPolarHBondContact O-CD2 3.42Å; F77-F80 WeakPolarHBondContact O-CB 3.06Å; F77-F80 PolarHBondContact O-N 3.01Å; F77-F80 VanDerWaalsContact O-N 3.08Å; D78-F80 VanDerWaalsContact C-N 3.3Å; F80-P83 CarbonylContact C-O 3.59Å; F80-Q84 WeakPolarHBondContact O-CA 3.47Å; F80-L85 HydrophobicContact CB-CB 4.42Å; F80-L85 HydrophobicContact CB-CD1 3.72Å; F80-L85 HydrophobicContact CB-CG 3.61Å; F80-L85 HydrophobicContact CD1-CD1 3.84Å; F80-L85 HydrophobicContact CD1-CD2 4.45Å; F80-L85 HydrophobicContact CD1-CG 4.06Å; F80-L85 HydrophobicContact CD2-CD1 3.67Å; F80-L85 HydrophobicContact CD2-CG 4.49Å; F80-L85 HydrophobicContact CE1-CD1 4.39Å; F80-L85 HydrophobicContact CE2-CD1 4.25Å; F80-L85 HydrophobicContact CG-CD1 3.45Å; F80-L85 VanDerWaalsContact CG-CD1 3.45Å; F80-L85 HydrophobicContact CG-CG 3.81Å; F80-L119 HydrophobicContact CE2-CD2 3.94Å; F80-I130 HydrophobicContact CD1-CD1 4.46Å; F80-I130 HydrophobicContact CE1-CD1 3.95Å; F80-F135 AromaticContact CE1-CD2 3.68Å; F80-F135 HydrophobicContact CE1-CD2 3.68Å; F80-F135 HydrophobicContact CE1-CE2 4.21Å; F80-F135 HydrophobicContact CE2-CD2 4.49Å; F80-F135 HydrophobicContact CE2-CE2 4.23Å; F80-F135 AromaticContact CZ-CD2 3.38Å; F80-F135 HydrophobicContact CZ-CD2 3.38Å; F80-F135 AromaticContact CZ-CE2 3.49Å; F80-F135 HydrophobicContact CZ-CE2 3.49Å; F80-F135 VanDerWaalsContact CZ-CE2 3.49Å; F80-F135 HydrophobicContact CZ-CG 4.35Å; F80-F135 HydrophobicContact CZ-CZ 4.49Å; F80-H138 HydrophobicContact CD1-CB 4.31Å; F80-H138 AromaticContact CD1-CD2 3.97Å; F80-H138 AromaticContact CD1-CE1 3.96Å; F80-H138 AromaticContact CD1-CG 3.76Å; F80-H138 AromaticContact CD1-ND1 3.76Å; F80-H138 HydrophobicContact CE1-CB 3.88Å; F80-H138 AromaticContact CE1-CG 3.68Å; F80-H138 AromaticContact CE1-ND1 3.59Å; F80-H138 HydrophobicContact CE2-CB 4.18Å; F80-H138 HydrophobicContact CZ-CB 3.8Å
81T90.6Very high95.6Very high102 Ų10245.8 Ų45.863%0.62624%0.24SC*.BIsolated β-bridgetrans-107.2-26.9177.153.50000112K79 P83 Q84K79-T81 PolarHBondContact O-N 2.98Å; T81-P83 VanDerWaalsContact C-C 3.49Å; T81-P83 CarbonylContact O-C 2.92Å; T81-Q84 PolarHBondContact O-N 2.91Å
82T89.8Confident95.6Very high112 Ų11244 Ų4469%0.68723%0.233SC*.THydrogen-bonded Turntrans-136.687.3179.4-51.60000110.2H138T82-H138 PolarHBondContact O-CE1 2.93Å; T82-H138 VanDerWaalsContact O-CE1 3.23Å; T82-H138 PolarHBondContact O-NE2 3.17Å
83P90.8Very high95.8Very high41 Ų4142.9 Ų42.927%0.26623%0.227SC..THydrogen-bonded Turncis-81.1155.42.233.4-35.3000113.3F80 T81 F128 I130F80-P83 CarbonylContact C-O 3.59Å; T81-P83 VanDerWaalsContact C-C 3.49Å; T81-P83 CarbonylContact O-C 2.92Å; P83-F128 HydrophobicContact CB-CE1 3.98Å; P83-F128 HydrophobicContact CB-CZ 3.91Å; P83-F128 HydrophobicContact CG-CE1 3.9Å; P83-F128 HydrophobicContact CG-CZ 4.33Å; P83-I130 HydrophobicContact CG-CG2 3.8Å
84Q94.7Very high95.8Very high157 Ų15742.9 Ų42.973%0.73423%0.227SC*.BIsolated β-bridgetrans-73.5125.5168.6-175.8176.51.200110F80 T81 F128F80-Q84 WeakPolarHBondContact O-CA 3.47Å; T81-Q84 PolarHBondContact O-N 2.91Å; Q84-F128 WeakPolarHBondContact O-CZ 3.29Å
85L96.2Very high95.9Very high8 Ų841.4 Ų41.44%0.04222%0.221CC..PPolyproline II helixtrans-79.4137.7178.7-65.1177.7000111.4F77 F80 V89 L119 F128 I130F77-L85 HydrophobicContact CD2-CB 4.01Å; F77-L85 HydrophobicContact CD2-CD1 3.77Å; F77-L85 HydrophobicContact CE2-CB 3.38Å; F77-L85 HydrophobicContact CE2-CD1 4Å; F77-L85 HydrophobicContact CE2-CG 4.35Å; F77-L85 HydrophobicContact CZ-CB 3.92Å; F80-L85 HydrophobicContact CB-CB 4.42Å; F80-L85 HydrophobicContact CB-CD1 3.72Å; F80-L85 HydrophobicContact CB-CG 3.61Å; F80-L85 HydrophobicContact CD1-CD1 3.84Å; F80-L85 HydrophobicContact CD1-CD2 4.45Å; F80-L85 HydrophobicContact CD1-CG 4.06Å; F80-L85 HydrophobicContact CD2-CD1 3.67Å; F80-L85 HydrophobicContact CD2-CG 4.49Å; F80-L85 HydrophobicContact CE1-CD1 4.39Å; F80-L85 HydrophobicContact CE2-CD1 4.25Å; F80-L85 HydrophobicContact CG-CD1 3.45Å; F80-L85 VanDerWaalsContact CG-CD1 3.45Å; F80-L85 HydrophobicContact CG-CG 3.81Å; L85-V89 HydrophobicContact CD1-CG1 4.25Å; L85-L119 HydrophobicContact CD1-CD1 4.45Å; L85-F128 HydrophobicContact CD2-CD1 3.61Å; L85-F128 HydrophobicContact CD2-CE1 3.7Å; L85-I130 HydrophobicContact CD2-CD1 4.37Å
86P96.7Very high96Very high50 Ų5039.2 Ų39.233%0.32521%0.21SC..PPolyproline II helixtrans-63.6149.9169.3-21.632.9000112.3F77 E88 V89 F128F77-P86 WeakPolarHBondContact CE2-O 3.49Å; F77-P86 WeakPolarHBondContact CZ-O 3.37Å; P86-E88 PolarHBondContact O-N 2.92Å; P86-V89 HydrophobicContact CB-CG2 4.5Å; P86-V89 HydrophobicContact CG-CG2 4.45Å; P86-V89 WeakPolarHBondContact O-CB 3.42Å; P86-V89 PolarHBondContact O-N 3.32Å; P86-F128 HydrophobicContact CG-CB 4.38Å; P86-F128 HydrophobicContact CG-CD2 3.79Å; P86-F128 HydrophobicContact CG-CE2 4.21Å; P86-F128 HydrophobicContact CG-CG 4.03Å
87N97.1Very high96.2Very high63 Ų6338.3 Ų38.334%0.33721%0.205SC..Hα-helixtrans-57.7-32.4176.6-66.3-45.5000112.8V89 Y90 G91 Y171N87-V89 PolarHBondContact O-N 3.23Å; N87-Y90 PolarHBondContact O-N 3.26Å; N87-G91 PolarHBondContact O-N 3.36Å; N87-G91 VanDerWaalsContact O-N 3.08Å; N87-Y171 HydrophobicContact CB-CD1 3.96Å; N87-Y171 HydrophobicContact CB-CD2 4.07Å; N87-Y171 HydrophobicContact CB-CE1 3.92Å; N87-Y171 HydrophobicContact CB-CE2 4.09Å; N87-Y171 HydrophobicContact CB-CG 4.02Å; N87-Y171 WeakPolarHBondContact O-CE2 3.33Å
88E97.3Very high96.3Very high52 Ų5238 Ų3824%0.24320%0.204CC..Hα-helixtrans-52.6-41.1174.5-67.1-60151.600112.2P86 Y90 G91 F92 A126 T169P86-E88 PolarHBondContact O-N 2.92Å; E88-Y90 VanDerWaalsContact C-N 3.3Å; E88-Y90 PolarHBondContact O-N 3.1Å; E88-G91 PolarHBondContact O-N 3.35Å; E88-G91 VanDerWaalsContact O-N 3.11Å; E88-F92 WeakPolarHBondContact O-CD2 3.33Å; E88-F92 PolarHBondContact O-N 3.24Å; E88-A126 HydrophobicContact CB-CB 4.41Å; E88-T169 PolarHBondContact OE1-OG1 3.31Å; E88-T169 WeakPolarHBondContact OE2-CB 3.44Å; E88-T169 WeakPolarHBondContact OE2-CG2 3.4Å; E88-T169 PolarHBondContact OE2-OG1 3.08Å
89V98.3Very high96.4Very high0 Ų033.8 Ų33.80%018%0.181CC..Hα-helixtrans-59.5-42.5178.71750000110.9F77 L85 P86 N87 F92 A93 L119 A122 A126 F128F77-V89 HydrophobicContact CE2-CB 4.25Å; L85-V89 HydrophobicContact CD1-CG1 4.25Å; P86-V89 HydrophobicContact CB-CG2 4.5Å; P86-V89 HydrophobicContact CG-CG2 4.45Å; P86-V89 WeakPolarHBondContact O-CB 3.42Å; P86-V89 PolarHBondContact O-N 3.32Å; N87-V89 PolarHBondContact O-N 3.23Å; V89-F92 PolarHBondContact O-N 3.44Å; V89-A93 VanDerWaalsContact O-CB 3.29Å; V89-A93 WeakPolarHBondContact O-CB 3.43Å; V89-A93 PolarHBondContact O-N 2.79Å; V89-L119 HydrophobicContact CG1-CD1 3.96Å; V89-A122 HydrophobicContact CG1-CB 4.17Å; V89-A122 WeakPolarHBondContact O-CB 3.49Å; V89-A126 HydrophobicContact CG2-CB 4Å; V89-F128 HydrophobicContact CG2-CB 4.08Å
90Y98.4Very high96.6Very high2 Ų228.7 Ų28.71%0.00816%0.159CC..Hα-helixtrans-67-41.4176.5178.5-102.1000111.7V70 M73 K74 F77 N87 E88 F92 A93 A94 Y171 N219 Y222V70-Y90 WeakPolarHBondContact CG1-OH 3.47Å; M73-Y90 HydrophobicContact CB-CE2 4.41Å; M73-Y90 HydrophobicContact CG-CD2 4.44Å; M73-Y90 HydrophobicContact CG-CE2 4.27Å; M73-Y90 HydrophobicContact SD-CD2 4.41Å; M73-Y90 HydrophobicContact SD-CE2 4.31Å; K74-Y90 HydrophobicContact CB-CE2 3.7Å; K74-Y90 HydrophobicContact CD-CD1 4.43Å; K74-Y90 HydrophobicContact CD-CD2 4.06Å; K74-Y90 HydrophobicContact CD-CE1 4.23Å; K74-Y90 HydrophobicContact CD-CE2 3.84Å; K74-Y90 HydrophobicContact CD-CG 4.34Å; K74-Y90 HydrophobicContact CG-CE2 4.33Å; F77-Y90 HydrophobicContact CB-CD2 4.23Å; F77-Y90 HydrophobicContact CD2-CD2 4.49Å; F77-Y90 HydrophobicContact CG-CD2 4.23Å; F77-Y90 HydrophobicContact CG-CG 4.49Å; N87-Y90 PolarHBondContact O-N 3.26Å; E88-Y90 VanDerWaalsContact C-N 3.3Å; E88-Y90 PolarHBondContact O-N 3.1Å; Y90-F92 VanDerWaalsContact C-N 3.32Å; Y90-F92 PolarHBondContact O-N 3.03Å; Y90-A93 PolarHBondContact O-N 3.16Å; Y90-A94 HydrophobicContact CE1-CB 4.43Å; Y90-A94 WeakPolarHBondContact O-CB 3.24Å; Y90-A94 PolarHBondContact O-N 3.3Å; Y90-Y171 WeakPolarHBondContact CD1-OH 3.48Å; Y90-N219 WeakPolarHBondContact CD1-OD1 3.33Å; Y90-N219 HydrophobicContact CE1-CB 4.19Å; Y90-N219 PolarHBondContact OH-O 3.29Å; Y90-Y222 HydrophobicContact CD1-CD2 4.22Å; Y90-Y222 AromaticContact CE1-CD2 3.83Å; Y90-Y222 HydrophobicContact CE1-CD2 3.83Å; Y90-Y222 HydrophobicContact CE1-CG 4.21Å
91G98.4Very high96.8Very high0 Ų029 Ų290%016%0.16CC..Hα-helixtrans-61.1-40.5177.400000112.9N87 E88 T95 Y222N87-G91 PolarHBondContact O-N 3.36Å; N87-G91 VanDerWaalsContact O-N 3.08Å; E88-G91 PolarHBondContact O-N 3.35Å; E88-G91 VanDerWaalsContact O-N 3.11Å; G91-T95 VanDerWaalsContact O-CB 3.28Å; G91-T95 WeakPolarHBondContact O-CB 3.38Å; G91-T95 PolarHBondContact O-N 3.18Å; G91-T95 PolarHBondContact O-OG1 3.22Å; G91-Y222 VanDerWaalsContact CA-CZ 3.49Å; G91-Y222 VanDerWaalsContact CA-OH 3.25Å; G91-Y222 WeakPolarHBondContact CA-OH 3.45Å
92F98.6Very high97.1Very high5 Ų524.3 Ų24.32%0.02213%0.131CC..Hα-helixtrans-63.8-51.5172.5-84.7-121.9000110.9E88 V89 Y90 A94 T95 Y96 A122 A125 A126 L165 W166 V167 T169E88-F92 WeakPolarHBondContact O-CD2 3.33Å; E88-F92 PolarHBondContact O-N 3.24Å; V89-F92 PolarHBondContact O-N 3.44Å; Y90-F92 VanDerWaalsContact C-N 3.32Å; Y90-F92 PolarHBondContact O-N 3.03Å; F92-A94 PolarHBondContact O-N 3.39Å; F92-T95 PolarHBondContact O-N 3.44Å; F92-Y96 HydrophobicContact CB-CE2 4.33Å; F92-Y96 HydrophobicContact CD1-CE2 4.48Å; F92-Y96 AromaticContact CD1-CZ 3.94Å; F92-Y96 PolarHBondContact O-N 3.22Å; F92-A122 HydrophobicContact CB-CB 3.65Å; F92-A125 HydrophobicContact CD1-CB 3.86Å; F92-A125 HydrophobicContact CE1-CB 4.03Å; F92-A126 HydrophobicContact CD1-CB 4.32Å; F92-A126 HydrophobicContact CD2-CB 4.2Å; F92-A126 HydrophobicContact CE1-CB 4.45Å; F92-A126 HydrophobicContact CE2-CB 4.32Å; F92-A126 HydrophobicContact CG-CB 4.19Å; F92-A126 HydrophobicContact CZ-CB 4.44Å; F92-L165 WeakPolarHBondContact CE1-O 3.41Å; F92-W166 HydrophobicContact CZ-CE3 4.26Å; F92-W166 HydrophobicContact CZ-CZ3 4.37Å; F92-V167 HydrophobicContact CD1-CB 4.14Å; F92-V167 HydrophobicContact CD1-CG2 4.18Å; F92-V167 HydrophobicContact CD2-CB 3.96Å; F92-V167 HydrophobicContact CE1-CB 4.18Å; F92-V167 HydrophobicContact CE1-CG2 4.47Å; F92-V167 HydrophobicContact CE2-CB 4Å; F92-V167 WeakPolarHBondContact CE2-O 3.47Å; F92-V167 HydrophobicContact CG-CB 4.05Å; F92-V167 HydrophobicContact CG-CG2 4.31Å; F92-V167 HydrophobicContact CZ-CB 4.12Å; F92-V167 VanDerWaalsContact CZ-O 3.28Å; F92-V167 WeakPolarHBondContact CZ-O 3.13Å; F92-T169 HydrophobicContact CD2-CG2 3.74Å; F92-T169 HydrophobicContact CE2-CG2 3.94Å
93A98.7Very high97.4Very high0 Ų022.9 Ų22.90%012%0.119CC..Hα-helixtrans-60.7-47.6-176.400000112.8M73 V89 Y90 T95 Y96 F97 L119 A122M73-A93 HydrophobicContact CE-CB 4.27Å; M73-A93 HydrophobicContact SD-CB 3.53Å; M73-A93 VanDerWaalsContact SD-CB 3.53Å; V89-A93 VanDerWaalsContact O-CB 3.29Å; V89-A93 WeakPolarHBondContact O-CB 3.43Å; V89-A93 PolarHBondContact O-N 2.79Å; Y90-A93 PolarHBondContact O-N 3.16Å; A93-T95 VanDerWaalsContact C-N 3.31Å; A93-T95 PolarHBondContact O-N 3.4Å; A93-Y96 PolarHBondContact O-N 3.17Å; A93-F97 WeakPolarHBondContact O-CB 3.38Å; A93-F97 PolarHBondContact O-N 3.03Å; A93-L119 HydrophobicContact CB-CB 4.29Å; A93-L119 HydrophobicContact CB-CD1 3.85Å; A93-A122 HydrophobicContact CB-CB 3.69Å
94A98.6Very high97.7Very high0 Ų022.5 Ų22.50%011%0.114CC..Hα-helixtrans-62.5-40177.500000111.3Y90 F92 F97 K98 Y222Y90-A94 HydrophobicContact CE1-CB 4.43Å; Y90-A94 WeakPolarHBondContact O-CB 3.24Å; Y90-A94 PolarHBondContact O-N 3.3Å; F92-A94 PolarHBondContact O-N 3.39Å; A94-F97 PolarHBondContact O-N 3.02Å; A94-K98 WeakPolarHBondContact O-CB 3.28Å; A94-K98 VanDerWaalsContact O-CG 3.31Å; A94-K98 WeakPolarHBondContact O-CG 3.38Å; A94-K98 PolarHBondContact O-N 3.06Å; A94-Y222 HydrophobicContact CB-CD1 3.72Å; A94-Y222 HydrophobicContact CB-CE1 4.28Å; A94-Y222 HydrophobicContact CB-CG 3.98Å
95T98.5Very high97.8Very high1 Ų115 Ų151%0.0068%0.079CC..Hα-helixtrans-66.1-46.3177.1-57.40000111.5G91 F92 A93 F97 K98 R99 V167G91-T95 VanDerWaalsContact O-CB 3.28Å; G91-T95 WeakPolarHBondContact O-CB 3.38Å; G91-T95 PolarHBondContact O-N 3.18Å; G91-T95 PolarHBondContact O-OG1 3.22Å; F92-T95 PolarHBondContact O-N 3.44Å; A93-T95 VanDerWaalsContact C-N 3.31Å; A93-T95 PolarHBondContact O-N 3.4Å; T95-F97 VanDerWaalsContact C-N 3.32Å; T95-F97 PolarHBondContact O-N 3.2Å; T95-K98 PolarHBondContact O-N 3.17Å; T95-R99 HydrophobicContact CG2-CG 4.29Å; T95-R99 WeakPolarHBondContact O-CB 3.02Å; T95-R99 VanDerWaalsContact O-CG 3.25Å; T95-R99 WeakPolarHBondContact O-CG 3.15Å; T95-R99 PolarHBondContact O-N 3.36Å; T95-V167 HydrophobicContact CG2-CG1 3.89Å; T95-V167 HydrophobicContact CG2-CG2 4.04Å
96Y98.7Very high97.9Very high0 Ų014.6 Ų14.60%08%0.077CC..Hα-helixtrans-58.7-44.3175.5-65.5-19.8000112.2F92 A93 K98 R99 F100 V121 A122 A125 L161 L165 V167F92-Y96 HydrophobicContact CB-CE2 4.33Å; F92-Y96 HydrophobicContact CD1-CE2 4.48Å; F92-Y96 AromaticContact CD1-CZ 3.94Å; F92-Y96 PolarHBondContact O-N 3.22Å; A93-Y96 PolarHBondContact O-N 3.17Å; Y96-K98 PolarHBondContact O-N 3.06Å; Y96-R99 PolarHBondContact O-N 2.88Å; Y96-F100 VanDerWaalsContact O-CB 3.3Å; Y96-F100 WeakPolarHBondContact O-CB 3.13Å; Y96-F100 PolarHBondContact O-N 3.2Å; Y96-V121 HydrophobicContact CE2-CG1 4Å; Y96-A122 HydrophobicContact CD2-CB 4.27Å; Y96-A122 HydrophobicContact CE2-CB 4.07Å; Y96-A125 HydrophobicContact CE2-CB 4.44Å; Y96-A125 WeakPolarHBondContact OH-CB 3.29Å; Y96-L161 HydrophobicContact CD1-CD1 3.65Å; Y96-L161 HydrophobicContact CD2-CD1 4.38Å; Y96-L161 HydrophobicContact CE1-CD1 4.17Å; Y96-L161 HydrophobicContact CG-CD1 3.75Å; Y96-L165 HydrophobicContact CE1-CD2 4.42Å; Y96-L165 WeakPolarHBondContact OH-CA 3.41Å; Y96-L165 WeakPolarHBondContact OH-CB 3.02Å; Y96-L165 PolarHBondContact OH-O 3.39Å; Y96-V167 HydrophobicContact CD1-CG2 4.24Å; Y96-V167 HydrophobicContact CE1-CG2 3.72Å
97F98.7Very high97.8Very high0 Ų012.2 Ų12.20%06%0.061CC..Hα-helixtrans-60.1-46.4178.2-168.1-106.6000111.5V66 Y69 V70 M73 A93 A94 T95 F100 Y101 P111 I114 M115 C118V66-F97 HydrophobicContact CB-CE1 4.32Å; V66-F97 HydrophobicContact CG1-CD1 3.97Å; V66-F97 HydrophobicContact CG1-CE1 3.7Å; V66-F97 WeakPolarHBondContact O-CE1 3.29Å; Y69-F97 HydrophobicContact CG-CZ 4.42Å; V70-F97 HydrophobicContact CG2-CD1 3.69Å; V70-F97 HydrophobicContact CG2-CE1 4.09Å; M73-F97 HydrophobicContact CE-CB 3.85Å; M73-F97 HydrophobicContact CE-CD2 4.08Å; M73-F97 HydrophobicContact CE-CG 3.96Å; A93-F97 WeakPolarHBondContact O-CB 3.38Å; A93-F97 PolarHBondContact O-N 3.03Å; A94-F97 PolarHBondContact O-N 3.02Å; T95-F97 VanDerWaalsContact C-N 3.32Å; T95-F97 PolarHBondContact O-N 3.2Å; F97-F100 PolarHBondContact O-N 2.85Å; F97-Y101 HydrophobicContact CD1-CD2 4.35Å; F97-Y101 HydrophobicContact CD2-CD2 4.28Å; F97-Y101 AromaticContact CD2-CE2 3.88Å; F97-Y101 HydrophobicContact CD2-CE2 3.88Å; F97-Y101 HydrophobicContact CE1-CD2 4.15Å; F97-Y101 HydrophobicContact CE1-CE2 4.13Å; F97-Y101 HydrophobicContact CE2-CD2 4.08Å; F97-Y101 AromaticContact CE2-CE2 3.38Å; F97-Y101 HydrophobicContact CE2-CE2 3.38Å; F97-Y101 HydrophobicContact CG-CD2 4.41Å; F97-Y101 HydrophobicContact CG-CE2 4.44Å; F97-Y101 AromaticContact CZ-CD2 3.99Å; F97-Y101 HydrophobicContact CZ-CD2 3.99Å; F97-Y101 AromaticContact CZ-CE2 3.5Å; F97-Y101 HydrophobicContact CZ-CE2 3.5Å; F97-Y101 VanDerWaalsContact O-CD2 3.29Å; F97-Y101 WeakPolarHBondContact O-CD2 3.33Å; F97-Y101 PolarHBondContact O-N 2.9Å; F97-P111 HydrophobicContact CE2-CB 4.49Å; F97-P111 WeakPolarHBondContact CE2-O 3.37Å; F97-P111 HydrophobicContact CZ-CB 3.95Å; F97-I114 HydrophobicContact CD2-CG2 4.01Å; F97-I114 HydrophobicContact CE2-CB 4.27Å; F97-I114 HydrophobicContact CE2-CG2 4.22Å; F97-M115 HydrophobicContact CD2-CB 4.11Å; F97-M115 HydrophobicContact CE2-CB 3.66Å; F97-M115 HydrophobicContact CZ-CB 4.33Å; F97-C118 HydrophobicContact CB-CB 4.44Å
98K98.3Very high97.6Very high4 Ų49.3 Ų9.32%0.0175%0.046CC..Hα-helixtrans-63.4-44.6176-72.5-74.4-168.4163.30112.4V66 A94 T95 Y96 Y101 L102 Q223 T224 D225 L228V66-K98 HydrophobicContact CG1-CD 4.07Å; A94-K98 WeakPolarHBondContact O-CB 3.28Å; A94-K98 VanDerWaalsContact O-CG 3.31Å; A94-K98 WeakPolarHBondContact O-CG 3.38Å; A94-K98 PolarHBondContact O-N 3.06Å; T95-K98 PolarHBondContact O-N 3.17Å; Y96-K98 PolarHBondContact O-N 3.06Å; K98-Y101 PolarHBondContact O-N 3.38Å; K98-L102 WeakPolarHBondContact O-CG 3.35Å; K98-L102 PolarHBondContact O-N 3.33Å; K98-Q223 PolarHBondContact NZ-O 3.39Å; K98-T224 WeakPolarHBondContact CE-O 3.23Å; K98-T224 PolarHBondContact NZ-O 3.16Å; K98-D225 IonicContact NZ-OD1 3.44Å; K98-D225 PolarHBondContact NZ-OD1 2.95Å; K98-L228 HydrophobicContact CB-CD1 4.11Å; K98-L228 HydrophobicContact CB-CG 4.49Å
99R98.2Very high97.5Very high0 Ų08.2 Ų8.20%04%0.04CC..Hα-helixtrans-62.5-43.3177.7-72.9-179.6-177174.37.8112.3Q7 W11 T95 Y96 Y101 L102 L161 D164 L228Q7-R99 VanDerWaalsContact CG-NH2 3.3Å; W11-R99 HydrophobicContact CD2-CB 4.39Å; W11-R99 VanDerWaalsContact CD2-CD 3.43Å; W11-R99 HydrophobicContact CD2-CG 3.76Å; W11-R99 HydrophobicContact CE3-CB 3.79Å; W11-R99 HydrophobicContact CE3-CG 3.4Å; W11-R99 HydrophobicContact CG-CG 4.31Å; W11-R99 VanDerWaalsContact CG-NE 3.33Å; W11-R99 HydrophobicContact CH2-CB 3.99Å; W11-R99 HydrophobicContact CH2-CG 4.41Å; W11-R99 HydrophobicContact CZ3-CB 3.56Å; W11-R99 HydrophobicContact CZ3-CG 3.76Å; T95-R99 HydrophobicContact CG2-CG 4.29Å; T95-R99 WeakPolarHBondContact O-CB 3.02Å; T95-R99 VanDerWaalsContact O-CG 3.25Å; T95-R99 WeakPolarHBondContact O-CG 3.15Å; T95-R99 PolarHBondContact O-N 3.36Å; Y96-R99 PolarHBondContact O-N 2.88Å; R99-Y101 PolarHBondContact O-N 3.13Å; R99-L102 WeakPolarHBondContact O-CB 3.49Å; R99-L102 PolarHBondContact O-N 3.41Å; R99-L161 HydrophobicContact CB-CD2 3.51Å; R99-L161 HydrophobicContact CG-CD2 4.49Å; R99-D164 PolarHBondContact NH1-O 3.15Å; R99-L228 HydrophobicContact CG-CD2 3.85Å
100F98.5Very high97.3Very high0 Ų010 Ų100%05%0.047CC..Hα-helixtrans-57.9-48.6179-180-88000111.4Y96 F97 L102 N103 H104 F109 I114 F156 L157Y96-F100 VanDerWaalsContact O-CB 3.3Å; Y96-F100 WeakPolarHBondContact O-CB 3.13Å; Y96-F100 PolarHBondContact O-N 3.2Å; F97-F100 PolarHBondContact O-N 2.85Å; F100-L102 PolarHBondContact O-N 2.81Å; F100-L102 VanDerWaalsContact O-N 3.15Å; F100-N103 PolarHBondContact O-N 3.35Å; F100-H104 HydrophobicContact CD1-CB 4.01Å; F100-H104 AromaticContact CD2-CD2 3.7Å; F100-H104 HydrophobicContact CE1-CB 3.53Å; F100-H104 HydrophobicContact CE2-CB 4.45Å; F100-H104 AromaticContact CE2-CD2 3.47Å; F100-H104 VanDerWaalsContact CE2-CD2 3.47Å; F100-H104 WeakPolarHBondContact CE2-CD2 3.36Å; F100-H104 HydrophobicContact CZ-CB 3.79Å; F100-H104 AromaticContact CZ-CD2 3.69Å; F100-H104 AromaticContact CZ-CG 3.79Å; F100-H104 PolarHBondContact O-CD2 3.19Å; F100-H104 PolarHBondContact O-N 3.24Å; F100-H104 VanDerWaalsContact O-N 3.14Å; F100-F109 HydrophobicContact CE1-CB 3.72Å; F100-F109 HydrophobicContact CE1-CD2 4.26Å; F100-F109 HydrophobicContact CE1-CG 4.09Å; F100-F109 HydrophobicContact CZ-CB 3.81Å; F100-F109 HydrophobicContact CZ-CD1 4.22Å; F100-F109 AromaticContact CZ-CD2 3.96Å; F100-F109 HydrophobicContact CZ-CD2 3.96Å; F100-F109 AromaticContact CZ-CG 3.72Å; F100-F109 HydrophobicContact CZ-CG 3.72Å; F100-I114 HydrophobicContact CB-CG2 4.4Å; F100-I114 HydrophobicContact CD1-CG1 4.28Å; F100-I114 HydrophobicContact CD1-CG2 3.62Å; F100-I114 HydrophobicContact CD2-CG2 4.33Å; F100-I114 HydrophobicContact CE1-CB 4.38Å; F100-I114 HydrophobicContact CE1-CD1 3.95Å; F100-I114 HydrophobicContact CE1-CG1 3.68Å; F100-I114 HydrophobicContact CE1-CG2 3.9Å; F100-I114 HydrophobicContact CE2-CD1 4.15Å; F100-I114 HydrophobicContact CG-CG2 3.85Å; F100-I114 HydrophobicContact CZ-CD1 3.62Å; F100-I114 HydrophobicContact CZ-CG1 3.92Å; F100-I114 HydrophobicContact CZ-CG2 4.36Å; F100-F156 HydrophobicContact CE2-CD1 4.29Å; F100-F156 AromaticContact CE2-CE1 3.72Å; F100-F156 HydrophobicContact CE2-CE1 3.72Å; F100-F156 HydrophobicContact CE2-CZ 4.44Å; F100-F156 AromaticContact CZ-CE1 3.86Å; F100-F156 HydrophobicContact CZ-CE1 3.86Å; F100-L157 HydrophobicContact CB-CD1 4.23Å; F100-L157 HydrophobicContact CD2-CD1 3.62Å; F100-L157 HydrophobicContact CE2-CD1 4.39Å; F100-L157 HydrophobicContact CG-CD1 4.21Å
101Y98.3Very high97.2Very high13 Ų1310 Ų105%0.0515%0.047CC..Hα-helixtrans-76.98-179.3-73.7-66.5000115.1V66 F97 K98 R99 H104 V106 F109 P111 I114V66-Y101 HydrophobicContact CG1-CD2 4.4Å; V66-Y101 HydrophobicContact CG2-CD1 4.23Å; V66-Y101 HydrophobicContact CG2-CD2 3.81Å; V66-Y101 HydrophobicContact CG2-CG 3.67Å; F97-Y101 HydrophobicContact CD1-CD2 4.35Å; F97-Y101 HydrophobicContact CD2-CD2 4.28Å; F97-Y101 AromaticContact CD2-CE2 3.88Å; F97-Y101 HydrophobicContact CD2-CE2 3.88Å; F97-Y101 HydrophobicContact CE1-CD2 4.15Å; F97-Y101 HydrophobicContact CE1-CE2 4.13Å; F97-Y101 HydrophobicContact CE2-CD2 4.08Å; F97-Y101 AromaticContact CE2-CE2 3.38Å; F97-Y101 HydrophobicContact CE2-CE2 3.38Å; F97-Y101 HydrophobicContact CG-CD2 4.41Å; F97-Y101 HydrophobicContact CG-CE2 4.44Å; F97-Y101 AromaticContact CZ-CD2 3.99Å; F97-Y101 HydrophobicContact CZ-CD2 3.99Å; F97-Y101 AromaticContact CZ-CE2 3.5Å; F97-Y101 HydrophobicContact CZ-CE2 3.5Å; F97-Y101 VanDerWaalsContact O-CD2 3.29Å; F97-Y101 WeakPolarHBondContact O-CD2 3.33Å; F97-Y101 PolarHBondContact O-N 2.9Å; K98-Y101 PolarHBondContact O-N 3.38Å; R99-Y101 PolarHBondContact O-N 3.13Å; Y101-H104 WeakPolarHBondContact CA-O 3.47Å; Y101-H104 VanDerWaalsContact CD1-O 3.28Å; Y101-H104 WeakPolarHBondContact CD1-O 3.43Å; Y101-V106 HydrophobicContact CD1-CG1 3.64Å; Y101-V106 HydrophobicContact CE1-CB 4.14Å; Y101-V106 HydrophobicContact CE1-CG1 3.42Å; Y101-V106 VanDerWaalsContact CE1-CG1 3.42Å; Y101-V106 HydrophobicContact CG-CG1 4.38Å; Y101-F109 PolarHBondContact OH-O 2.66Å; Y101-P111 WeakPolarHBondContact OH-CA 3.43Å; Y101-I114 HydrophobicContact CE2-CB 4.22Å; Y101-I114 HydrophobicContact CE2-CG2 4.02Å; Y101-I114 WeakPolarHBondContact OH-CB 3.46Å; Y101-I114 WeakPolarHBondContact OH-CG1 3.42Å
102L97.4Very high97Very high2 Ų213.9 Ų13.91%0.016%0.062CC..Hα-helixtrans-80.2-30.5164.3-62.2-178.2000112W11 F13 L18 K98 R99 F100 L228W11-L102 HydrophobicContact CE3-CD1 4.44Å; W11-L102 HydrophobicContact CZ3-CD1 4.34Å; F13-L102 HydrophobicContact CD2-CD1 4.19Å; F13-L102 HydrophobicContact CE2-CD1 3.62Å; F13-L102 HydrophobicContact CZ-CD1 4.14Å; L18-L102 HydrophobicContact CD2-CD1 4.01Å; L18-L102 HydrophobicContact CD2-CD2 3.78Å; K98-L102 WeakPolarHBondContact O-CG 3.35Å; K98-L102 PolarHBondContact O-N 3.33Å; R99-L102 WeakPolarHBondContact O-CB 3.49Å; R99-L102 PolarHBondContact O-N 3.41Å; F100-L102 PolarHBondContact O-N 2.81Å; F100-L102 VanDerWaalsContact O-N 3.15Å; L102-L228 HydrophobicContact CD1-CD1 3.94Å; L102-L228 HydrophobicContact CD1-CD2 4.39Å; L102-L228 HydrophobicContact CD2-CD1 4.15Å; L102-L228 HydrophobicContact CG-CD1 4.33Å
103N96.1Very high96.9Very high82 Ų8214.2 Ų14.244%0.4396%0.064SC..Hα-helixtrans-114.7-7.5-173.4-62.4-35.5000113.1C25 F100C25-N103 VanDerWaalsContact SG-C 3.52Å; F100-N103 PolarHBondContact O-N 3.35Å
104H96.9Very high96.8Very high33 Ų3314.4 Ų14.415%0.1537%0.065CC..SBendtrans-133.1142.2-178.3-63.1-61000110.2C25 F100 Y101 F109 F156 S160C25-H104 PolarHBondContact SG-N 3.43Å; C25-H104 VanDerWaalsContact SG-N 3.4Å; F100-H104 HydrophobicContact CD1-CB 4.01Å; F100-H104 AromaticContact CD2-CD2 3.7Å; F100-H104 HydrophobicContact CE1-CB 3.53Å; F100-H104 HydrophobicContact CE2-CB 4.45Å; F100-H104 AromaticContact CE2-CD2 3.47Å; F100-H104 VanDerWaalsContact CE2-CD2 3.47Å; F100-H104 WeakPolarHBondContact CE2-CD2 3.36Å; F100-H104 HydrophobicContact CZ-CB 3.79Å; F100-H104 AromaticContact CZ-CD2 3.69Å; F100-H104 AromaticContact CZ-CG 3.79Å; F100-H104 PolarHBondContact O-CD2 3.19Å; F100-H104 PolarHBondContact O-N 3.24Å; F100-H104 VanDerWaalsContact O-N 3.14Å; Y101-H104 WeakPolarHBondContact CA-O 3.47Å; Y101-H104 VanDerWaalsContact CD1-O 3.28Å; Y101-H104 WeakPolarHBondContact CD1-O 3.43Å; H104-F109 HydrophobicContact CB-CD2 3.77Å; H104-F109 HydrophobicContact CB-CE2 4.14Å; H104-F109 AromaticContact ND1-CE2 3.61Å; H104-F156 AromaticContact CE1-CZ 3.95Å; H104-S160 PolarHBondContact CD2-OG 2.59Å; H104-S160 VanDerWaalsContact NE2-CB 3.33Å; H104-S160 WeakPolarHBondContact NE2-CB 3.46Å; H104-S160 PolarHBondContact NE2-OG 2.96Å
105S96.8Very high96.8Very high0 Ų014.7 Ų14.70%07%0.066CC..  trans-90.9147.1178.4171.70000111E62 M107 D108 F109E62-S105 PolarHBondContact OE1-OG 2.88Å; E62-S105 WeakPolarHBondContact OE2-CA 3.4Å; E62-S105 PolarHBondContact OE2-OG 3.3Å; E62-S105 VanDerWaalsContact OE2-OG 3.1Å; S105-M107 PolarHBondContact O-N 3.21Å; S105-M107 WeakPolarHBondContact OG-CB 3.43Å; S105-M107 WeakPolarHBondContact OG-CE 3.49Å; S105-M107 PolarHBondContact OG-N 3.48Å; S105-M107 VanDerWaalsContact OG-N 3.13Å; S105-D108 PolarHBondContact O-N 3.12Å; S105-D108 VanDerWaalsContact O-N 3.15Å; S105-F109 PolarHBondContact O-N 2.8Å
106V96.7Very high96.7Very high0 Ų014.9 Ų14.90%07%0.067CC..THydrogen-bonded Turntrans-60.4-26.2171.2-65.80000112.4L57 E62 I65 V66 Y101 D108 F109 P111 L330L57-V106 HydrophobicContact CD1-CG2 3.66Å; E62-V106 HydrophobicContact CB-CG2 3.96Å; E62-V106 HydrophobicContact CG-CG2 3.62Å; E62-V106 PolarHBondContact OE2-N 2.92Å; I65-V106 HydrophobicContact CD1-CG2 4.27Å; I65-V106 HydrophobicContact CG2-CG1 4.25Å; V66-V106 HydrophobicContact CG2-CG1 3.82Å; Y101-V106 HydrophobicContact CD1-CG1 3.64Å; Y101-V106 HydrophobicContact CE1-CB 4.14Å; Y101-V106 HydrophobicContact CE1-CG1 3.42Å; Y101-V106 VanDerWaalsContact CE1-CG1 3.42Å; Y101-V106 HydrophobicContact CG-CG1 4.38Å; V106-D108 PolarHBondContact O-N 3.45Å; V106-F109 CarbonylContact O-C 3.56Å; V106-P111 HydrophobicContact CG1-CB 4.48Å; V106-L330 HydrophobicContact CB-CD1 4.28Å; V106-L330 HydrophobicContact CG2-CD1 4.1Å; V106-L330 WeakPolarHBondContact O-CD1 3.37Å
107M94.9Very high96.7Very high0 Ų014.9 Ų14.90%07%0.067CC..THydrogen-bonded Turntrans-66.9-27.8178-61.3-174.3-82.800112.2A29 L30 L33 L57 E62 S105 L330 N335A29-M107 HydrophobicContact CB-CE 3.91Å; L30-M107 HydrophobicContact CD2-CE 3.83Å; L30-M107 HydrophobicContact CD2-SD 4.15Å; L30-M107 HydrophobicContact CG-CE 4.09Å; L33-M107 HydrophobicContact CD1-CB 4.16Å; L33-M107 HydrophobicContact CD1-CE 4.39Å; L33-M107 HydrophobicContact CD1-CG 4.5Å; L33-M107 HydrophobicContact CD1-SD 3.62Å; L57-M107 HydrophobicContact CB-CG 4.47Å; L57-M107 HydrophobicContact CB-SD 4.23Å; L57-M107 HydrophobicContact CD1-CG 3.91Å; L57-M107 HydrophobicContact CG-CG 4.37Å; L57-M107 HydrophobicContact CG-SD 4.5Å; L57-M107 PolarHBondContact N-SD 2.86Å; E62-M107 VanDerWaalsContact OE1-CE 3.23Å; E62-M107 WeakPolarHBondContact OE1-CE 3.23Å; S105-M107 PolarHBondContact O-N 3.21Å; S105-M107 WeakPolarHBondContact OG-CB 3.43Å; S105-M107 WeakPolarHBondContact OG-CE 3.49Å; S105-M107 PolarHBondContact OG-N 3.48Å; S105-M107 VanDerWaalsContact OG-N 3.13Å; M107-L330 HydrophobicContact CG-CD1 4.38Å; M107-N335 WeakPolarHBondContact O-CB 3.34Å; M107-N335 PolarHBondContact O-N 2.92Å
108D94.1Very high96.7Very high2 Ų214.9 Ų14.91%0.0117%0.067CC..THydrogen-bonded Turntrans-91.7-48.6175.2-61-62.4000111.9R32 S105 V106 N335 Y338R32-D108 IonicContact CZ-OD1 3.23Å; R32-D108 IonicContact CZ-OD2 3.23Å; R32-D108 IonicContact NH1-OD1 2.64Å; R32-D108 PolarHBondContact NH1-OD1 2.9Å; R32-D108 IonicContact NH1-OD2 3.95Å; R32-D108 PolarHBondContact NH1-OD2 3.43Å; R32-D108 IonicContact NH2-OD2 2.76Å; R32-D108 PolarHBondContact NH2-OD2 3.3Å; S105-D108 PolarHBondContact O-N 3.12Å; S105-D108 VanDerWaalsContact O-N 3.15Å; V106-D108 PolarHBondContact O-N 3.45Å; D108-N335 PolarHBondContact OD1-ND2 2.92Å; D108-Y338 HydrophobicContact CB-CD2 3.68Å; D108-Y338 HydrophobicContact CB-CE2 4.06Å; D108-Y338 HydrophobicContact CB-CG 4.39Å; D108-Y338 WeakPolarHBondContact O-CB 3.07Å
109F95Very high96.7Very high29 Ų2914.7 Ų14.713%0.1277%0.066CC..SBendtrans-115.2108.3-172.7-61-78.7000109.5F100 Y101 H104 S105 V106 I114 F156 Y338F100-F109 HydrophobicContact CE1-CB 3.72Å; F100-F109 HydrophobicContact CE1-CD2 4.26Å; F100-F109 HydrophobicContact CE1-CG 4.09Å; F100-F109 HydrophobicContact CZ-CB 3.81Å; F100-F109 HydrophobicContact CZ-CD1 4.22Å; F100-F109 AromaticContact CZ-CD2 3.96Å; F100-F109 HydrophobicContact CZ-CD2 3.96Å; F100-F109 AromaticContact CZ-CG 3.72Å; F100-F109 HydrophobicContact CZ-CG 3.72Å; Y101-F109 PolarHBondContact OH-O 2.66Å; H104-F109 HydrophobicContact CB-CD2 3.77Å; H104-F109 HydrophobicContact CB-CE2 4.14Å; H104-F109 AromaticContact ND1-CE2 3.61Å; S105-F109 PolarHBondContact O-N 2.8Å; V106-F109 CarbonylContact O-C 3.56Å; F109-I114 HydrophobicContact CB-CD1 4.12Å; F109-I114 HydrophobicContact CB-CG1 3.88Å; F109-F156 AromaticContact CD1-CE1 3.73Å; F109-F156 HydrophobicContact CD1-CE1 3.73Å; F109-F156 HydrophobicContact CD1-CZ 4.35Å; F109-F156 HydrophobicContact CE1-CD1 4.19Å; F109-F156 AromaticContact CE1-CE1 3.25Å; F109-F156 HydrophobicContact CE1-CE1 3.25Å; F109-F156 AromaticContact CE1-CZ 3.52Å; F109-F156 HydrophobicContact CE1-CZ 3.52Å; F109-F156 HydrophobicContact CE2-CE1 4.26Å; F109-F156 HydrophobicContact CE2-CZ 4.02Å; F109-F156 HydrophobicContact CG-CE1 4.4Å; F109-F156 AromaticContact CZ-CE1 3.55Å; F109-F156 HydrophobicContact CZ-CE1 3.55Å; F109-F156 HydrophobicContact CZ-CE2 4.37Å; F109-F156 AromaticContact CZ-CZ 3.3Å; F109-F156 HydrophobicContact CZ-CZ 3.3Å; F109-Y338 HydrophobicContact CE1-CD1 4.02Å; F109-Y338 HydrophobicContact CE1-CE1 4.3Å; F109-Y338 HydrophobicContact CE1-CG 4.48Å; F109-Y338 HydrophobicContact CZ-CD1 4.14Å; F109-Y338 HydrophobicContact CZ-CE1 4.01Å
110Y94.1Very high96.7Very high38 Ų3815.5 Ų15.515%0.1497%0.07CC..  trans-64.7129.8-171.1-160.5-112000111.2R112 D113 I114 L330 D331Y110-R112 VanDerWaalsContact C-N 3.28Å; Y110-R112 HydrophobicContact CD1-CB 3.74Å; Y110-R112 HydrophobicContact CE1-CB 3.85Å; Y110-R112 PolarHBondContact O-N 3.35Å; Y110-D113 WeakPolarHBondContact O-CB 3.3Å; Y110-D113 PolarHBondContact O-N 3.27Å; Y110-I114 PolarHBondContact O-N 3.1Å; Y110-L330 HydrophobicContact CD2-CD2 3.98Å; Y110-L330 HydrophobicContact CD2-CG 4.36Å; Y110-L330 HydrophobicContact CE2-CD2 3.66Å; Y110-L330 HydrophobicContact CE2-CG 4.03Å; Y110-D331 PolarHBondContact OH-OD1 3.05Å; Y110-D331 VanDerWaalsContact OH-OD1 3.1Å
111P96.1Very high96.6Very high0 Ų015.7 Ų15.70%07%0.07CC..Hα-helixtrans-62.8-30.6-170.425.9-37.5000113.9I65 Y69 F97 Y101 V106 D113 M115 L330I65-P111 HydrophobicContact CG2-CB 4.3Å; I65-P111 HydrophobicContact CG2-CG 3.7Å; Y69-P111 HydrophobicContact CD1-CB 3.87Å; Y69-P111 HydrophobicContact CD1-CG 4.28Å; Y69-P111 HydrophobicContact CD2-CB 3.58Å; Y69-P111 HydrophobicContact CD2-CG 3.56Å; Y69-P111 HydrophobicContact CE1-CB 4.19Å; Y69-P111 HydrophobicContact CE1-CG 4.13Å; Y69-P111 HydrophobicContact CE2-CB 3.91Å; Y69-P111 HydrophobicContact CE2-CG 3.37Å; Y69-P111 HydrophobicContact CG-CB 3.55Å; Y69-P111 HydrophobicContact CG-CG 4.01Å; F97-P111 HydrophobicContact CE2-CB 4.49Å; F97-P111 WeakPolarHBondContact CE2-O 3.37Å; F97-P111 HydrophobicContact CZ-CB 3.95Å; Y101-P111 WeakPolarHBondContact OH-CA 3.43Å; V106-P111 HydrophobicContact CG1-CB 4.48Å; P111-D113 VanDerWaalsContact C-N 3.28Å; P111-D113 PolarHBondContact O-N 3.13Å; P111-M115 WeakPolarHBondContact O-CB 3.47Å; P111-M115 PolarHBondContact O-N 2.68Å; P111-L330 HydrophobicContact CG-CD2 4.03Å
112R94.8Very high96.6Very high82 Ų8215 Ų1531%0.3097%0.068SC..Hα-helixtrans-60.7-41.9174.3-166171.6-62.8-76.4-6.2112.3Y69 Y110 L116 Y146Y69-R112 HydrophobicContact CD1-CB 4.42Å; Y69-R112 HydrophobicContact CE1-CB 3.55Å; Y69-R112 HydrophobicContact CE1-CG 4.19Å; Y69-R112 PolarHBondContact OH-NH2 3.15Å; Y110-R112 VanDerWaalsContact C-N 3.28Å; Y110-R112 HydrophobicContact CD1-CB 3.74Å; Y110-R112 HydrophobicContact CE1-CB 3.85Å; Y110-R112 PolarHBondContact O-N 3.35Å; R112-L116 VanDerWaalsContact O-CG 3.28Å; R112-L116 WeakPolarHBondContact O-CG 3.48Å; R112-L116 PolarHBondContact O-N 3.14Å; R112-Y146 WeakPolarHBondContact CD-OH 3.43Å; R112-Y146 HydrophobicContact CG-CE1 4.48Å
113D94.6Very high96.6Very high13 Ų1315 Ų157%0.077%0.067CC..Hα-helixtrans-75.3-43.9-171.2-68.1-14000110.1Y110 P111 T117 L149Y110-D113 WeakPolarHBondContact O-CB 3.3Å; Y110-D113 PolarHBondContact O-N 3.27Å; P111-D113 VanDerWaalsContact C-N 3.28Å; P111-D113 PolarHBondContact O-N 3.13Å; D113-T117 PolarHBondContact O-N 3.15Å; D113-T117 PolarHBondContact O-OG1 3.46Å; D113-L149 HydrophobicContact CB-CD1 3.47Å; D113-L149 VanDerWaalsContact CB-CD1 3.47Å; D113-L149 HydrophobicContact CB-CD2 3.53Å; D113-L149 HydrophobicContact CB-CG 4.1Å; D113-L149 WeakPolarHBondContact O-CD2 3.23Å; D113-L149 WeakPolarHBondContact OD1-CD1 3.38Å; D113-L149 VanDerWaalsContact OD2-CD1 3.26Å; D113-L149 WeakPolarHBondContact OD2-CD1 3.47Å
114I97.7Very high96.7Very high4 Ų414.9 Ų14.92%0.0216%0.063CC..Hα-helixtrans-68.2-39.9174-58.1-55.6000111.5F97 F100 Y101 F109 Y110 L116 T117 C118F97-I114 HydrophobicContact CD2-CG2 4.01Å; F97-I114 HydrophobicContact CE2-CB 4.27Å; F97-I114 HydrophobicContact CE2-CG2 4.22Å; F100-I114 HydrophobicContact CB-CG2 4.4Å; F100-I114 HydrophobicContact CD1-CG1 4.28Å; F100-I114 HydrophobicContact CD1-CG2 3.62Å; F100-I114 HydrophobicContact CD2-CG2 4.33Å; F100-I114 HydrophobicContact CE1-CB 4.38Å; F100-I114 HydrophobicContact CE1-CD1 3.95Å; F100-I114 HydrophobicContact CE1-CG1 3.68Å; F100-I114 HydrophobicContact CE1-CG2 3.9Å; F100-I114 HydrophobicContact CE2-CD1 4.15Å; F100-I114 HydrophobicContact CG-CG2 3.85Å; F100-I114 HydrophobicContact CZ-CD1 3.62Å; F100-I114 HydrophobicContact CZ-CG1 3.92Å; F100-I114 HydrophobicContact CZ-CG2 4.36Å; Y101-I114 HydrophobicContact CE2-CB 4.22Å; Y101-I114 HydrophobicContact CE2-CG2 4.02Å; Y101-I114 WeakPolarHBondContact OH-CB 3.46Å; Y101-I114 WeakPolarHBondContact OH-CG1 3.42Å; F109-I114 HydrophobicContact CB-CD1 4.12Å; F109-I114 HydrophobicContact CB-CG1 3.88Å; Y110-I114 PolarHBondContact O-N 3.1Å; I114-L116 VanDerWaalsContact C-N 3.32Å; I114-L116 PolarHBondContact O-N 3.4Å; I114-T117 PolarHBondContact O-N 3.17Å; I114-T117 VanDerWaalsContact O-N 3.17Å; I114-C118 WeakPolarHBondContact O-CB 3.41Å; I114-C118 PolarHBondContact O-N 3.14Å; I114-C118 PolarHBondContact O-SG 3.4Å
115M97.7Very high96.7Very high6 Ų614.3 Ų14.33%0.036%0.064CC..Hα-helixtrans-56.1-46.4177178.2-163.173.400111.7Y69 L72 M73 L76 F97 P111 L119Y69-M115 HydrophobicContact CD1-SD 4.02Å; Y69-M115 VanDerWaalsContact O-SD 3.38Å; L72-M115 HydrophobicContact CB-SD 4.03Å; M73-M115 VanDerWaalsContact CA-SD 3.55Å; M73-M115 HydrophobicContact CB-CG 3.64Å; M73-M115 HydrophobicContact CB-SD 3.78Å; M73-M115 HydrophobicContact CE-CB 4.12Å; M73-M115 HydrophobicContact CE-CG 3.48Å; M73-M115 VanDerWaalsContact CE-CG 3.48Å; M73-M115 HydrophobicContact CG-CG 3.87Å; M73-M115 HydrophobicContact CG-SD 4.5Å; M73-M115 PolarHBondContact N-SD 3.47Å; M73-M115 VanDerWaalsContact N-SD 3.39Å; L76-M115 HydrophobicContact CD2-CE 4.11Å; F97-M115 HydrophobicContact CD2-CB 4.11Å; F97-M115 HydrophobicContact CE2-CB 3.66Å; F97-M115 HydrophobicContact CZ-CB 4.33Å; P111-M115 WeakPolarHBondContact O-CB 3.47Å; P111-M115 PolarHBondContact O-N 2.68Å; M115-L119 PolarHBondContact O-N 3.45Å
116L97.5Very high96.6Very high4 Ų415.3 Ų15.32%0.0217%0.072CC..Hα-helixtrans-64.9-42.1177.8-68.4175.1000111.9L76 R112 I114 L119 Y120 F135 I139 Y146 V150L76-L116 HydrophobicContact CD2-CD2 3.28Å; R112-L116 VanDerWaalsContact O-CG 3.28Å; R112-L116 WeakPolarHBondContact O-CG 3.48Å; R112-L116 PolarHBondContact O-N 3.14Å; I114-L116 VanDerWaalsContact C-N 3.32Å; I114-L116 PolarHBondContact O-N 3.4Å; L116-L119 PolarHBondContact O-N 2.67Å; L116-Y120 PolarHBondContact O-N 2.95Å; L116-F135 HydrophobicContact CD2-CZ 4.43Å; L116-F135 WeakPolarHBondContact O-CZ 3.37Å; L116-I139 HydrophobicContact CD1-CD1 3.98Å; L116-I139 HydrophobicContact CD2-CD1 3.61Å; L116-I139 HydrophobicContact CD2-CG1 4.34Å; L116-I139 HydrophobicContact CG-CD1 4.38Å; L116-Y146 HydrophobicContact CD1-CD1 3.31Å; L116-Y146 HydrophobicContact CD1-CD2 4.14Å; L116-Y146 HydrophobicContact CD1-CE1 3.63Å; L116-Y146 HydrophobicContact CD1-CE2 4.37Å; L116-Y146 HydrophobicContact CD1-CG 3.62Å; L116-V150 HydrophobicContact CB-CG2 4.03Å
117T97.8Very high96.5Very high0 Ų022 Ų220%011%0.108CC..Hα-helixtrans-64.7-44.8178.3-520000111.1D113 I114 L119 Y120 V121 L157D113-T117 PolarHBondContact O-N 3.15Å; D113-T117 PolarHBondContact O-OG1 3.46Å; I114-T117 PolarHBondContact O-N 3.17Å; I114-T117 VanDerWaalsContact O-N 3.17Å; T117-L119 PolarHBondContact O-N 3.24Å; T117-Y120 PolarHBondContact O-N 2.88Å; T117-V121 HydrophobicContact CG2-CG2 4.42Å; T117-V121 WeakPolarHBondContact O-CB 3.43Å; T117-V121 WeakPolarHBondContact O-CG2 3.29Å; T117-V121 PolarHBondContact O-N 3.3Å; T117-L157 HydrophobicContact CG2-CB 4.1Å; T117-L157 HydrophobicContact CG2-CD2 3.76Å
118C98.6Very high96.6Very high0 Ų024.9 Ų24.90%012%0.121CC..Hα-helixtrans-57.8-45.6174.7-72.80000112.1M73 F97 I114 A122 L157M73-C118 HydrophobicContact CE-CB 4.16Å; F97-C118 HydrophobicContact CB-CB 4.44Å; I114-C118 WeakPolarHBondContact O-CB 3.41Å; I114-C118 PolarHBondContact O-N 3.14Å; I114-C118 PolarHBondContact O-SG 3.4Å; C118-A122 WeakPolarHBondContact O-CB 3.34Å; C118-A122 PolarHBondContact O-N 3.31Å; C118-L157 HydrophobicContact CB-CD2 4.34Å
119L98.2Very high96.5Very high0 Ų029.5 Ų29.50%015%0.151CC..Hα-helixtrans-65.5-40.8179.8-174.861.8000112L76 F77 F80 L85 V89 A93 M115 L116 T117 A122 C123 F135L76-L119 HydrophobicContact CD2-CD2 4.02Å; L76-L119 HydrophobicContact CG-CD2 4.21Å; F77-L119 HydrophobicContact CD2-CD1 4.2Å; F80-L119 HydrophobicContact CE2-CD2 3.94Å; L85-L119 HydrophobicContact CD1-CD1 4.45Å; V89-L119 HydrophobicContact CG1-CD1 3.96Å; A93-L119 HydrophobicContact CB-CB 4.29Å; A93-L119 HydrophobicContact CB-CD1 3.85Å; M115-L119 PolarHBondContact O-N 3.45Å; L116-L119 PolarHBondContact O-N 2.67Å; T117-L119 PolarHBondContact O-N 3.24Å; L119-A122 PolarHBondContact O-N 2.85Å; L119-C123 PolarHBondContact O-N 2.79Å; L119-C123 VanDerWaalsContact O-N 3.12Å; L119-C123 PolarHBondContact O-SG 2.87Å; L119-F135 HydrophobicContact CB-CE2 4.21Å; L119-F135 HydrophobicContact CB-CZ 4.15Å; L119-F135 HydrophobicContact CD2-CE2 3.84Å; L119-F135 HydrophobicContact CD2-CZ 4.2Å; L119-F135 HydrophobicContact CG-CE2 3.83Å; L119-F135 HydrophobicContact CG-CZ 4.25Å
120Y98Very high96.5Very high18 Ų1828.9 Ų28.97%0.07115%0.149CC..Hα-helixtrans-66.9-46.1176.9177.6-113000112.7L116 T117 A122 C123 K124 L132 F135 V150L116-Y120 PolarHBondContact O-N 2.95Å; T117-Y120 PolarHBondContact O-N 2.88Å; Y120-A122 VanDerWaalsContact C-N 3.3Å; Y120-A122 PolarHBondContact O-N 3.32Å; Y120-C123 WeakPolarHBondContact O-CB 3.3Å; Y120-C123 PolarHBondContact O-N 3.01Å; Y120-K124 VanDerWaalsContact CE1-CE 3.44Å; Y120-K124 PolarHBondContact O-N 2.78Å; Y120-K124 VanDerWaalsContact OH-CE 3.29Å; Y120-K124 WeakPolarHBondContact OH-CE 3.37Å; Y120-K124 PolarHBondContact OH-NZ 3.1Å; Y120-L132 HydrophobicContact CD2-CD1 4.29Å; Y120-L132 HydrophobicContact CE1-CD1 4.24Å; Y120-L132 HydrophobicContact CE2-CB 4.17Å; Y120-L132 HydrophobicContact CE2-CD1 4.03Å; Y120-F135 HydrophobicContact CD2-CB 4.05Å; Y120-F135 HydrophobicContact CD2-CD1 4.07Å; Y120-F135 HydrophobicContact CD2-CD2 4.42Å; Y120-F135 AromaticContact CD2-CG 3.92Å; Y120-F135 HydrophobicContact CD2-CG 3.92Å; Y120-F135 HydrophobicContact CE2-CB 4.48Å; Y120-F135 HydrophobicContact CG-CD1 4.4Å; Y120-V150 HydrophobicContact CD1-CG1 3.27Å; Y120-V150 HydrophobicContact CE1-CG1 3.91Å; Y120-V150 HydrophobicContact CG-CG1 3.63Å
121V98.1Very high96.5Very high3 Ų329.2 Ų29.22%0.01816%0.164CC..Hα-helixtrans-64.6-36.6176.5173.60000111Y96 T117 C123 K124 A125 E154 L157 M158Y96-V121 HydrophobicContact CE2-CG1 4Å; T117-V121 HydrophobicContact CG2-CG2 4.42Å; T117-V121 WeakPolarHBondContact O-CB 3.43Å; T117-V121 WeakPolarHBondContact O-CG2 3.29Å; T117-V121 PolarHBondContact O-N 3.3Å; V121-C123 VanDerWaalsContact C-N 3.32Å; V121-C123 PolarHBondContact O-N 3.22Å; V121-K124 WeakPolarHBondContact O-CB 3.4Å; V121-K124 PolarHBondContact O-N 3.34Å; V121-K124 VanDerWaalsContact O-N 3.13Å; V121-A125 WeakPolarHBondContact O-CB 3.05Å; V121-A125 PolarHBondContact O-N 3.06Å; V121-E154 HydrophobicContact CG2-CB 4.46Å; V121-E154 HydrophobicContact CG2-CG 3.92Å; V121-L157 HydrophobicContact CB-CD2 4.21Å; V121-L157 HydrophobicContact CG2-CD2 4.05Å; V121-M158 HydrophobicContact CG1-CG 4.49Å
122A98.4Very high96.5Very high0 Ų030.4 Ų30.40%017%0.17CC..Hα-helixtrans-62.1-37.1174.300000112.9V89 F92 A93 Y96 C118 L119 Y120 K124 A125 A126V89-A122 HydrophobicContact CG1-CB 4.17Å; V89-A122 WeakPolarHBondContact O-CB 3.49Å; F92-A122 HydrophobicContact CB-CB 3.65Å; A93-A122 HydrophobicContact CB-CB 3.69Å; Y96-A122 HydrophobicContact CD2-CB 4.27Å; Y96-A122 HydrophobicContact CE2-CB 4.07Å; C118-A122 WeakPolarHBondContact O-CB 3.34Å; C118-A122 PolarHBondContact O-N 3.31Å; L119-A122 PolarHBondContact O-N 2.85Å; Y120-A122 VanDerWaalsContact C-N 3.3Å; Y120-A122 PolarHBondContact O-N 3.32Å; A122-K124 VanDerWaalsContact C-N 3.27Å; A122-K124 PolarHBondContact O-N 2.98Å; A122-A125 PolarHBondContact O-N 3.21Å; A122-A126 VanDerWaalsContact O-CB 3.23Å; A122-A126 WeakPolarHBondContact O-CB 3.4Å; A122-A126 PolarHBondContact O-N 3.02Å
123C97.6Very high96.5Very high0 Ų032.6 Ų32.60%018%0.184CC..Hα-helixtrans-57.7-43.4173-65.10000111L119 Y120 V121 F128 I130L119-C123 PolarHBondContact O-N 2.79Å; L119-C123 VanDerWaalsContact O-N 3.12Å; L119-C123 PolarHBondContact O-SG 2.87Å; Y120-C123 WeakPolarHBondContact O-CB 3.3Å; Y120-C123 PolarHBondContact O-N 3.01Å; V121-C123 VanDerWaalsContact C-N 3.32Å; V121-C123 PolarHBondContact O-N 3.22Å; C123-F128 CarbonylContact C-O 3.49Å; C123-F128 WeakPolarHBondContact CB-O 3.45Å; C123-F128 CarbonylContact O-C 3.2Å; C123-F128 VanDerWaalsContact O-CA 3.29Å; C123-F128 WeakPolarHBondContact O-CA 3.45Å; C123-F128 PolarHBondContact O-N 2.79Å; C123-F128 VanDerWaalsContact O-O 3.04Å; C123-I130 HydrophobicContact CB-CD1 4.35Å; C123-I130 HydrophobicContact CB-CG1 3.98Å
124K97Very high96.5Very high80 Ų8035 Ų3535%0.34820%0.199SC..Hα-helixtrans-67.9-44.1177.3-61.9-177.4-178.4179.70112.4Y120 V121 A122 E154Y120-K124 VanDerWaalsContact CE1-CE 3.44Å; Y120-K124 PolarHBondContact O-N 2.78Å; Y120-K124 VanDerWaalsContact OH-CE 3.29Å; Y120-K124 WeakPolarHBondContact OH-CE 3.37Å; Y120-K124 PolarHBondContact OH-NZ 3.1Å; V121-K124 WeakPolarHBondContact O-CB 3.4Å; V121-K124 PolarHBondContact O-N 3.34Å; V121-K124 VanDerWaalsContact O-N 3.13Å; A122-K124 VanDerWaalsContact C-N 3.27Å; A122-K124 PolarHBondContact O-N 2.98Å; K124-E154 IonicContact NZ-OE1 2.63Å; K124-E154 PolarHBondContact NZ-OE1 3.08Å; K124-E154 IonicContact NZ-OE2 2.92Å; K124-E154 PolarHBondContact NZ-OE2 3.2Å
125A96.9Very high96.4Very high21 Ų2134.8 Ų34.817%0.17420%0.198CC..Hα-helixtrans-75-29.4-174.400000114F92 Y96 V121 A122 D127 L165F92-A125 HydrophobicContact CD1-CB 3.86Å; F92-A125 HydrophobicContact CE1-CB 4.03Å; Y96-A125 HydrophobicContact CE2-CB 4.44Å; Y96-A125 WeakPolarHBondContact OH-CB 3.29Å; V121-A125 WeakPolarHBondContact O-CB 3.05Å; V121-A125 PolarHBondContact O-N 3.06Å; A122-A125 PolarHBondContact O-N 3.21Å; A125-D127 VanDerWaalsContact C-N 3.25Å; A125-D127 PolarHBondContact O-N 3.25Å; A125-L165 HydrophobicContact CB-CB 4.46Å
126A95.6Very high96.3Very high21 Ų2134.6 Ų34.617%0.17420%0.197CC..THydrogen-bonded Turntrans-90.425.3177.900000112.9E88 V89 F92 A122 F128E88-A126 HydrophobicContact CB-CB 4.41Å; V89-A126 HydrophobicContact CG2-CB 4Å; F92-A126 HydrophobicContact CD1-CB 4.32Å; F92-A126 HydrophobicContact CD2-CB 4.2Å; F92-A126 HydrophobicContact CE1-CB 4.45Å; F92-A126 HydrophobicContact CE2-CB 4.32Å; F92-A126 HydrophobicContact CG-CB 4.19Å; F92-A126 HydrophobicContact CZ-CB 4.44Å; A122-A126 VanDerWaalsContact O-CB 3.23Å; A122-A126 WeakPolarHBondContact O-CB 3.4Å; A122-A126 PolarHBondContact O-N 3.02Å; A126-F128 PolarHBondContact O-N 3.32Å
127D94.5Very high96.1Very high141 Ų14137.7 Ų37.775%0.75422%0.219SC*.THydrogen-bonded Turntrans54.433.1-179.7-81.1-28.2000114.7A125 P129A125-D127 VanDerWaalsContact C-N 3.25Å; A125-D127 PolarHBondContact O-N 3.25Å; D127-P129 VanDerWaalsContact C-CD 3.44Å
128F95.8Very high95.9Very high61 Ų6139.4 Ų39.427%0.26823%0.227SC..  trans-128.857.5174.8-158.7-96.5000112.1P83 Q84 L85 P86 V89 C123 A126 I130P83-F128 HydrophobicContact CB-CE1 3.98Å; P83-F128 HydrophobicContact CB-CZ 3.91Å; P83-F128 HydrophobicContact CG-CE1 3.9Å; P83-F128 HydrophobicContact CG-CZ 4.33Å; Q84-F128 WeakPolarHBondContact O-CZ 3.29Å; L85-F128 HydrophobicContact CD2-CD1 3.61Å; L85-F128 HydrophobicContact CD2-CE1 3.7Å; P86-F128 HydrophobicContact CG-CB 4.38Å; P86-F128 HydrophobicContact CG-CD2 3.79Å; P86-F128 HydrophobicContact CG-CE2 4.21Å; P86-F128 HydrophobicContact CG-CG 4.03Å; V89-F128 HydrophobicContact CG2-CB 4.08Å; C123-F128 CarbonylContact C-O 3.49Å; C123-F128 WeakPolarHBondContact CB-O 3.45Å; C123-F128 CarbonylContact O-C 3.2Å; C123-F128 VanDerWaalsContact O-CA 3.29Å; C123-F128 WeakPolarHBondContact O-CA 3.45Å; C123-F128 PolarHBondContact O-N 2.79Å; C123-F128 VanDerWaalsContact O-O 3.04Å; A126-F128 PolarHBondContact O-N 3.32Å; F128-I130 HydrophobicContact CD1-CG2 4.05Å; F128-I130 HydrophobicContact CE1-CG2 4Å; F128-I130 PolarHBondContact O-N 2.99Å
129P93.3Very high95.6Very high98 Ų9840 Ų4064%0.63623%0.23SC*.  trans-65.8127.2-174.428.1-35.1000111.1D127D127-P129 VanDerWaalsContact C-CD 3.44Å
130I94.5Very high95Very high17 Ų1744.8 Ų44.89%0.08726%0.261CS..  trans-115.614417257.8177.1000109.2F80 P83 L85 C123 F128 F135F80-I130 HydrophobicContact CD1-CD1 4.46Å; F80-I130 HydrophobicContact CE1-CD1 3.95Å; P83-I130 HydrophobicContact CG-CG2 3.8Å; L85-I130 HydrophobicContact CD2-CD1 4.37Å; C123-I130 HydrophobicContact CB-CD1 4.35Å; C123-I130 HydrophobicContact CB-CG1 3.98Å; F128-I130 HydrophobicContact CD1-CG2 4.05Å; F128-I130 HydrophobicContact CE1-CG2 4Å; F128-I130 PolarHBondContact O-N 2.99Å; I130-F135 HydrophobicContact CD1-CB 3.76Å; I130-F135 HydrophobicContact CD1-CD2 3.59Å; I130-F135 HydrophobicContact CD1-CG 4.14Å; I130-F135 HydrophobicContact CG1-CB 4.17Å
131G94.8Very high94.6Very high45 Ų4553.4 Ų53.446%0.46429%0.293SS..  trans-63.4142.1176.400000111Q133 T134 F135G131-Q133 VanDerWaalsContact C-N 3.25Å; G131-Q133 PolarHBondContact O-N 3.24Å; G131-T134 WeakPolarHBondContact O-CA 3.38Å; G131-T134 WeakPolarHBondContact O-CB 3.44Å; G131-T134 PolarHBondContact O-N 3.32Å; G131-F135 PolarHBondContact O-N 3.09Å
132L95.4Very high94.2Very high24 Ų2458.1 Ų58.113%0.12632%0.319CS..Hα-helixtrans-53.1-42.2-178.3-178.360.2000112.5Y120 T134 F135 I136 V150 L151Y120-L132 HydrophobicContact CD2-CD1 4.29Å; Y120-L132 HydrophobicContact CE1-CD1 4.24Å; Y120-L132 HydrophobicContact CE2-CB 4.17Å; Y120-L132 HydrophobicContact CE2-CD1 4.03Å; L132-T134 PolarHBondContact O-N 3.29Å; L132-F135 HydrophobicContact CD1-CD1 4.48Å; L132-F135 WeakPolarHBondContact O-CB 3.29Å; L132-F135 PolarHBondContact O-N 3.44Å; L132-I136 HydrophobicContact CD1-CD1 4.35Å; L132-I136 HydrophobicContact CD1-CG1 3.92Å; L132-I136 HydrophobicContact CG-CG1 4.26Å; L132-I136 WeakPolarHBondContact O-CB 3.35Å; L132-I136 VanDerWaalsContact O-CG1 3.24Å; L132-I136 WeakPolarHBondContact O-CG1 3.34Å; L132-I136 PolarHBondContact O-N 3.19Å; L132-V150 HydrophobicContact CD1-CB 4.07Å; L132-V150 HydrophobicContact CD1-CG1 3.68Å; L132-L151 HydrophobicContact CD2-CB 4.26Å
133Q94.8Very high93.9Very high129 Ų12962.3 Ų62.360%0.60334%0.338SS*.Hα-helixtrans-65.2-38.8178.6-62.8-55.1-39.700112.5G131 F135 I136 S137 S147G131-Q133 VanDerWaalsContact C-N 3.25Å; G131-Q133 PolarHBondContact O-N 3.24Å; Q133-F135 VanDerWaalsContact C-N 3.34Å; Q133-I136 PolarHBondContact O-N 3.32Å; Q133-S137 WeakPolarHBondContact O-CB 3.34Å; Q133-S137 PolarHBondContact O-N 3.34Å; Q133-S147 PolarHBondContact NE2-OG 3.47Å
134T94.6Very high93.6Very high62 Ų6270.6 Ų70.638%0.3838%0.377SS..Hα-helixtrans-67-36.4173.5-50.60000111.7G131 L132 S137 H138G131-T134 WeakPolarHBondContact O-CA 3.38Å; G131-T134 WeakPolarHBondContact O-CB 3.44Å; G131-T134 PolarHBondContact O-N 3.32Å; L132-T134 PolarHBondContact O-N 3.29Å; T134-S137 PolarHBondContact O-OG 3.49Å; T134-H138 PolarHBondContact O-CE1 3.02Å; T134-H138 PolarHBondContact O-ND1 3.26Å
135F95.9Very high93.4Very high0 Ų069.9 Ų69.90%037%0.372CS..Hα-helixtrans-63.4-52.6174.1175.8-104.6000111F80 L116 L119 Y120 I130 G131 L132 Q133 S137 H138 I139 V150F80-F135 AromaticContact CE1-CD2 3.68Å; F80-F135 HydrophobicContact CE1-CD2 3.68Å; F80-F135 HydrophobicContact CE1-CE2 4.21Å; F80-F135 HydrophobicContact CE2-CD2 4.49Å; F80-F135 HydrophobicContact CE2-CE2 4.23Å; F80-F135 AromaticContact CZ-CD2 3.38Å; F80-F135 HydrophobicContact CZ-CD2 3.38Å; F80-F135 AromaticContact CZ-CE2 3.49Å; F80-F135 HydrophobicContact CZ-CE2 3.49Å; F80-F135 VanDerWaalsContact CZ-CE2 3.49Å; F80-F135 HydrophobicContact CZ-CG 4.35Å; F80-F135 HydrophobicContact CZ-CZ 4.49Å; L116-F135 HydrophobicContact CD2-CZ 4.43Å; L116-F135 WeakPolarHBondContact O-CZ 3.37Å; L119-F135 HydrophobicContact CB-CE2 4.21Å; L119-F135 HydrophobicContact CB-CZ 4.15Å; L119-F135 HydrophobicContact CD2-CE2 3.84Å; L119-F135 HydrophobicContact CD2-CZ 4.2Å; L119-F135 HydrophobicContact CG-CE2 3.83Å; L119-F135 HydrophobicContact CG-CZ 4.25Å; Y120-F135 HydrophobicContact CD2-CB 4.05Å; Y120-F135 HydrophobicContact CD2-CD1 4.07Å; Y120-F135 HydrophobicContact CD2-CD2 4.42Å; Y120-F135 AromaticContact CD2-CG 3.92Å; Y120-F135 HydrophobicContact CD2-CG 3.92Å; Y120-F135 HydrophobicContact CE2-CB 4.48Å; Y120-F135 HydrophobicContact CG-CD1 4.4Å; I130-F135 HydrophobicContact CD1-CB 3.76Å; I130-F135 HydrophobicContact CD1-CD2 3.59Å; I130-F135 HydrophobicContact CD1-CG 4.14Å; I130-F135 HydrophobicContact CG1-CB 4.17Å; G131-F135 PolarHBondContact O-N 3.09Å; L132-F135 HydrophobicContact CD1-CD1 4.48Å; L132-F135 WeakPolarHBondContact O-CB 3.29Å; L132-F135 PolarHBondContact O-N 3.44Å; Q133-F135 VanDerWaalsContact C-N 3.34Å; F135-S137 VanDerWaalsContact C-N 3.3Å; F135-S137 PolarHBondContact O-N 3.05Å; F135-H138 PolarHBondContact O-N 2.94Å; F135-I139 HydrophobicContact CE1-CD1 4.28Å; F135-V150 HydrophobicContact CE1-CG2 4.39Å
136I95.3Very high93.2Very high2 Ų270 Ų701%0.0137%0.368CS..Hα-helixtrans-66.6-29.1-177.2-64.6-62.3000112.2L132 Q133 H138 I139 Q143 V150L132-I136 HydrophobicContact CD1-CD1 4.35Å; L132-I136 HydrophobicContact CD1-CG1 3.92Å; L132-I136 HydrophobicContact CG-CG1 4.26Å; L132-I136 WeakPolarHBondContact O-CB 3.35Å; L132-I136 VanDerWaalsContact O-CG1 3.24Å; L132-I136 WeakPolarHBondContact O-CG1 3.34Å; L132-I136 PolarHBondContact O-N 3.19Å; Q133-I136 PolarHBondContact O-N 3.32Å; I136-H138 PolarHBondContact O-N 3.39Å; I136-H138 VanDerWaalsContact O-N 3.11Å; I136-I139 HydrophobicContact CD1-CD1 3.71Å; I136-I139 WeakPolarHBondContact O-CB 3.2Å; I136-I139 PolarHBondContact O-N 2.94Å; I136-Q143 HydrophobicContact CG2-CB 3.48Å; I136-Q143 VanDerWaalsContact CG2-CB 3.48Å; I136-Q143 HydrophobicContact CG2-CG 3.75Å; I136-Q143 VanDerWaalsContact CG2-O 3.31Å; I136-Q143 WeakPolarHBondContact CG2-O 3.29Å; I136-V150 HydrophobicContact CD1-CG2 4.41Å
137S94.3Very high93.2Very high69 Ų6969.9 Ų69.948%0.48337%0.366SS..THydrogen-bonded Turntrans-61.6-21177.969.80000113.6Q133 T134 F135 I139Q133-S137 WeakPolarHBondContact O-CB 3.34Å; Q133-S137 PolarHBondContact O-N 3.34Å; T134-S137 PolarHBondContact O-OG 3.49Å; F135-S137 VanDerWaalsContact C-N 3.3Å; F135-S137 PolarHBondContact O-N 3.05Å; S137-I139 VanDerWaalsContact C-N 3.29Å
138H93.4Very high93.1Very high36 Ų3667.5 Ų67.517%0.16735%0.347CS..THydrogen-bonded Turntrans-80.7-9.1174.6-67.583.9000113.1F80 T82 T134 F135 I136F80-H138 HydrophobicContact CD1-CB 4.31Å; F80-H138 AromaticContact CD1-CD2 3.97Å; F80-H138 AromaticContact CD1-CE1 3.96Å; F80-H138 AromaticContact CD1-CG 3.76Å; F80-H138 AromaticContact CD1-ND1 3.76Å; F80-H138 HydrophobicContact CE1-CB 3.88Å; F80-H138 AromaticContact CE1-CG 3.68Å; F80-H138 AromaticContact CE1-ND1 3.59Å; F80-H138 HydrophobicContact CE2-CB 4.18Å; F80-H138 HydrophobicContact CZ-CB 3.8Å; T82-H138 PolarHBondContact O-CE1 2.93Å; T82-H138 VanDerWaalsContact O-CE1 3.23Å; T82-H138 PolarHBondContact O-NE2 3.17Å; T134-H138 PolarHBondContact O-CE1 3.02Å; T134-H138 PolarHBondContact O-ND1 3.26Å; F135-H138 PolarHBondContact O-N 2.94Å; I136-H138 PolarHBondContact O-N 3.39Å; I136-H138 VanDerWaalsContact O-N 3.11Å
139I92.2Very high93Very high12 Ų1264.7 Ų64.76%0.06234%0.335CS..SBendtrans-94.6120.2178.1-50.7175.2000108.6L76 L116 F135 I136 S137 R141 Q143 Y146L76-I139 HydrophobicContact CD1-CG1 4.46Å; L116-I139 HydrophobicContact CD1-CD1 3.98Å; L116-I139 HydrophobicContact CD2-CD1 3.61Å; L116-I139 HydrophobicContact CD2-CG1 4.34Å; L116-I139 HydrophobicContact CG-CD1 4.38Å; F135-I139 HydrophobicContact CE1-CD1 4.28Å; I136-I139 HydrophobicContact CD1-CD1 3.71Å; I136-I139 WeakPolarHBondContact O-CB 3.2Å; I136-I139 PolarHBondContact O-N 2.94Å; S137-I139 VanDerWaalsContact C-N 3.29Å; I139-R141 VanDerWaalsContact C-N 3.34Å; I139-R141 PolarHBondContact O-N 3.11Å; I139-Q143 VanDerWaalsContact O-CG 3.25Å; I139-Q143 WeakPolarHBondContact O-CG 3.28Å; I139-Q143 PolarHBondContact O-NE2 2.95Å; I139-Y146 HydrophobicContact CD1-CD2 4.4Å; I139-Y146 HydrophobicContact CG2-CD2 3.77Å; I139-Y146 HydrophobicContact CG2-CE2 3.94Å
140P85.4Confident93.1Very high102 Ų10260 Ų6066%0.66231%0.305SS*.  trans-75-15.4-168.527.5-35.5000115.1
141R89Confident93.1Very high198 Ų19864.2 Ų64.275%0.74733%0.327SS*.SBendtrans-140.2153.7-173.8-63.6-175.9-177176.91.1110.8I139 Q143 Y146I139-R141 VanDerWaalsContact C-N 3.34Å; I139-R141 PolarHBondContact O-N 3.11Å; R141-Q143 VanDerWaalsContact C-N 3.25Å; R141-Q143 PolarHBondContact O-N 2.85Å; R141-Y146 WeakPolarHBondContact O-CD2 3.4Å; R141-Y146 VanDerWaalsContact O-CE2 3.25Å; R141-Y146 WeakPolarHBondContact O-CE2 3.25Å
142N89.5Confident92.9Very high103 Ų10366 Ų6655%0.55133%0.326SS*.  trans5437.7173.3-58.7-21.1000114E144 R145 Y146N142-E144 PolarHBondContact O-N 3.38Å; N142-R145 HydrophobicContact CB-CB 4.21Å; N142-R145 WeakPolarHBondContact O-CB 3.38Å; N142-R145 PolarHBondContact O-N 2.79Å; N142-Y146 HydrophobicContact CB-CD2 4.02Å; N142-Y146 HydrophobicContact CB-CE2 3.71Å; N142-Y146 WeakPolarHBondContact O-CD2 3.28Å; N142-Y146 PolarHBondContact O-N 2.91Å
143Q92.8Very high92.8Very high87 Ų8766 Ų6641%0.40733%0.328SS..Hα-helixtrans-56.5-48.3-175.1-74.2-176.6-10.300112.9I136 I139 R141 R145 Y146 S147I136-Q143 HydrophobicContact CG2-CB 3.48Å; I136-Q143 VanDerWaalsContact CG2-CB 3.48Å; I136-Q143 HydrophobicContact CG2-CG 3.75Å; I136-Q143 VanDerWaalsContact CG2-O 3.31Å; I136-Q143 WeakPolarHBondContact CG2-O 3.29Å; I139-Q143 VanDerWaalsContact O-CG 3.25Å; I139-Q143 WeakPolarHBondContact O-CG 3.28Å; I139-Q143 PolarHBondContact O-NE2 2.95Å; R141-Q143 VanDerWaalsContact C-N 3.25Å; R141-Q143 PolarHBondContact O-N 2.85Å; Q143-R145 PolarHBondContact O-N 2.78Å; Q143-Y146 PolarHBondContact O-N 3.47Å; Q143-S147 WeakPolarHBondContact O-CB 3.45Å; Q143-S147 PolarHBondContact O-N 3.24Å
144E91.8Very high92.9Very high175 Ų17561.4 Ų61.482%0.81831%0.306SS*.Hα-helixtrans-60.6-44.2179.3-65.7-179.2175.200112.1N142 Y146 S147 Y148N142-E144 PolarHBondContact O-N 3.38Å; E144-Y146 PolarHBondContact O-N 3.45Å; E144-S147 WeakPolarHBondContact O-CB 3.48Å; E144-S147 PolarHBondContact O-N 2.85Å; E144-Y148 PolarHBondContact O-N 2.88Å
145R92Very high93Very high65 Ų6563 Ų6325%0.24531%0.312CS..Hα-helixtrans-58-49.9174.6176.5-166.3172.698.7-7.2110.9N142 Q143 S147 Y148 L149 E341N142-R145 HydrophobicContact CB-CB 4.21Å; N142-R145 WeakPolarHBondContact O-CB 3.38Å; N142-R145 PolarHBondContact O-N 2.79Å; Q143-R145 PolarHBondContact O-N 2.78Å; R145-S147 VanDerWaalsContact C-N 3.34Å; R145-S147 PolarHBondContact O-N 3.32Å; R145-Y148 PolarHBondContact O-N 3.3Å; R145-L149 WeakPolarHBondContact O-CB 3.39Å; R145-L149 PolarHBondContact O-N 2.87Å; R145-E341 IonicContact CZ-OE1 2.68Å; R145-E341 IonicContact CZ-OE2 3.38Å; R145-E341 VanDerWaalsContact NH1-CG 3.25Å; R145-E341 IonicContact NH1-OE1 2.74Å; R145-E341 PolarHBondContact NH1-OE1 2.76Å; R145-E341 IonicContact NH1-OE2 3.47Å; R145-E341 PolarHBondContact NH1-OE2 3.21Å; R145-E341 IonicContact NH2-OE1 2.78Å; R145-E341 IonicContact NH2-OE2 2.92Å; R145-E341 PolarHBondContact NH2-OE2 3.24Å
146Y93.2Very high93Very high23 Ų2365.9 Ų65.99%0.0933%0.325CS..Hα-helixtrans-68.9-32.5-179.1-67.4-50.1000112.7R112 L116 I139 R141 N142 Q143 E144 L149 V150R112-Y146 WeakPolarHBondContact CD-OH 3.43Å; R112-Y146 HydrophobicContact CG-CE1 4.48Å; L116-Y146 HydrophobicContact CD1-CD1 3.31Å; L116-Y146 HydrophobicContact CD1-CD2 4.14Å; L116-Y146 HydrophobicContact CD1-CE1 3.63Å; L116-Y146 HydrophobicContact CD1-CE2 4.37Å; L116-Y146 HydrophobicContact CD1-CG 3.62Å; I139-Y146 HydrophobicContact CD1-CD2 4.4Å; I139-Y146 HydrophobicContact CG2-CD2 3.77Å; I139-Y146 HydrophobicContact CG2-CE2 3.94Å; R141-Y146 WeakPolarHBondContact O-CD2 3.4Å; R141-Y146 VanDerWaalsContact O-CE2 3.25Å; R141-Y146 WeakPolarHBondContact O-CE2 3.25Å; N142-Y146 HydrophobicContact CB-CD2 4.02Å; N142-Y146 HydrophobicContact CB-CE2 3.71Å; N142-Y146 WeakPolarHBondContact O-CD2 3.28Å; N142-Y146 PolarHBondContact O-N 2.91Å; Q143-Y146 PolarHBondContact O-N 3.47Å; E144-Y146 PolarHBondContact O-N 3.45Å; Y146-L149 PolarHBondContact O-N 3.43Å; Y146-V150 WeakPolarHBondContact O-CB 3.28Å; Y146-V150 VanDerWaalsContact O-CG2 3.28Å; Y146-V150 WeakPolarHBondContact O-CG2 3.11Å; Y146-V150 PolarHBondContact O-N 3.45Å
147S94.8Very high93.1Very high19 Ų1965.8 Ų65.813%0.13332%0.324CS..Hα-helixtrans-60.8-46.5171.7-174.90000111.1Q133 Q143 E144 R145 L151Q133-S147 PolarHBondContact NE2-OG 3.47Å; Q143-S147 WeakPolarHBondContact O-CB 3.45Å; Q143-S147 PolarHBondContact O-N 3.24Å; E144-S147 WeakPolarHBondContact O-CB 3.48Å; E144-S147 PolarHBondContact O-N 2.85Å; R145-S147 VanDerWaalsContact C-N 3.34Å; R145-S147 PolarHBondContact O-N 3.32Å; S147-L151 WeakPolarHBondContact O-CB 3.23Å; S147-L151 PolarHBondContact O-N 3.46Å
148Y93.1Very high93.3Very high90 Ų9064.4 Ų64.435%0.35331%0.311SS..Hα-helixtrans-63.8-43.5175.6175.5-91.1000111.3E144 R145 L151 N152 K349E144-Y148 PolarHBondContact O-N 2.88Å; R145-Y148 PolarHBondContact O-N 3.3Å; Y148-L151 PolarHBondContact O-N 3.49Å; Y148-N152 WeakPolarHBondContact CD1-ND2 3.41Å; Y148-N152 VanDerWaalsContact CD2-ND2 3.28Å; Y148-N152 WeakPolarHBondContact CD2-ND2 3.2Å; Y148-N152 WeakPolarHBondContact CE1-ND2 3.32Å; Y148-N152 WeakPolarHBondContact CE2-ND2 3.35Å; Y148-N152 PolarHBondContact O-N 3Å; Y148-N152 VanDerWaalsContact O-N 3.12Å; Y148-N152 PolarHBondContact O-ND2 2.91Å; Y148-K349 PolarHBondContact OH-NZ 2.86Å
149L92.7Very high93.5Very high3 Ų367.5 Ų67.52%0.01633%0.325CS..Hα-helixtrans-64.7-53-177.1-169.9145.1000112.2D113 R145 Y146 L151 N152 S153 I340D113-L149 HydrophobicContact CB-CD1 3.47Å; D113-L149 VanDerWaalsContact CB-CD1 3.47Å; D113-L149 HydrophobicContact CB-CD2 3.53Å; D113-L149 HydrophobicContact CB-CG 4.1Å; D113-L149 WeakPolarHBondContact O-CD2 3.23Å; D113-L149 WeakPolarHBondContact OD1-CD1 3.38Å; D113-L149 VanDerWaalsContact OD2-CD1 3.26Å; D113-L149 WeakPolarHBondContact OD2-CD1 3.47Å; R145-L149 WeakPolarHBondContact O-CB 3.39Å; R145-L149 PolarHBondContact O-N 2.87Å; Y146-L149 PolarHBondContact O-N 3.43Å; L149-L151 PolarHBondContact O-N 3.5Å; L149-N152 PolarHBondContact O-N 3.19Å; L149-N152 VanDerWaalsContact O-N 3.13Å; L149-S153 WeakPolarHBondContact O-CB 3.44Å; L149-S153 PolarHBondContact O-N 3.18Å; L149-S153 PolarHBondContact O-OG 3.49Å; L149-I340 HydrophobicContact CD1-CD1 3.93Å; L149-I340 HydrophobicContact CG-CD1 4.4Å
150V95.3Very high93.7Very high0 Ų067.8 Ų67.80%033%0.328CS..Hα-helixtrans-58.6-39.8-178.6169.70000110.3L116 Y120 L132 F135 I136 Y146 E154L116-V150 HydrophobicContact CB-CG2 4.03Å; Y120-V150 HydrophobicContact CD1-CG1 3.27Å; Y120-V150 HydrophobicContact CE1-CG1 3.91Å; Y120-V150 HydrophobicContact CG-CG1 3.63Å; L132-V150 HydrophobicContact CD1-CB 4.07Å; L132-V150 HydrophobicContact CD1-CG1 3.68Å; F135-V150 HydrophobicContact CE1-CG2 4.39Å; I136-V150 HydrophobicContact CD1-CG2 4.41Å; Y146-V150 WeakPolarHBondContact O-CB 3.28Å; Y146-V150 VanDerWaalsContact O-CG2 3.28Å; Y146-V150 WeakPolarHBondContact O-CG2 3.11Å; Y146-V150 PolarHBondContact O-N 3.45Å; V150-E154 VanDerWaalsContact O-CB 3.32Å; V150-E154 WeakPolarHBondContact O-CB 3.35Å; V150-E154 PolarHBondContact O-N 3.28Å
151L94.2Very high94.3Very high104 Ų10462.9 Ų62.955%0.54530%0.296SS..Hα-helixtrans-63.7-42.5178.1-175.964.7000112.7L132 S147 Y148 L149L132-L151 HydrophobicContact CD2-CB 4.26Å; S147-L151 WeakPolarHBondContact O-CB 3.23Å; S147-L151 PolarHBondContact O-N 3.46Å; Y148-L151 PolarHBondContact O-N 3.49Å; L149-L151 PolarHBondContact O-N 3.5Å
152N91.7Very high94.7Very high83 Ų8355.8 Ų55.844%0.44428%0.284SS..Hα-helixtrans-84.1-24.6-177-67.2-54.1000113.6Y148 L149Y148-N152 WeakPolarHBondContact CD1-ND2 3.41Å; Y148-N152 VanDerWaalsContact CD2-ND2 3.28Å; Y148-N152 WeakPolarHBondContact CD2-ND2 3.2Å; Y148-N152 WeakPolarHBondContact CE1-ND2 3.32Å; Y148-N152 WeakPolarHBondContact CE2-ND2 3.35Å; Y148-N152 PolarHBondContact O-N 3Å; Y148-N152 VanDerWaalsContact O-N 3.12Å; Y148-N152 PolarHBondContact O-ND2 2.91Å; L149-N152 PolarHBondContact O-N 3.19Å; L149-N152 VanDerWaalsContact O-N 3.13Å
153S93.8Very high95Very high25 Ų2556.8 Ų56.818%0.17528%0.282CS..Hα-helixtrans-90-13178.5-62.20000113.2L149 F156 L157L149-S153 WeakPolarHBondContact O-CB 3.44Å; L149-S153 PolarHBondContact O-N 3.18Å; L149-S153 PolarHBondContact O-OG 3.49Å; S153-F156 PolarHBondContact O-N 2.94Å; S153-L157 WeakPolarHBondContact O-CB 3.27Å; S153-L157 PolarHBondContact O-N 3.43Å
154E95.8Very high95.2Very high31 Ų3153.6 Ų53.615%0.14527%0.267CS..Hα-helixtrans-56.4-54.7-178.7169.7166.6-163.200112.4V121 K124 V150 F156 L157 M158V121-E154 HydrophobicContact CG2-CB 4.46Å; V121-E154 HydrophobicContact CG2-CG 3.92Å; K124-E154 IonicContact NZ-OE1 2.63Å; K124-E154 PolarHBondContact NZ-OE1 3.08Å; K124-E154 IonicContact NZ-OE2 2.92Å; K124-E154 PolarHBondContact NZ-OE2 3.2Å; V150-E154 VanDerWaalsContact O-CB 3.32Å; V150-E154 WeakPolarHBondContact O-CB 3.35Å; V150-E154 PolarHBondContact O-N 3.28Å; E154-F156 PolarHBondContact O-N 3.31Å; E154-L157 PolarHBondContact O-N 3.35Å; E154-M158 HydrophobicContact CG-SD 4.32Å; E154-M158 WeakPolarHBondContact O-CG 3.44Å; E154-M158 PolarHBondContact O-N 2.92Å; E154-M158 VanDerWaalsContact O-N 3.12Å
155L96.4Very high95.5Very high96 Ų9647.2 Ų47.250%0.50324%0.239SC..Hα-helixtrans-64.3-43.3-178.9179.461000111.3L157 M158 E159L155-L157 VanDerWaalsContact C-N 3.32Å; L155-L157 PolarHBondContact O-N 2.92Å; L155-M158 WeakPolarHBondContact O-CB 3.29Å; L155-M158 PolarHBondContact O-N 3.44Å; L155-M158 VanDerWaalsContact O-N 3.11Å; L155-E159 HydrophobicContact CD1-CG 4.48Å; L155-E159 WeakPolarHBondContact O-CG 3.32Å; L155-E159 PolarHBondContact O-N 2.9Å
156F96.1Very high95.7Very high60 Ų6050.6 Ų50.626%0.26325%0.251SS..Hα-helixtrans-59.1-43.5177.8176.2-111.7000111.8F100 H104 F109 S153 E154 M158 E159 S160F100-F156 HydrophobicContact CE2-CD1 4.29Å; F100-F156 AromaticContact CE2-CE1 3.72Å; F100-F156 HydrophobicContact CE2-CE1 3.72Å; F100-F156 HydrophobicContact CE2-CZ 4.44Å; F100-F156 AromaticContact CZ-CE1 3.86Å; F100-F156 HydrophobicContact CZ-CE1 3.86Å; H104-F156 AromaticContact CE1-CZ 3.95Å; F109-F156 AromaticContact CD1-CE1 3.73Å; F109-F156 HydrophobicContact CD1-CE1 3.73Å; F109-F156 HydrophobicContact CD1-CZ 4.35Å; F109-F156 HydrophobicContact CE1-CD1 4.19Å; F109-F156 AromaticContact CE1-CE1 3.25Å; F109-F156 HydrophobicContact CE1-CE1 3.25Å; F109-F156 AromaticContact CE1-CZ 3.52Å; F109-F156 HydrophobicContact CE1-CZ 3.52Å; F109-F156 HydrophobicContact CE2-CE1 4.26Å; F109-F156 HydrophobicContact CE2-CZ 4.02Å; F109-F156 HydrophobicContact CG-CE1 4.4Å; F109-F156 AromaticContact CZ-CE1 3.55Å; F109-F156 HydrophobicContact CZ-CE1 3.55Å; F109-F156 HydrophobicContact CZ-CE2 4.37Å; F109-F156 AromaticContact CZ-CZ 3.3Å; F109-F156 HydrophobicContact CZ-CZ 3.3Å; S153-F156 PolarHBondContact O-N 2.94Å; E154-F156 PolarHBondContact O-N 3.31Å; F156-M158 VanDerWaalsContact C-N 3.35Å; F156-M158 PolarHBondContact O-N 3.03Å; F156-E159 PolarHBondContact O-N 3.42Å; F156-S160 WeakPolarHBondContact O-CB 3.49Å; F156-S160 PolarHBondContact O-N 2.85Å; F156-S160 PolarHBondContact O-OG 3.4Å; F156-S160 VanDerWaalsContact O-OG 3.11Å
157L98Very high95.8Very high0 Ų049.6 Ų49.60%025%0.248CC..Hα-helixtrans-59.6-45174.4175.363.2000111.5F100 T117 C118 V121 S153 E154 L155 E159 S160 L161F100-L157 HydrophobicContact CB-CD1 4.23Å; F100-L157 HydrophobicContact CD2-CD1 3.62Å; F100-L157 HydrophobicContact CE2-CD1 4.39Å; F100-L157 HydrophobicContact CG-CD1 4.21Å; T117-L157 HydrophobicContact CG2-CB 4.1Å; T117-L157 HydrophobicContact CG2-CD2 3.76Å; C118-L157 HydrophobicContact CB-CD2 4.34Å; V121-L157 HydrophobicContact CB-CD2 4.21Å; V121-L157 HydrophobicContact CG2-CD2 4.05Å; S153-L157 WeakPolarHBondContact O-CB 3.27Å; S153-L157 PolarHBondContact O-N 3.43Å; E154-L157 PolarHBondContact O-N 3.35Å; L155-L157 VanDerWaalsContact C-N 3.32Å; L155-L157 PolarHBondContact O-N 2.92Å; L157-E159 VanDerWaalsContact C-N 3.32Å; L157-E159 PolarHBondContact O-N 3.31Å; L157-S160 PolarHBondContact O-N 2.63Å; L157-L161 HydrophobicContact CD1-CD1 3.95Å; L157-L161 HydrophobicContact CD1-CG 4.14Å; L157-L161 HydrophobicContact CG-CD1 4.02Å; L157-L161 VanDerWaalsContact O-CG 3.24Å; L157-L161 WeakPolarHBondContact O-CG 3.48Å; L157-L161 PolarHBondContact O-N 3Å
158M98Very high95.9Very high40 Ų4052.2 Ų52.220%0.19726%0.255CS..Hα-helixtrans-61.8-40.6178.9-68.2174.455.300111.9V121 E154 L155 F156 L161 G162 Y163 L165V121-M158 HydrophobicContact CG1-CG 4.49Å; E154-M158 HydrophobicContact CG-SD 4.32Å; E154-M158 WeakPolarHBondContact O-CG 3.44Å; E154-M158 PolarHBondContact O-N 2.92Å; E154-M158 VanDerWaalsContact O-N 3.12Å; L155-M158 WeakPolarHBondContact O-CB 3.29Å; L155-M158 PolarHBondContact O-N 3.44Å; L155-M158 VanDerWaalsContact O-N 3.11Å; F156-M158 VanDerWaalsContact C-N 3.35Å; F156-M158 PolarHBondContact O-N 3.03Å; M158-L161 PolarHBondContact O-N 3.42Å; M158-G162 PolarHBondContact O-N 3.27Å; M158-Y163 HydrophobicContact CB-CD1 4.14Å; M158-Y163 HydrophobicContact CB-CE1 4.06Å; M158-Y163 HydrophobicContact CE-CD1 3.94Å; M158-Y163 HydrophobicContact CE-CE1 4Å; M158-Y163 PolarHBondContact O-N 3.29Å; M158-L165 HydrophobicContact CE-CD1 4.01Å; M158-L165 HydrophobicContact CG-CD1 4.46Å; M158-L165 HydrophobicContact CG-CD2 4.3Å
159E97.5Very high96.1Very high102 Ų10248.5 Ų48.548%0.47724%0.242SC..Hα-helixtrans-64.4-45.5174.9-71.3177.9156.700112.2L155 F156 L157 L161 G162 Y163L155-E159 HydrophobicContact CD1-CG 4.48Å; L155-E159 WeakPolarHBondContact O-CG 3.32Å; L155-E159 PolarHBondContact O-N 2.9Å; F156-E159 PolarHBondContact O-N 3.42Å; L157-E159 VanDerWaalsContact C-N 3.32Å; L157-E159 PolarHBondContact O-N 3.31Å; E159-L161 PolarHBondContact O-N 3.04Å; E159-G162 PolarHBondContact O-N 2.94Å; E159-Y163 HydrophobicContact CG-CE2 4.02Å; E159-Y163 VanDerWaalsContact CG-OH 3.23Å; E159-Y163 WeakPolarHBondContact CG-OH 3.47Å
160S96.9Very high96.4Very high17 Ų1748.5 Ų48.512%0.11924%0.242CC..Hα-helixtrans-59.6-29.6175.7-67.80000113.2H104 F156 L157 G162H104-S160 PolarHBondContact CD2-OG 2.59Å; H104-S160 VanDerWaalsContact NE2-CB 3.33Å; H104-S160 WeakPolarHBondContact NE2-CB 3.46Å; H104-S160 PolarHBondContact NE2-OG 2.96Å; F156-S160 WeakPolarHBondContact O-CB 3.49Å; F156-S160 PolarHBondContact O-N 2.85Å; F156-S160 PolarHBondContact O-OG 3.4Å; F156-S160 VanDerWaalsContact O-OG 3.11Å; L157-S160 PolarHBondContact O-N 2.63Å; S160-G162 VanDerWaalsContact C-N 3.3Å
161L97.7Very high96.5Very high0 Ų048.9 Ų48.90%024%0.243CC..THydrogen-bonded Turntrans-86.94175.7-63.9174000113W11 Y96 R99 L157 M158 E159 Y163 D164 L165W11-L161 WeakPolarHBondContact CZ2-O 3.34Å; Y96-L161 HydrophobicContact CD1-CD1 3.65Å; Y96-L161 HydrophobicContact CD2-CD1 4.38Å; Y96-L161 HydrophobicContact CE1-CD1 4.17Å; Y96-L161 HydrophobicContact CG-CD1 3.75Å; R99-L161 HydrophobicContact CB-CD2 3.51Å; R99-L161 HydrophobicContact CG-CD2 4.49Å; L157-L161 HydrophobicContact CD1-CD1 3.95Å; L157-L161 HydrophobicContact CD1-CG 4.14Å; L157-L161 HydrophobicContact CG-CD1 4.02Å; L157-L161 VanDerWaalsContact O-CG 3.24Å; L157-L161 WeakPolarHBondContact O-CG 3.48Å; L157-L161 PolarHBondContact O-N 3Å; M158-L161 PolarHBondContact O-N 3.42Å; E159-L161 PolarHBondContact O-N 3.04Å; L161-Y163 PolarHBondContact O-N 3.11Å; L161-Y163 VanDerWaalsContact O-N 3.17Å; L161-D164 WeakPolarHBondContact O-CB 3.43Å; L161-D164 PolarHBondContact O-N 3.4Å; L161-L165 HydrophobicContact CD1-CD2 4.15Å
162G96.9Very high96.6Very high48 Ų4851.3 Ų51.350%0.49525%0.252SS..THydrogen-bonded Turntrans61.223.2-176.700000113.4M158 E159 S160 D164M158-G162 PolarHBondContact O-N 3.27Å; E159-G162 PolarHBondContact O-N 2.94Å; S160-G162 VanDerWaalsContact C-N 3.3Å; G162-D164 PolarHBondContact O-N 2.94Å
163Y97.3Very high96.8Very high125 Ų12548.7 Ų48.749%0.4924%0.242SC..THydrogen-bonded Turntrans6016.3-171.2-58-91.5000114.8M158 E159 L161 L165M158-Y163 HydrophobicContact CB-CD1 4.14Å; M158-Y163 HydrophobicContact CB-CE1 4.06Å; M158-Y163 HydrophobicContact CE-CD1 3.94Å; M158-Y163 HydrophobicContact CE-CE1 4Å; M158-Y163 PolarHBondContact O-N 3.29Å; E159-Y163 HydrophobicContact CG-CE2 4.02Å; E159-Y163 VanDerWaalsContact CG-OH 3.23Å; E159-Y163 WeakPolarHBondContact CG-OH 3.47Å; L161-Y163 PolarHBondContact O-N 3.11Å; L161-Y163 VanDerWaalsContact O-N 3.17Å; Y163-L165 PolarHBondContact O-N 3.45Å
164D96.7Very high97Very high20 Ų2047.5 Ų47.511%0.10723%0.234CC..  trans-8065.6175.4-69.5-35.6000111.8T6 N10 W11 R99 L161 G162T6-D164 WeakPolarHBondContact CB-OD1 3.48Å; T6-D164 VanDerWaalsContact CG2-OD1 3.29Å; T6-D164 WeakPolarHBondContact CG2-OD1 3.34Å; T6-D164 PolarHBondContact OG1-OD1 3.4Å; N10-D164 PolarHBondContact ND2-OD2 3Å; W11-D164 VanDerWaalsContact NE1-CB 3.31Å; W11-D164 PolarHBondContact NE1-OD2 3.47Å; R99-D164 PolarHBondContact NH1-O 3.15Å; L161-D164 WeakPolarHBondContact O-CB 3.43Å; L161-D164 PolarHBondContact O-N 3.4Å; G162-D164 PolarHBondContact O-N 2.94Å
165L96.8Very high97.1Very high41 Ų4148.7 Ų48.722%0.21524%0.243CC..  trans-78.3-23.4-173.5-59.5-174.4000113.6F92 Y96 A125 M158 L161 Y163 V167F92-L165 WeakPolarHBondContact CE1-O 3.41Å; Y96-L165 HydrophobicContact CE1-CD2 4.42Å; Y96-L165 WeakPolarHBondContact OH-CA 3.41Å; Y96-L165 WeakPolarHBondContact OH-CB 3.02Å; Y96-L165 PolarHBondContact OH-O 3.39Å; A125-L165 HydrophobicContact CB-CB 4.46Å; M158-L165 HydrophobicContact CE-CD1 4.01Å; M158-L165 HydrophobicContact CG-CD1 4.46Å; M158-L165 HydrophobicContact CG-CD2 4.3Å; L161-L165 HydrophobicContact CD1-CD2 4.15Å; Y163-L165 PolarHBondContact O-N 3.45Å; L165-V167 PolarHBondContact O-N 3.17Å
166W96.2Very high97.1Very high136 Ų13645.5 Ų45.552%0.51523%0.233SC..  trans-73.5124.7180-170-100.1000111.5F92 Y168F92-W166 HydrophobicContact CZ-CE3 4.26Å; F92-W166 HydrophobicContact CZ-CZ3 4.37Å; W166-Y168 AromaticContact CD1-CD2 3.84Å; W166-Y168 AromaticContact CD1-CE2 3.4Å; W166-Y168 VanDerWaalsContact CD1-CE2 3.4Å; W166-Y168 AromaticContact CD1-CZ 3.84Å; W166-Y168 AromaticContact NE1-CD2 3.86Å; W166-Y168 AromaticContact NE1-CE1 3.8Å; W166-Y168 AromaticContact NE1-CE2 3.45Å; W166-Y168 AromaticContact NE1-CZ 3.44Å
167V96.7Very high97.2Very high2 Ų244 Ų441%0.01223%0.227CC..  trans-123.2123.7178.3-177.40000109.8F92 T95 Y96 L165 T169F92-V167 HydrophobicContact CD1-CB 4.14Å; F92-V167 HydrophobicContact CD1-CG2 4.18Å; F92-V167 HydrophobicContact CD2-CB 3.96Å; F92-V167 HydrophobicContact CE1-CB 4.18Å; F92-V167 HydrophobicContact CE1-CG2 4.47Å; F92-V167 HydrophobicContact CE2-CB 4Å; F92-V167 WeakPolarHBondContact CE2-O 3.47Å; F92-V167 HydrophobicContact CG-CB 4.05Å; F92-V167 HydrophobicContact CG-CG2 4.31Å; F92-V167 HydrophobicContact CZ-CB 4.12Å; F92-V167 VanDerWaalsContact CZ-O 3.28Å; F92-V167 WeakPolarHBondContact CZ-O 3.13Å; T95-V167 HydrophobicContact CG2-CG1 3.89Å; T95-V167 HydrophobicContact CG2-CG2 4.04Å; Y96-V167 HydrophobicContact CD1-CG2 4.24Å; Y96-V167 HydrophobicContact CE1-CG2 3.72Å; L165-V167 PolarHBondContact O-N 3.17Å; V167-T169 HydrophobicContact CG1-CG2 4.2Å; V167-T169 PolarHBondContact O-N 3.31Å
168Y97Very high97.1Very high73 Ų7344 Ų4429%0.28623%0.227SC..  trans-81.1108.6165.1-66.1-92.4000108.2A1 Y2 S5 W166 P232A1-Y168 HydrophobicContact CB-CE1 3.99Å; Y2-Y168 AromaticContact CD2-CD2 3.83Å; Y2-Y168 HydrophobicContact CD2-CD2 3.83Å; Y2-Y168 HydrophobicContact CD2-CG 4.03Å; S5-Y168 VanDerWaalsContact CB-CE2 3.41Å; W166-Y168 AromaticContact CD1-CD2 3.84Å; W166-Y168 AromaticContact CD1-CE2 3.4Å; W166-Y168 VanDerWaalsContact CD1-CE2 3.4Å; W166-Y168 AromaticContact CD1-CZ 3.84Å; W166-Y168 AromaticContact NE1-CD2 3.86Å; W166-Y168 AromaticContact NE1-CE1 3.8Å; W166-Y168 AromaticContact NE1-CE2 3.45Å; W166-Y168 AromaticContact NE1-CZ 3.44Å; Y168-P232 WeakPolarHBondContact O-CB 3.46Å; Y168-P232 WeakPolarHBondContact O-CG 3.5Å
169T97.4Very high97Very high12 Ų1246.1 Ų46.17%0.07424%0.238CC..  trans-89.1162.5176.375.10000110.7E88 F92 V167 Y171E88-T169 PolarHBondContact OE1-OG1 3.31Å; E88-T169 WeakPolarHBondContact OE2-CB 3.44Å; E88-T169 WeakPolarHBondContact OE2-CG2 3.4Å; E88-T169 PolarHBondContact OE2-OG1 3.08Å; F92-T169 HydrophobicContact CD2-CG2 3.74Å; F92-T169 HydrophobicContact CE2-CG2 3.94Å; V167-T169 HydrophobicContact CG1-CG2 4.2Å; V167-T169 PolarHBondContact O-N 3.31Å; T169-Y171 VanDerWaalsContact C-N 3.34Å; T169-Y171 HydrophobicContact CG2-CD2 4.4Å; T169-Y171 WeakPolarHBondContact OG1-CD2 3.44Å
170P97.8Very high96.8Very high3 Ų345.1 Ų45.12%0.01924%0.236CC..Hα-helixtrans-81.4-6.4178.331.3-32.4000113.9A173 L174 I218 Y222 P232 F235 A236P170-A173 PolarHBondContact O-N 3.31Å; P170-L174 VanDerWaalsContact O-CB 3.3Å; P170-L174 WeakPolarHBondContact O-CB 3.12Å; P170-L174 PolarHBondContact O-N 2.82Å; P170-I218 HydrophobicContact CB-CD1 4.06Å; P170-I218 HydrophobicContact CB-CG1 4.4Å; P170-I218 HydrophobicContact CG-CB 4.45Å; P170-I218 HydrophobicContact CG-CD1 3.95Å; P170-I218 HydrophobicContact CG-CG1 4.03Å; P170-I218 HydrophobicContact CG-CG2 3.56Å; P170-Y222 WeakPolarHBondContact CD-OH 3.37Å; P170-P232 WeakPolarHBondContact CB-O 3.28Å; P170-F235 HydrophobicContact CB-CB 4.14Å; P170-F235 HydrophobicContact CB-CD2 4.18Å; P170-F235 HydrophobicContact CB-CG 4.09Å; P170-F235 HydrophobicContact CG-CD1 4.23Å; P170-F235 HydrophobicContact CG-CD2 4.09Å; P170-F235 HydrophobicContact CG-CE1 4.42Å; P170-F235 HydrophobicContact CG-CE2 4.3Å; P170-F235 HydrophobicContact CG-CG 4.07Å; P170-F235 HydrophobicContact CG-CZ 4.46Å; P170-A236 HydrophobicContact CB-CB 3.86Å; P170-A236 WeakPolarHBondContact O-CB 3.25Å
171Y98.1Very high96.6Very high8 Ų844.3 Ų44.33%0.03123%0.231CC..Hα-helixtrans-65.9-47.8-172.7-59.2-68.8000113.3N87 Y90 T169 L174 T175 V215 I218 N219 Y222N87-Y171 HydrophobicContact CB-CD1 3.96Å; N87-Y171 HydrophobicContact CB-CD2 4.07Å; N87-Y171 HydrophobicContact CB-CE1 3.92Å; N87-Y171 HydrophobicContact CB-CE2 4.09Å; N87-Y171 HydrophobicContact CB-CG 4.02Å; N87-Y171 WeakPolarHBondContact O-CE2 3.33Å; Y90-Y171 WeakPolarHBondContact CD1-OH 3.48Å; T169-Y171 VanDerWaalsContact C-N 3.34Å; T169-Y171 HydrophobicContact CG2-CD2 4.4Å; T169-Y171 WeakPolarHBondContact OG1-CD2 3.44Å; Y171-L174 PolarHBondContact O-N 3.13Å; Y171-T175 PolarHBondContact O-N 3.24Å; Y171-T175 PolarHBondContact O-OG1 3.1Å; Y171-V215 HydrophobicContact CD1-CG1 4.42Å; Y171-V215 HydrophobicContact CD1-CG2 3.98Å; Y171-V215 HydrophobicContact CE1-CG1 4.13Å; Y171-V215 HydrophobicContact CE1-CG2 4.47Å; Y171-I218 HydrophobicContact CD1-CB 4.3Å; Y171-I218 HydrophobicContact CD1-CD1 3.75Å; Y171-I218 HydrophobicContact CD1-CG2 3.92Å; Y171-I218 HydrophobicContact CE1-CB 3.81Å; Y171-I218 HydrophobicContact CE1-CD1 4.16Å; Y171-I218 HydrophobicContact CE1-CG2 3.28Å; Y171-I218 HydrophobicContact CE2-CG2 4.32Å; Y171-I218 HydrophobicContact CG-CD1 4.49Å; Y171-N219 PolarHBondContact OH-OD1 3.48Å; Y171-Y222 HydrophobicContact CE2-CE2 4.09Å; Y171-Y222 AromaticContact CZ-CE2 3.89Å; Y171-Y222 WeakPolarHBondContact OH-CE2 3.32Å
172Q95.4Very high96.3Very high155 Ų15544.6 Ų44.672%0.72423%0.232SC*.Hα-helixtrans-66.3-40.4178.6-170.9177.82.900111.4T175 G176Q172-T175 PolarHBondContact O-N 3.46Å; Q172-G176 PolarHBondContact O-N 2.9Å
173A96.9Very high96Very high29 Ų2944.2 Ų44.224%0.2422%0.224CC..Hα-helixtrans-62.9-43.7176.300000111.5P170 T175 G176 F177 A236P170-A173 PolarHBondContact O-N 3.31Å; A173-T175 VanDerWaalsContact C-N 3.33Å; A173-T175 PolarHBondContact O-N 3.24Å; A173-G176 PolarHBondContact O-N 3.32Å; A173-F177 HydrophobicContact CB-CE2 4.22Å; A173-F177 WeakPolarHBondContact O-CD2 3.35Å; A173-F177 WeakPolarHBondContact O-CG 3.49Å; A173-F177 PolarHBondContact O-N 3.35Å; A173-A236 HydrophobicContact CB-CB 3.66Å
174L98.2Very high95.6Very high0 Ų038.5 Ų38.50%020%0.202CC..Hα-helixtrans-57.7-47.5174.917371.1000110.9P170 Y171 G176 F177 V178 I218 A236 V239P170-L174 VanDerWaalsContact O-CB 3.3Å; P170-L174 WeakPolarHBondContact O-CB 3.12Å; P170-L174 PolarHBondContact O-N 2.82Å; Y171-L174 PolarHBondContact O-N 3.13Å; L174-G176 VanDerWaalsContact C-N 3.3Å; L174-G176 PolarHBondContact O-N 3.2Å; L174-F177 PolarHBondContact O-N 3.32Å; L174-V178 HydrophobicContact CD1-CG2 4.05Å; L174-V178 HydrophobicContact CG-CG2 4.28Å; L174-V178 VanDerWaalsContact O-CG2 3.31Å; L174-V178 WeakPolarHBondContact O-CG2 3.44Å; L174-V178 PolarHBondContact O-N 2.96Å; L174-I218 HydrophobicContact CB-CD1 4.01Å; L174-I218 HydrophobicContact CD2-CD1 3.54Å; L174-I218 HydrophobicContact CG-CD1 4.35Å; L174-A236 HydrophobicContact CB-CB 4.11Å; L174-V239 HydrophobicContact CD1-CB 4.48Å; L174-V239 HydrophobicContact CD1-CG1 4Å; L174-V239 HydrophobicContact CD2-CG1 4.44Å
175T97.4Very high95.2Very high55 Ų5538.1 Ų38.134%0.33720%0.2SC..Hα-helixtrans-58.8-43.9179.8-560000111.2Y171 Q172 A173 V178 I179Y171-T175 PolarHBondContact O-N 3.24Å; Y171-T175 PolarHBondContact O-OG1 3.1Å; Q172-T175 PolarHBondContact O-N 3.46Å; A173-T175 VanDerWaalsContact C-N 3.33Å; A173-T175 PolarHBondContact O-N 3.24Å; T175-V178 PolarHBondContact O-N 2.93Å; T175-I179 HydrophobicContact CG2-CD1 4.04Å; T175-I179 VanDerWaalsContact O-CG1 3.29Å; T175-I179 WeakPolarHBondContact O-CG1 3.43Å; T175-I179 PolarHBondContact O-N 3.46Å; T175-I179 VanDerWaalsContact O-N 3.07Å
176G96.5Very high94.5Very high29 Ų2942.4 Ų42.430%0.29921%0.213SC..Hα-helixtrans-59.1-50.6174.100000112.3Q172 A173 L174 V178 I179 D180Q172-G176 PolarHBondContact O-N 2.9Å; A173-G176 PolarHBondContact O-N 3.32Å; L174-G176 VanDerWaalsContact C-N 3.3Å; L174-G176 PolarHBondContact O-N 3.2Å; G176-V178 VanDerWaalsContact C-N 3.32Å; G176-V178 PolarHBondContact O-N 3.18Å; G176-I179 PolarHBondContact O-N 2.83Å; G176-D180 PolarHBondContact O-N 3.08Å
177F97.1Very high94Very high28 Ų2839.7 Ų39.712%0.12320%0.203CC..Hα-helixtrans-62.2-36.9179.4-66.5-46.1000113.5A173 L174 D180 L181 S233 A236 L237 L240 L260A173-F177 HydrophobicContact CB-CE2 4.22Å; A173-F177 WeakPolarHBondContact O-CD2 3.35Å; A173-F177 WeakPolarHBondContact O-CG 3.49Å; A173-F177 PolarHBondContact O-N 3.35Å; L174-F177 PolarHBondContact O-N 3.32Å; F177-D180 PolarHBondContact O-N 3.4Å; F177-L181 VanDerWaalsContact O-CB 3.26Å; F177-L181 WeakPolarHBondContact O-CB 3.34Å; F177-L181 PolarHBondContact O-N 2.87Å; F177-S233 WeakPolarHBondContact CE2-O 3.49Å; F177-A236 HydrophobicContact CD2-CB 4.03Å; F177-A236 HydrophobicContact CE2-CB 3.98Å; F177-L237 HydrophobicContact CD2-CD1 4.37Å; F177-L237 HydrophobicContact CE2-CB 4.11Å; F177-L237 HydrophobicContact CE2-CD1 4.41Å; F177-L237 HydrophobicContact CG-CD1 4.43Å; F177-L237 HydrophobicContact CZ-CD1 4.49Å; F177-L240 HydrophobicContact CB-CD2 3.75Å; F177-L260 HydrophobicContact CE1-CD1 4.34Å; F177-L260 HydrophobicContact CE1-CD2 4.19Å
178V96.4Very high93.3Very high0 Ų042.3 Ų42.30%022%0.216CC..Hα-helixtrans-65.7-43.6176169.70000110.9L174 T175 G176 D180 L181 V182 V207 L210 L240L174-V178 HydrophobicContact CD1-CG2 4.05Å; L174-V178 HydrophobicContact CG-CG2 4.28Å; L174-V178 VanDerWaalsContact O-CG2 3.31Å; L174-V178 WeakPolarHBondContact O-CG2 3.44Å; L174-V178 PolarHBondContact O-N 2.96Å; T175-V178 PolarHBondContact O-N 2.93Å; G176-V178 VanDerWaalsContact C-N 3.32Å; G176-V178 PolarHBondContact O-N 3.18Å; V178-D180 VanDerWaalsContact C-N 3.35Å; V178-L181 PolarHBondContact O-N 3.08Å; V178-V182 WeakPolarHBondContact O-CG2 3.34Å; V178-V182 PolarHBondContact O-N 3.41Å; V178-V207 HydrophobicContact CG1-CB 4.27Å; V178-V207 HydrophobicContact CG1-CG1 4.07Å; V178-V207 HydrophobicContact CG1-CG2 4.28Å; V178-L210 HydrophobicContact CG1-CB 3.66Å; V178-L210 HydrophobicContact CG1-CD1 4.07Å; V178-L210 HydrophobicContact CG2-CB 4.13Å; V178-L240 HydrophobicContact CG2-CD1 3.79Å
179I95.4Very high92.2Very high86 Ų8639.8 Ų39.844%0.44121%0.208SC..Hα-helixtrans-61.4-46176.5-68.9165.7000110.3T175 G176 L181 V182 A183 V207T175-I179 HydrophobicContact CG2-CD1 4.04Å; T175-I179 VanDerWaalsContact O-CG1 3.29Å; T175-I179 WeakPolarHBondContact O-CG1 3.43Å; T175-I179 PolarHBondContact O-N 3.46Å; T175-I179 VanDerWaalsContact O-N 3.07Å; G176-I179 PolarHBondContact O-N 2.83Å; I179-L181 PolarHBondContact O-N 3.37Å; I179-V182 PolarHBondContact O-N 3.25Å; I179-A183 WeakPolarHBondContact O-CB 3.2Å; I179-A183 PolarHBondContact O-N 3.3Å; I179-V207 HydrophobicContact CG1-CG1 4.01Å; I179-V207 HydrophobicContact CG1-CG2 4.43Å
180D94.1Very high90.7Very high80 Ų8042.4 Ų42.443%0.42824%0.238SC..Hα-helixtrans-63.4-41178.9-70-21.4000111.8G176 F177 V178 A183 Y184 F255G176-D180 PolarHBondContact O-N 3.08Å; F177-D180 PolarHBondContact O-N 3.4Å; V178-D180 VanDerWaalsContact C-N 3.35Å; D180-A183 PolarHBondContact O-N 2.97Å; D180-Y184 VanDerWaalsContact O-CB 3.3Å; D180-Y184 WeakPolarHBondContact O-CB 3.49Å; D180-Y184 PolarHBondContact O-N 3.41Å; D180-F255 HydrophobicContact CB-CE2 4.15Å; D180-F255 HydrophobicContact CB-CZ 3.7Å
181L93.1Very high88.7Confident1 Ų146 Ų461%0.00527%0.268CS..Hα-helixtrans-61.6-46.1176175.866.8000111.7F177 V178 I179 Y184 Q185 L240 L250 V252 F255F177-L181 VanDerWaalsContact O-CB 3.26Å; F177-L181 WeakPolarHBondContact O-CB 3.34Å; F177-L181 PolarHBondContact O-N 2.87Å; V178-L181 PolarHBondContact O-N 3.08Å; I179-L181 PolarHBondContact O-N 3.37Å; L181-Y184 WeakPolarHBondContact O-CB 3.35Å; L181-Y184 PolarHBondContact O-N 2.94Å; L181-Q185 WeakPolarHBondContact O-CB 3.37Å; L181-Q185 WeakPolarHBondContact O-CG 3.12Å; L181-Q185 PolarHBondContact O-N 3.43Å; L181-L240 HydrophobicContact CD2-CD1 3.89Å; L181-L240 HydrophobicContact CD2-CD2 4.48Å; L181-L240 HydrophobicContact CD2-CG 4.43Å; L181-L250 HydrophobicContact CD2-CB 4.46Å; L181-L250 HydrophobicContact CD2-CD1 4.4Å; L181-V252 HydrophobicContact CD1-CG2 4.25Å; L181-V252 HydrophobicContact CD2-CG2 3.81Å; L181-F255 HydrophobicContact CB-CD1 4.24Å; L181-F255 HydrophobicContact CB-CE1 4.11Å; L181-F255 HydrophobicContact CB-CZ 4.35Å; L181-F255 HydrophobicContact CD1-CB 3.72Å; L181-F255 HydrophobicContact CD1-CD1 3.73Å; L181-F255 HydrophobicContact CD1-CD2 4.34Å; L181-F255 HydrophobicContact CD1-CE1 4.45Å; L181-F255 HydrophobicContact CD1-CG 3.65Å
182V91.7Very high86.4Confident5 Ų551.6 Ų51.63%0.0329%0.294CS..Hα-helixtrans-65.5-41.2178.3172.70000110.7V178 I179 Y184 Q185 R186 D203 L206 V207 L210V178-V182 WeakPolarHBondContact O-CG2 3.34Å; V178-V182 PolarHBondContact O-N 3.41Å; I179-V182 PolarHBondContact O-N 3.25Å; V182-Y184 VanDerWaalsContact C-N 3.31Å; V182-Y184 PolarHBondContact O-N 2.91Å; V182-Q185 PolarHBondContact O-N 3.02Å; V182-R186 PolarHBondContact O-N 3.39Å; V182-D203 HydrophobicContact CG1-CB 3.89Å; V182-L206 HydrophobicContact CG1-CD2 4.37Å; V182-L206 HydrophobicContact CG2-CD2 3.81Å; V182-L206 HydrophobicContact CG2-CG 3.95Å; V182-V207 HydrophobicContact CB-CG2 4.05Å; V182-V207 HydrophobicContact CG1-CG2 4.26Å; V182-V207 HydrophobicContact CG2-CG2 3.78Å; V182-L210 HydrophobicContact CG2-CD1 4.36Å
183A89.8Confident84.4Confident40 Ų4049.4 Ų49.433%0.33130%0.296SS..Hα-helixtrans-64.3-35.3174.700000112.7I179 D180 R187I179-A183 WeakPolarHBondContact O-CB 3.2Å; I179-A183 PolarHBondContact O-N 3.3Å; D180-A183 PolarHBondContact O-N 2.97Å; A183-R187 WeakPolarHBondContact O-CG 3.49Å; A183-R187 PolarHBondContact O-N 3.19Å; A183-R187 PolarHBondContact O-NE 2.82Å; A183-R187 VanDerWaalsContact O-NE 3.11Å
184Y89.2Confident82.1Confident5 Ų555 Ų552%0.0232%0.322CS..Hα-helixtrans-67.4-49.3173.9172-98.3000111.7D180 L181 V182 R186 R187 I188 F255 E259 V266D180-Y184 VanDerWaalsContact O-CB 3.3Å; D180-Y184 WeakPolarHBondContact O-CB 3.49Å; D180-Y184 PolarHBondContact O-N 3.41Å; L181-Y184 WeakPolarHBondContact O-CB 3.35Å; L181-Y184 PolarHBondContact O-N 2.94Å; V182-Y184 VanDerWaalsContact C-N 3.31Å; V182-Y184 PolarHBondContact O-N 2.91Å; Y184-R186 VanDerWaalsContact C-N 3.29Å; Y184-R186 PolarHBondContact O-N 2.66Å; Y184-R187 WeakPolarHBondContact O-CB 3.31Å; Y184-R187 PolarHBondContact O-N 2.81Å; Y184-I188 HydrophobicContact CD1-CD1 4.12Å; Y184-I188 HydrophobicContact CD2-CD1 4.39Å; Y184-I188 HydrophobicContact CE1-CD1 3.4Å; Y184-I188 HydrophobicContact CE1-CG1 4.44Å; Y184-I188 HydrophobicContact CE2-CD1 3.71Å; Y184-I188 HydrophobicContact CE2-CG1 4.42Å; Y184-I188 PolarHBondContact O-N 3.19Å; Y184-I188 VanDerWaalsContact O-N 3.09Å; Y184-I188 WeakPolarHBondContact OH-CD1 3.28Å; Y184-F255 HydrophobicContact CD1-CB 3.76Å; Y184-F255 AromaticContact CD1-CD2 3.74Å; Y184-F255 HydrophobicContact CD1-CD2 3.74Å; Y184-F255 HydrophobicContact CD1-CG 4.16Å; Y184-F255 AromaticContact CD2-CD2 3.93Å; Y184-F255 HydrophobicContact CD2-CD2 3.93Å; Y184-F255 HydrophobicContact CE1-CB 3.7Å; Y184-F255 HydrophobicContact CE1-CD2 4.34Å; Y184-F255 HydrophobicContact CG-CB 4.37Å; Y184-F255 AromaticContact CG-CD2 3.49Å; Y184-F255 HydrophobicContact CG-CD2 3.49Å; Y184-F255 VanDerWaalsContact CG-CD2 3.49Å; Y184-F255 HydrophobicContact CG-CE2 4.26Å; Y184-F255 HydrophobicContact CG-CG 4.36Å; Y184-E259 HydrophobicContact CD2-CB 4.02Å; Y184-E259 HydrophobicContact CD2-CG 4.31Å; Y184-E259 HydrophobicContact CE2-CB 4.16Å; Y184-V266 HydrophobicContact CD2-CG2 4.25Å; Y184-V266 HydrophobicContact CE2-CG2 3.71Å
185Q87.3Confident80Confident13 Ų1356.2 Ų56.26%0.06133%0.33CS..Hα-helixtrans-54-45.7174.9-83.1-82.5-34.200111.2L181 V182 R187 I188 C189 L198 Q249 L250L181-Q185 WeakPolarHBondContact O-CB 3.37Å; L181-Q185 WeakPolarHBondContact O-CG 3.12Å; L181-Q185 PolarHBondContact O-N 3.43Å; V182-Q185 PolarHBondContact O-N 3.02Å; Q185-R187 VanDerWaalsContact C-N 3.29Å; Q185-R187 PolarHBondContact O-N 3.24Å; Q185-I188 PolarHBondContact O-N 3.32Å; Q185-C189 VanDerWaalsContact O-CB 3.3Å; Q185-C189 WeakPolarHBondContact O-CB 3.41Å; Q185-C189 PolarHBondContact O-N 2.83Å; Q185-C189 PolarHBondContact O-SG 3.05Å; Q185-L198 HydrophobicContact CB-CD1 4.06Å; Q185-Q249 PolarHBondContact NE2-O 3.04Å; Q185-L250 PolarHBondContact NE2-O 2.54Å
186R83.9Confident77.8Confident130 Ų13061.1 Ų61.149%0.49134%0.344SS..Hα-helixtrans-61.1-36.4177.3-169.367.6-176.8176.13.3112.9V182 Y184 G190 L198V182-R186 PolarHBondContact O-N 3.39Å; Y184-R186 VanDerWaalsContact C-N 3.29Å; Y184-R186 PolarHBondContact O-N 2.66Å; R186-G190 PolarHBondContact O-N 3.02Å; R186-L198 HydrophobicContact CB-CD1 4.38Å
187R83.9Confident75.8Confident80 Ų8062.2 Ų62.230%0.30234%0.343SS..Hα-helixtrans-68.2-44.5178.4-76.8179-93.2165.2-9.9111.9A183 Y184 Q185 G190 A191 E259A183-R187 WeakPolarHBondContact O-CG 3.49Å; A183-R187 PolarHBondContact O-N 3.19Å; A183-R187 PolarHBondContact O-NE 2.82Å; A183-R187 VanDerWaalsContact O-NE 3.11Å; Y184-R187 WeakPolarHBondContact O-CB 3.31Å; Y184-R187 PolarHBondContact O-N 2.81Å; Q185-R187 VanDerWaalsContact C-N 3.29Å; Q185-R187 PolarHBondContact O-N 3.24Å; R187-G190 PolarHBondContact O-N 3.33Å; R187-A191 PolarHBondContact O-N 2.82Å; R187-E259 IonicContact CZ-OE1 3.4Å; R187-E259 IonicContact NH1-OE1 2.81Å; R187-E259 PolarHBondContact NH1-OE1 3.24Å; R187-E259 IonicContact NH1-OE2 3.87Å; R187-E259 IonicContact NH2-OE1 3.22Å; R187-E259 PolarHBondContact NH2-OE1 2.93Å
188I82.5Confident73.9Confident57 Ų5761.3 Ų61.329%0.29234%0.339SS..Hα-helixtrans-69.5-42.1178.7-65.2-174.6000111.3Y184 Q185 G190 A191 H192 V266Y184-I188 HydrophobicContact CD1-CD1 4.12Å; Y184-I188 HydrophobicContact CD2-CD1 4.39Å; Y184-I188 HydrophobicContact CE1-CD1 3.4Å; Y184-I188 HydrophobicContact CE1-CG1 4.44Å; Y184-I188 HydrophobicContact CE2-CD1 3.71Å; Y184-I188 HydrophobicContact CE2-CG1 4.42Å; Y184-I188 PolarHBondContact O-N 3.19Å; Y184-I188 VanDerWaalsContact O-N 3.09Å; Y184-I188 WeakPolarHBondContact OH-CD1 3.28Å; Q185-I188 PolarHBondContact O-N 3.32Å; I188-G190 PolarHBondContact O-N 2.8Å; I188-A191 PolarHBondContact O-N 3.08Å; I188-H192 PolarHBondContact O-N 2.91Å; I188-H192 VanDerWaalsContact O-N 3.09Å; I188-V266 HydrophobicContact CD1-CG2 4.47Å; I188-V266 HydrophobicContact CG1-CG2 4.35Å
189C73.9Confident72.1Confident19 Ų1967.6 Ų67.613%0.12837%0.368CS..Hα-helixtrans-69-32.2177.1-60.50000112.4Q185 A191 H192 S195 L198Q185-C189 VanDerWaalsContact O-CB 3.3Å; Q185-C189 WeakPolarHBondContact O-CB 3.41Å; Q185-C189 PolarHBondContact O-N 2.83Å; Q185-C189 PolarHBondContact O-SG 3.05Å; C189-A191 PolarHBondContact O-N 3.48Å; C189-H192 CarbonylContact O-C 3.24Å; C189-H192 VanDerWaalsContact O-C 3.24Å; C189-H192 PolarHBondContact O-N 3.27Å; C189-S195 WeakPolarHBondContact SG-CB 3.11Å; C189-S195 PolarHBondContact SG-OG 3.13Å; C189-L198 HydrophobicContact CB-CD1 4.19Å
190G65.9Low70.7Confident67 Ų6770.5 Ų70.569%0.69138%0.384SS*.Hα-helixtrans-66.7-26172.300000113.4R186 R187 I188R186-G190 PolarHBondContact O-N 3.02Å; R187-G190 PolarHBondContact O-N 3.33Å; I188-G190 PolarHBondContact O-N 2.8Å
191A55.9Low69.8Low78 Ų7872.2 Ų72.265%0.64539%0.385SS*.Hα-helixtrans-83.2-26.5174.400000112.9R187 I188 C189R187-A191 PolarHBondContact O-N 2.82Å; I188-A191 PolarHBondContact O-N 3.08Å; C189-A191 PolarHBondContact O-N 3.48Å
192H50.8Low69.4Low126 Ų12674.8 Ų74.858%0.58340%0.403SS*.SBendtrans-117.6100.4178.1-65.8-54.8000110.1I188 C189 D194 S195I188-H192 PolarHBondContact O-N 2.91Å; I188-H192 VanDerWaalsContact O-N 3.09Å; C189-H192 CarbonylContact O-C 3.24Å; C189-H192 VanDerWaalsContact O-C 3.24Å; C189-H192 PolarHBondContact O-N 3.27Å; H192-D194 PolarHBondContact O-N 3.33Å; H192-S195 PolarHBondContact O-N 3.16Å
193S52Low69.2Low110 Ų11077.6 Ų77.677%0.76942%0.418SS*.THydrogen-bonded Turntrans-52.83.2-178.1-170.30000117
194D48.8Very low69.2Low146 Ų14679.3 Ų79.378%0.78143%0.432SS*.THydrogen-bonded Turntrans-117.69.8-169.8-75-19.7000114.7H192 Y196H192-D194 PolarHBondContact O-N 3.33Å; D194-Y196 PolarHBondContact O-N 2.88Å; D194-Y196 VanDerWaalsContact O-N 3.14Å
195S53.8Low69.3Low26 Ų2684.4 Ų84.418%0.18246%0.456CS..  trans-84.993.9178-1690000113.4C189 H192 L197C189-S195 WeakPolarHBondContact SG-CB 3.11Å; C189-S195 PolarHBondContact SG-OG 3.13Å; H192-S195 PolarHBondContact O-N 3.16Å; S195-L197 PolarHBondContact O-N 3.45Å; S195-L197 VanDerWaalsContact O-N 3.11Å
196Y51Low69.5Low158 Ų15884.7 Ų84.762%0.6246%0.458SS*.Hα-helixtrans-56.2-16176.454.1-86.5000116D194D194-Y196 PolarHBondContact O-N 2.88Å; D194-Y196 VanDerWaalsContact O-N 3.14Å
197L54.5Low70Confident52 Ų5279.9 Ų79.927%0.27244%0.443SS..Hα-helixtrans-74.5-39.7-170.3-64.6171.6000113.8S195 Q249S195-L197 PolarHBondContact O-N 3.45Å; S195-L197 VanDerWaalsContact O-N 3.11Å; L197-Q249 HydrophobicContact CD1-CB 3.51Å; L197-Q249 HydrophobicContact CD1-CG 3.67Å; L197-Q249 WeakPolarHBondContact CD1-O 3.46Å; L197-Q249 HydrophobicContact CD2-CB 4.14Å; L197-Q249 HydrophobicContact CD2-CG 3.86Å; L197-Q249 HydrophobicContact CG-CB 4.46Å; L197-Q249 HydrophobicContact CG-CG 4.41Å
198L57.7Low70.5Confident9 Ų979.9 Ų79.95%0.04745%0.449CS..Hα-helixtrans-92.3-12.1-177.7-82.7160.1000112.8Q185 R186 C189 N200 L206Q185-L198 HydrophobicContact CB-CD1 4.06Å; R186-L198 HydrophobicContact CB-CD1 4.38Å; C189-L198 HydrophobicContact CB-CD1 4.19Å; L198-N200 VanDerWaalsContact C-N 3.28Å; L198-N200 PolarHBondContact O-N 3.29Å; L198-L206 HydrophobicContact CD2-CD2 4.18Å
199E59.7Low71.1Confident132 Ų13279.5 Ų79.562%0.61745%0.446SS*.Hα-helixtrans-67.1-31.1-175.9-68.4-174.6159.700112.6
200N65.9Low72.1Confident146 Ų14678.6 Ų78.678%0.78144%0.44SS*.SBendtrans-103.9-4.7-174.6-66.6-41.4000114.6L198L198-N200 VanDerWaalsContact C-N 3.28Å; L198-N200 PolarHBondContact O-N 3.29Å
201R73.7Confident73.6Confident116 Ų11676.3 Ų76.344%0.43841%0.413SS..SBendtrans-128.6138.7-175-65-129.8-105-1726.7111E209R201-E209 IonicContact CZ-OE2 3.29Å; R201-E209 IonicContact NH1-OE2 2.74Å; R201-E209 PolarHBondContact NH1-OE2 3.34Å; R201-E209 IonicContact NH2-OE1 2.84Å; R201-E209 PolarHBondContact NH2-OE1 3.25Å; R201-E209 IonicContact NH2-OE2 3.86Å; R201-E209 PolarHBondContact NH2-OE2 3.21Å
202S85.8Confident75.6Confident55 Ų5578 Ų7839%0.38541%0.406SS..  trans-73.2143.4171.565.30000110.5A204 Q205 L206S202-A204 PolarHBondContact O-N 3.03Å; S202-Q205 WeakPolarHBondContact O-CB 3.4Å; S202-Q205 PolarHBondContact O-N 3.1Å; S202-Q205 WeakPolarHBondContact OG-CB 3.35Å; S202-Q205 WeakPolarHBondContact OG-CG 3.47Å; S202-Q205 PolarHBondContact OG-N 3.12Å; S202-Q205 PolarHBondContact OG-OE1 3.1Å; S202-L206 PolarHBondContact O-N 3.49Å; S202-L206 VanDerWaalsContact O-N 3.09Å
203D86.9Confident77.8Confident65 Ų6574.5 Ų74.535%0.34839%0.392SS..Hα-helixtrans-52.5-41.3176.2-61.7-4.7000111.1V182 Q205 L206 V207V182-D203 HydrophobicContact CG1-CB 3.89Å; D203-Q205 PolarHBondContact O-N 2.68Å; D203-L206 PolarHBondContact O-N 3.12Å; D203-V207 VanDerWaalsContact O-CG2 3.31Å; D203-V207 WeakPolarHBondContact O-CG2 3.4Å; D203-V207 PolarHBondContact O-N 3.28Å
204A90.2Very high80Confident75 Ų7569.3 Ų69.362%0.6236%0.355SS*.Hα-helixtrans-61.3-40.417800000113.1S202 D208S202-A204 PolarHBondContact O-N 3.03Å; A204-D208 WeakPolarHBondContact O-CB 3.34Å; A204-D208 PolarHBondContact O-N 3.39Å
205Q91.7Very high82.3Confident112 Ų11263.2 Ų63.252%0.52332%0.323SS..Hα-helixtrans-68.7-39176.5-76.3166.9-3100111.8S202 D203 D208 E209S202-Q205 WeakPolarHBondContact O-CB 3.4Å; S202-Q205 PolarHBondContact O-N 3.1Å; S202-Q205 WeakPolarHBondContact OG-CB 3.35Å; S202-Q205 WeakPolarHBondContact OG-CG 3.47Å; S202-Q205 PolarHBondContact OG-N 3.12Å; S202-Q205 PolarHBondContact OG-OE1 3.1Å; D203-Q205 PolarHBondContact O-N 2.68Å; Q205-D208 PolarHBondContact O-N 2.8Å; Q205-E209 WeakPolarHBondContact O-CB 3.34Å; Q205-E209 PolarHBondContact O-N 3.37Å
206L90.5Very high84.4Confident19 Ų1966.6 Ų66.610%0.09934%0.339CS..Hα-helixtrans-66.1-43.7177.7-178.460.1000111.2V182 L198 S202 D203 E209 L210V182-L206 HydrophobicContact CG1-CD2 4.37Å; V182-L206 HydrophobicContact CG2-CD2 3.81Å; V182-L206 HydrophobicContact CG2-CG 3.95Å; L198-L206 HydrophobicContact CD2-CD2 4.18Å; S202-L206 PolarHBondContact O-N 3.49Å; S202-L206 VanDerWaalsContact O-N 3.09Å; D203-L206 PolarHBondContact O-N 3.12Å; L206-E209 PolarHBondContact O-N 3.48Å; L206-L210 HydrophobicContact CD1-CD1 4Å; L206-L210 HydrophobicContact CD1-CG 4.17Å; L206-L210 HydrophobicContact CG-CD1 4.01Å; L206-L210 WeakPolarHBondContact O-CB 3.39Å; L206-L210 VanDerWaalsContact O-CG 3.31Å; L206-L210 WeakPolarHBondContact O-CG 3.29Å; L206-L210 PolarHBondContact O-N 2.86Å
207V94.4Very high86.6Confident29 Ų2960.9 Ų60.918%0.17632%0.319CS..Hα-helixtrans-60.4-48.1175.1170.90000110.8V178 I179 V182 D203 E209 L210 C211V178-V207 HydrophobicContact CG1-CB 4.27Å; V178-V207 HydrophobicContact CG1-CG1 4.07Å; V178-V207 HydrophobicContact CG1-CG2 4.28Å; I179-V207 HydrophobicContact CG1-CG1 4.01Å; I179-V207 HydrophobicContact CG1-CG2 4.43Å; V182-V207 HydrophobicContact CB-CG2 4.05Å; V182-V207 HydrophobicContact CG1-CG2 4.26Å; V182-V207 HydrophobicContact CG2-CG2 3.78Å; D203-V207 VanDerWaalsContact O-CG2 3.31Å; D203-V207 WeakPolarHBondContact O-CG2 3.4Å; D203-V207 PolarHBondContact O-N 3.28Å; V207-E209 PolarHBondContact O-N 2.91Å; V207-L210 PolarHBondContact O-N 2.76Å; V207-C211 VanDerWaalsContact O-CB 3.23Å; V207-C211 WeakPolarHBondContact O-CB 3.35Å; V207-C211 PolarHBondContact O-N 3.37Å; V207-C211 PolarHBondContact O-SG 3.12Å
208D95.2Very high88.7Confident80 Ų8058.4 Ų58.443%0.42831%0.306SS..Hα-helixtrans-61.4-42.7179.317865.3000112.4A204 Q205 K212A204-D208 WeakPolarHBondContact O-CB 3.34Å; A204-D208 PolarHBondContact O-N 3.39Å; Q205-D208 PolarHBondContact O-N 2.8Å; D208-K212 WeakPolarHBondContact O-CB 3.45Å; D208-K212 WeakPolarHBondContact O-CD 3.38Å; D208-K212 VanDerWaalsContact O-CG 3.25Å; D208-K212 WeakPolarHBondContact O-CG 3.16Å; D208-K212 PolarHBondContact O-N 2.78Å; D208-K212 VanDerWaalsContact OD1-CE 3.22Å; D208-K212 WeakPolarHBondContact OD1-CE 3.12Å; D208-K212 IonicContact OD1-NZ 3.75Å; D208-K212 PolarHBondContact OD1-NZ 3.29Å; D208-K212 VanDerWaalsContact OD2-CE 3.31Å; D208-K212 WeakPolarHBondContact OD2-CE 3.3Å; D208-K212 IonicContact OD2-NZ 3.19Å; D208-K212 PolarHBondContact OD2-NZ 2.63Å
209E94.4Very high90.6Very high49 Ų4958.4 Ų58.423%0.22931%0.306CS..Hα-helixtrans-61.4-51.5175.8-176.9-176.3144.600111.8R201 Q205 L206 V207 C211 K212 D213 R247R201-E209 IonicContact CZ-OE2 3.29Å; R201-E209 IonicContact NH1-OE2 2.74Å; R201-E209 PolarHBondContact NH1-OE2 3.34Å; R201-E209 IonicContact NH2-OE1 2.84Å; R201-E209 PolarHBondContact NH2-OE1 3.25Å; R201-E209 IonicContact NH2-OE2 3.86Å; R201-E209 PolarHBondContact NH2-OE2 3.21Å; Q205-E209 WeakPolarHBondContact O-CB 3.34Å; Q205-E209 PolarHBondContact O-N 3.37Å; L206-E209 PolarHBondContact O-N 3.48Å; V207-E209 PolarHBondContact O-N 2.91Å; E209-C211 PolarHBondContact O-N 2.61Å; E209-K212 PolarHBondContact O-N 3.11Å; E209-D213 PolarHBondContact O-N 2.92Å; E209-R247 IonicContact OE1-CZ 3.05Å; E209-R247 IonicContact OE1-NE 2.71Å; E209-R247 IonicContact OE1-NH2 2.64Å; E209-R247 PolarHBondContact OE1-NH2 3.46Å
210L95.6Very high92.4Very high1 Ų154.9 Ų54.91%0.00529%0.291CS..Hα-helixtrans-65.4-39.2-178.5-69.3174.6000112.1V178 V182 L206 V207 G214 L243 L250V178-L210 HydrophobicContact CG1-CB 3.66Å; V178-L210 HydrophobicContact CG1-CD1 4.07Å; V178-L210 HydrophobicContact CG2-CB 4.13Å; V182-L210 HydrophobicContact CG2-CD1 4.36Å; L206-L210 HydrophobicContact CD1-CD1 4Å; L206-L210 HydrophobicContact CD1-CG 4.17Å; L206-L210 HydrophobicContact CG-CD1 4.01Å; L206-L210 WeakPolarHBondContact O-CB 3.39Å; L206-L210 VanDerWaalsContact O-CG 3.31Å; L206-L210 WeakPolarHBondContact O-CG 3.29Å; L206-L210 PolarHBondContact O-N 2.86Å; V207-L210 PolarHBondContact O-N 2.76Å; L210-G214 PolarHBondContact O-N 2.87Å; L210-L243 WeakPolarHBondContact O-CD1 3.11Å; L210-L250 HydrophobicContact CD1-CD1 4.13Å; L210-L250 HydrophobicContact CD2-CD1 3.8Å
211C97.2Very high93.9Very high19 Ų1948.3 Ų48.313%0.12826%0.256CS..Hα-helixtrans-63.8-43174.8-75.90000111.5V207 E209 G214 V215V207-C211 VanDerWaalsContact O-CB 3.23Å; V207-C211 WeakPolarHBondContact O-CB 3.35Å; V207-C211 PolarHBondContact O-N 3.37Å; V207-C211 PolarHBondContact O-SG 3.12Å; E209-C211 PolarHBondContact O-N 2.61Å; C211-G214 PolarHBondContact O-N 3.14Å; C211-V215 VanDerWaalsContact O-CB 3.3Å; C211-V215 WeakPolarHBondContact O-CB 3.24Å; C211-V215 WeakPolarHBondContact O-CG2 3.35Å; C211-V215 PolarHBondContact O-N 2.99Å
212K97Very high95.1Very high112 Ų11242.9 Ų42.949%0.48724%0.235SC..Hα-helixtrans-61-48.2177.1-79.2168.3175.7167.20112D208 E209 V215 N216D208-K212 WeakPolarHBondContact O-CB 3.45Å; D208-K212 WeakPolarHBondContact O-CD 3.38Å; D208-K212 VanDerWaalsContact O-CG 3.25Å; D208-K212 WeakPolarHBondContact O-CG 3.16Å; D208-K212 PolarHBondContact O-N 2.78Å; D208-K212 VanDerWaalsContact OD1-CE 3.22Å; D208-K212 WeakPolarHBondContact OD1-CE 3.12Å; D208-K212 IonicContact OD1-NZ 3.75Å; D208-K212 PolarHBondContact OD1-NZ 3.29Å; D208-K212 VanDerWaalsContact OD2-CE 3.31Å; D208-K212 WeakPolarHBondContact OD2-CE 3.3Å; D208-K212 IonicContact OD2-NZ 3.19Å; D208-K212 PolarHBondContact OD2-NZ 2.63Å; E209-K212 PolarHBondContact O-N 3.11Å; K212-V215 PolarHBondContact O-N 3.44Å; K212-N216 VanDerWaalsContact O-CG 3.32Å; K212-N216 PolarHBondContact O-N 2.89Å; K212-N216 VanDerWaalsContact O-N 3.09Å; K212-N216 PolarHBondContact O-ND2 2.94Å
213D97.4Very high95.7Very high54 Ų5440.6 Ų40.629%0.28922%0.218SC..Hα-helixtrans-65.5-43.1178.9-72.7-6.7000111.9E209 V215 N216 L217 L243 R247E209-D213 PolarHBondContact O-N 2.92Å; D213-V215 PolarHBondContact O-N 2.74Å; D213-N216 WeakPolarHBondContact O-CB 3.43Å; D213-N216 PolarHBondContact O-N 2.9Å; D213-L217 PolarHBondContact O-N 2.96Å; D213-L243 HydrophobicContact CB-CD2 3.64Å; D213-R247 IonicContact OD2-CZ 3.56Å; D213-R247 VanDerWaalsContact OD2-CZ 3.23Å; D213-R247 IonicContact OD2-NH1 3.74Å; D213-R247 PolarHBondContact OD2-NH1 3.03Å; D213-R247 IonicContact OD2-NH2 3.51Å; D213-R247 PolarHBondContact OD2-NH2 3.4Å
214G98.1Very high96.2Very high0 Ų037.5 Ų37.50%020%0.202CC..Hα-helixtrans-66.3-37.1177.900000112.7L210 C211 N216 L217 I218L210-G214 PolarHBondContact O-N 2.87Å; C211-G214 PolarHBondContact O-N 3.14Å; G214-N216 VanDerWaalsContact C-N 3.31Å; G214-N216 PolarHBondContact O-N 3.43Å; G214-L217 PolarHBondContact O-N 3.45Å; G214-I218 WeakPolarHBondContact O-CG1 3.35Å; G214-I218 PolarHBondContact O-N 3.19Å
215V98.1Very high96.5Very high19 Ų1935.2 Ų35.212%0.11518%0.179CC..Hα-helixtrans-60.4-42.3171.6164.80000110.6Y171 C211 K212 D213 I218 N219Y171-V215 HydrophobicContact CD1-CG1 4.42Å; Y171-V215 HydrophobicContact CD1-CG2 3.98Å; Y171-V215 HydrophobicContact CE1-CG1 4.13Å; Y171-V215 HydrophobicContact CE1-CG2 4.47Å; C211-V215 VanDerWaalsContact O-CB 3.3Å; C211-V215 WeakPolarHBondContact O-CB 3.24Å; C211-V215 WeakPolarHBondContact O-CG2 3.35Å; C211-V215 PolarHBondContact O-N 2.99Å; K212-V215 PolarHBondContact O-N 3.44Å; D213-V215 PolarHBondContact O-N 2.74Å; V215-I218 PolarHBondContact O-N 3.15Å; V215-N219 WeakPolarHBondContact O-CB 3.32Å; V215-N219 PolarHBondContact O-N 2.95Å; V215-N219 PolarHBondContact O-ND2 3.26Å; V215-N219 VanDerWaalsContact O-ND2 3.12Å; V215-N219 PolarHBondContact O-OD1 2.83Å
216N97.3Very high96.8Very high96 Ų9630 Ų3051%0.51316%0.155SC..Hα-helixtrans-62.8-41.6176.3-69.1-30.7000111.9K212 D213 G214 N219 L220K212-N216 VanDerWaalsContact O-CG 3.32Å; K212-N216 PolarHBondContact O-N 2.89Å; K212-N216 VanDerWaalsContact O-N 3.09Å; K212-N216 PolarHBondContact O-ND2 2.94Å; D213-N216 WeakPolarHBondContact O-CB 3.43Å; D213-N216 PolarHBondContact O-N 2.9Å; G214-N216 VanDerWaalsContact C-N 3.31Å; G214-N216 PolarHBondContact O-N 3.43Å; N216-N219 PolarHBondContact O-N 2.92Å; N216-L220 PolarHBondContact O-N 3.19Å
217L97.7Very high97.1Very high38 Ų3829.5 Ų29.520%0.19915%0.153CC..Hα-helixtrans-64-46174.3-73.4175.9000112.2D213 G214 N219 L220 W221 V239 E242 L243D213-L217 PolarHBondContact O-N 2.96Å; G214-L217 PolarHBondContact O-N 3.45Å; L217-N219 VanDerWaalsContact C-N 3.29Å; L217-N219 PolarHBondContact O-N 2.75Å; L217-L220 WeakPolarHBondContact O-CB 3.38Å; L217-L220 PolarHBondContact O-N 3.13Å; L217-W221 WeakPolarHBondContact O-CB 3.31Å; L217-W221 VanDerWaalsContact O-CD1 3.25Å; L217-W221 VanDerWaalsContact O-CG 3.25Å; L217-W221 PolarHBondContact O-N 3.42Å; L217-V239 HydrophobicContact CB-CG1 3.86Å; L217-V239 HydrophobicContact CB-CG2 4.45Å; L217-V239 HydrophobicContact CD1-CG1 4.08Å; L217-E242 HydrophobicContact CD1-CB 4.2Å; L217-E242 HydrophobicContact CD1-CG 3.99Å; L217-L243 HydrophobicContact CD1-CD2 3.72Å; L217-L243 HydrophobicContact CD1-CG 4.06Å
218I98.4Very high97.3Very high0 Ų028.1 Ų28.10%015%0.145CC..Hα-helixtrans-55.3-48.5174.4-72.1167.4000110.1P170 Y171 L174 G214 V215 L220 W221 Y222 F235 V239P170-I218 HydrophobicContact CB-CD1 4.06Å; P170-I218 HydrophobicContact CB-CG1 4.4Å; P170-I218 HydrophobicContact CG-CB 4.45Å; P170-I218 HydrophobicContact CG-CD1 3.95Å; P170-I218 HydrophobicContact CG-CG1 4.03Å; P170-I218 HydrophobicContact CG-CG2 3.56Å; Y171-I218 HydrophobicContact CD1-CB 4.3Å; Y171-I218 HydrophobicContact CD1-CD1 3.75Å; Y171-I218 HydrophobicContact CD1-CG2 3.92Å; Y171-I218 HydrophobicContact CE1-CB 3.81Å; Y171-I218 HydrophobicContact CE1-CD1 4.16Å; Y171-I218 HydrophobicContact CE1-CG2 3.28Å; Y171-I218 HydrophobicContact CE2-CG2 4.32Å; Y171-I218 HydrophobicContact CG-CD1 4.49Å; L174-I218 HydrophobicContact CB-CD1 4.01Å; L174-I218 HydrophobicContact CD2-CD1 3.54Å; L174-I218 HydrophobicContact CG-CD1 4.35Å; G214-I218 WeakPolarHBondContact O-CG1 3.35Å; G214-I218 PolarHBondContact O-N 3.19Å; V215-I218 PolarHBondContact O-N 3.15Å; I218-L220 VanDerWaalsContact C-N 3.27Å; I218-L220 PolarHBondContact O-N 3.07Å; I218-W221 PolarHBondContact O-N 3.05Å; I218-W221 VanDerWaalsContact O-N 3.14Å; I218-Y222 HydrophobicContact CG2-CD2 3.75Å; I218-Y222 HydrophobicContact CG2-CE2 3.42Å; I218-Y222 VanDerWaalsContact CG2-CE2 3.42Å; I218-Y222 VanDerWaalsContact O-CD2 3.24Å; I218-Y222 WeakPolarHBondContact O-CD2 3.26Å; I218-Y222 PolarHBondContact O-N 2.66Å; I218-F235 HydrophobicContact CG1-CE2 4.23Å; I218-F235 HydrophobicContact CG2-CE2 4.48Å; I218-V239 HydrophobicContact CG1-CB 4.44Å; I218-V239 HydrophobicContact CG1-CG1 4.28Å; I218-V239 HydrophobicContact CG1-CG2 3.84Å
219N97.7Very high97.4Very high10 Ų1024.7 Ų24.75%0.05313%0.127CC..Hα-helixtrans-59.1-40.3-178.7-69.9-23.7000112.2K74 Y90 Y171 V215 N216 L217K74-N219 HydrophobicContact CD-CB 4.33Å; K74-N219 VanDerWaalsContact CE-CG 3.42Å; K74-N219 WeakPolarHBondContact CE-ND2 3.3Å; Y90-N219 WeakPolarHBondContact CD1-OD1 3.33Å; Y90-N219 HydrophobicContact CE1-CB 4.19Å; Y90-N219 PolarHBondContact OH-O 3.29Å; Y171-N219 PolarHBondContact OH-OD1 3.48Å; V215-N219 WeakPolarHBondContact O-CB 3.32Å; V215-N219 PolarHBondContact O-N 2.95Å; V215-N219 PolarHBondContact O-ND2 3.26Å; V215-N219 VanDerWaalsContact O-ND2 3.12Å; V215-N219 PolarHBondContact O-OD1 2.83Å; N216-N219 PolarHBondContact O-N 2.92Å; L217-N219 VanDerWaalsContact C-N 3.29Å; L217-N219 PolarHBondContact O-N 2.75Å
220L97.2Very high97.4Very high58 Ų5822.5 Ų22.530%0.30412%0.117SC..Hα-helixtrans-67-46.4174.2-179.364.6000111.4N216 L217 I218 Y222 Q223 F316N216-L220 PolarHBondContact O-N 3.19Å; L217-L220 WeakPolarHBondContact O-CB 3.38Å; L217-L220 PolarHBondContact O-N 3.13Å; I218-L220 VanDerWaalsContact C-N 3.27Å; I218-L220 PolarHBondContact O-N 3.07Å; L220-Y222 VanDerWaalsContact C-N 3.26Å; L220-Y222 PolarHBondContact O-N 3.16Å; L220-Q223 VanDerWaalsContact O-CB 3.31Å; L220-Q223 WeakPolarHBondContact O-CB 3.46Å; L220-Q223 WeakPolarHBondContact O-CG 3.47Å; L220-Q223 PolarHBondContact O-N 2.65Å; L220-Q223 VanDerWaalsContact O-N 3.11Å; L220-F316 HydrophobicContact CD1-CB 4.03Å; L220-F316 HydrophobicContact CD1-CD1 3.58Å; L220-F316 HydrophobicContact CD1-CE1 4.32Å; L220-F316 HydrophobicContact CD1-CG 3.93Å; L220-F316 HydrophobicContact CD2-CD1 4.39Å; L220-F316 HydrophobicContact CD2-CG 4.47Å; L220-F316 HydrophobicContact CG-CD1 3.64Å; L220-F316 HydrophobicContact CG-CE1 3.89Å; L220-F316 HydrophobicContact CG-CG 4.14Å; L220-F316 WeakPolarHBondContact O-CE1 3.46Å
221W98.1Very high97.5Very high7 Ų724.4 Ų24.43%0.02713%0.126CC..Hα-helixtrans-69.7-19.3-175.6-71.714.8000113.5L217 I218 Q223 T224 L226 F235 A238 V239 E242 I307 I311 F316L217-W221 WeakPolarHBondContact O-CB 3.31Å; L217-W221 VanDerWaalsContact O-CD1 3.25Å; L217-W221 VanDerWaalsContact O-CG 3.25Å; L217-W221 PolarHBondContact O-N 3.42Å; I218-W221 PolarHBondContact O-N 3.05Å; I218-W221 VanDerWaalsContact O-N 3.14Å; W221-Q223 PolarHBondContact O-N 3.38Å; W221-Q223 VanDerWaalsContact O-N 3.12Å; W221-T224 WeakPolarHBondContact O-CB 3.25Å; W221-T224 PolarHBondContact O-N 3.22Å; W221-T224 PolarHBondContact O-OG1 2.87Å; W221-L226 HydrophobicContact CB-CD1 4.45Å; W221-L226 HydrophobicContact CD2-CD1 4.39Å; W221-L226 HydrophobicContact CE3-CD1 3.77Å; W221-L226 HydrophobicContact CZ3-CD1 4.44Å; W221-F235 HydrophobicContact CB-CE2 3.67Å; W221-F235 HydrophobicContact CB-CZ 3.55Å; W221-F235 HydrophobicContact CD2-CE2 4.29Å; W221-F235 HydrophobicContact CE3-CD2 4Å; W221-F235 AromaticContact CE3-CE2 3.64Å; W221-F235 HydrophobicContact CE3-CE2 3.64Å; W221-F235 HydrophobicContact CE3-CZ 4.49Å; W221-F235 HydrophobicContact CG-CE2 4.37Å; W221-A238 HydrophobicContact CH2-CB 4.23Å; W221-A238 HydrophobicContact CZ3-CB 3.77Å; W221-V239 HydrophobicContact CD2-CG2 4.1Å; W221-V239 HydrophobicContact CE3-CG2 3.5Å; W221-V239 HydrophobicContact CH2-CG2 4.07Å; W221-V239 HydrophobicContact CZ3-CB 4.4Å; W221-V239 HydrophobicContact CZ3-CG2 3.48Å; W221-V239 VanDerWaalsContact CZ3-CG2 3.48Å; W221-E242 HydrophobicContact CH2-CB 4.06Å; W221-E242 HydrophobicContact CZ2-CB 4.01Å; W221-E242 HydrophobicContact CZ2-CG 3.97Å; W221-I307 HydrophobicContact CZ3-CG2 4.08Å; W221-I311 HydrophobicContact CB-CD1 4.17Å; W221-I311 HydrophobicContact CD2-CD1 3.44Å; W221-I311 VanDerWaalsContact CD2-CD1 3.44Å; W221-I311 HydrophobicContact CD2-CG1 3.9Å; W221-I311 HydrophobicContact CE3-CD1 3.93Å; W221-I311 HydrophobicContact CE3-CG1 4.12Å; W221-I311 HydrophobicContact CG-CD1 3.53Å; W221-I311 HydrophobicContact CG-CG1 4.48Å; W221-I311 HydrophobicContact CH2-CG1 4.15Å; W221-I311 HydrophobicContact CZ2-CB 4.43Å; W221-I311 HydrophobicContact CZ2-CD1 4.31Å; W221-I311 HydrophobicContact CZ2-CG1 3.91Å; W221-I311 HydrophobicContact CZ2-CG2 3.93Å; W221-I311 HydrophobicContact CZ3-CG1 4.24Å; W221-F316 AromaticContact CD1-CZ 3.97Å
222Y98.1Very high97.4Very high3 Ų324 Ų241%0.01212%0.123CC..THydrogen-bonded Turntrans-59.8-16.2168.8-91.4-67.4000114Y90 G91 A94 P170 Y171 I218 L220 T224 C227Y90-Y222 HydrophobicContact CD1-CD2 4.22Å; Y90-Y222 AromaticContact CE1-CD2 3.83Å; Y90-Y222 HydrophobicContact CE1-CD2 3.83Å; Y90-Y222 HydrophobicContact CE1-CG 4.21Å; G91-Y222 VanDerWaalsContact CA-CZ 3.49Å; G91-Y222 VanDerWaalsContact CA-OH 3.25Å; G91-Y222 WeakPolarHBondContact CA-OH 3.45Å; A94-Y222 HydrophobicContact CB-CD1 3.72Å; A94-Y222 HydrophobicContact CB-CE1 4.28Å; A94-Y222 HydrophobicContact CB-CG 3.98Å; P170-Y222 WeakPolarHBondContact CD-OH 3.37Å; Y171-Y222 HydrophobicContact CE2-CE2 4.09Å; Y171-Y222 AromaticContact CZ-CE2 3.89Å; Y171-Y222 WeakPolarHBondContact OH-CE2 3.32Å; I218-Y222 HydrophobicContact CG2-CD2 3.75Å; I218-Y222 HydrophobicContact CG2-CE2 3.42Å; I218-Y222 VanDerWaalsContact CG2-CE2 3.42Å; I218-Y222 VanDerWaalsContact O-CD2 3.24Å; I218-Y222 WeakPolarHBondContact O-CD2 3.26Å; I218-Y222 PolarHBondContact O-N 2.66Å; L220-Y222 VanDerWaalsContact C-N 3.26Å; L220-Y222 PolarHBondContact O-N 3.16Å; Y222-T224 PolarHBondContact O-N 3.41Å; Y222-C227 HydrophobicContact CD1-CB 3.93Å; Y222-C227 HydrophobicContact CE1-CB 3.68Å
223Q97.6Very high97.4Very high6 Ų621.4 Ų21.43%0.02812%0.119CC..THydrogen-bonded Turntrans-64.1-29.7169.2-69.2-172.726.900112.5K67 V70 K98 L220 W221 F314 F316 V317K67-Q223 HydrophobicContact CG-CB 4.1Å; K67-Q223 HydrophobicContact CG-CG 4.47Å; V70-Q223 HydrophobicContact CG1-CG 4.22Å; K98-Q223 PolarHBondContact NZ-O 3.39Å; L220-Q223 VanDerWaalsContact O-CB 3.31Å; L220-Q223 WeakPolarHBondContact O-CB 3.46Å; L220-Q223 WeakPolarHBondContact O-CG 3.47Å; L220-Q223 PolarHBondContact O-N 2.65Å; L220-Q223 VanDerWaalsContact O-N 3.11Å; W221-Q223 PolarHBondContact O-N 3.38Å; W221-Q223 VanDerWaalsContact O-N 3.12Å; Q223-F314 HydrophobicContact CB-CE1 3.86Å; Q223-F314 HydrophobicContact CB-CZ 4.27Å; Q223-F314 WeakPolarHBondContact O-CZ 3.43Å; Q223-F316 HydrophobicContact CB-CD1 4.16Å; Q223-F316 HydrophobicContact CB-CE1 4.37Å; Q223-V317 PolarHBondContact NE2-O 2.97Å
224T97.4Very high97.3Very high1 Ų120.9 Ų20.91%0.00611%0.114CC..SBendtrans-79.1-176.6176.276.30000111.9K98 W221 Y222 L226 I311 F314 F316K98-T224 WeakPolarHBondContact CE-O 3.23Å; K98-T224 PolarHBondContact NZ-O 3.16Å; W221-T224 WeakPolarHBondContact O-CB 3.25Å; W221-T224 PolarHBondContact O-N 3.22Å; W221-T224 PolarHBondContact O-OG1 2.87Å; Y222-T224 PolarHBondContact O-N 3.41Å; T224-L226 WeakPolarHBondContact OG1-CB 3.45Å; T224-L226 VanDerWaalsContact OG1-CG 3.25Å; T224-L226 WeakPolarHBondContact OG1-CG 3.45Å; T224-L226 PolarHBondContact OG1-N 3.27Å; T224-I311 HydrophobicContact CG2-CD1 3.81Å; T224-F314 HydrophobicContact CG2-CB 4.23Å; T224-F314 HydrophobicContact CG2-CD1 3.7Å; T224-F314 HydrophobicContact CG2-CD2 3.78Å; T224-F314 HydrophobicContact CG2-CE1 3.87Å; T224-F314 HydrophobicContact CG2-CE2 3.95Å; T224-F314 HydrophobicContact CG2-CG 3.63Å; T224-F314 HydrophobicContact CG2-CZ 3.98Å; T224-F316 HydrophobicContact CG2-CE1 3.79Å; T224-F316 HydrophobicContact CG2-CZ 3.85Å
225D97.3Very high97.3Very high27 Ų2721 Ų2114%0.14412%0.115CC..SBendtrans-9413.5174.6-65.6-29.2000113.6L18 R22 F63 K98 C227 L228 T229L18-D225 HydrophobicContact CD1-CB 3.73Å; R22-D225 IonicContact CZ-OD1 2.63Å; R22-D225 IonicContact CZ-OD2 3.67Å; R22-D225 IonicContact NH1-OD2 2.81Å; R22-D225 PolarHBondContact NH1-OD2 3.04Å; R22-D225 IonicContact NH2-OD1 3.74Å; R22-D225 PolarHBondContact NH2-OD1 2.83Å; R22-D225 IonicContact NH2-OD2 3.81Å; R22-D225 PolarHBondContact NH2-OD2 2.92Å; F63-D225 VanDerWaalsContact CE2-OD1 3.26Å; F63-D225 WeakPolarHBondContact CE2-OD1 3.4Å; K98-D225 IonicContact NZ-OD1 3.44Å; K98-D225 PolarHBondContact NZ-OD1 2.95Å; D225-C227 PolarHBondContact O-N 3.22Å; D225-L228 PolarHBondContact O-N 3.09Å; D225-T229 HydrophobicContact CB-CG2 4.23Å; D225-T229 WeakPolarHBondContact O-CG2 3.5Å; D225-T229 PolarHBondContact O-N 3.43Å; D225-T229 PolarHBondContact O-OG1 3.26Å
226L97.8Very high97.3Very high1 Ų120.1 Ų20.11%0.00511%0.11CC..Hα-helixtrans-59.7-29.8-179.4-71.6177.6000113.3W221 T224 L228 T229 A230 F235 I307 I311W221-L226 HydrophobicContact CB-CD1 4.45Å; W221-L226 HydrophobicContact CD2-CD1 4.39Å; W221-L226 HydrophobicContact CE3-CD1 3.77Å; W221-L226 HydrophobicContact CZ3-CD1 4.44Å; T224-L226 WeakPolarHBondContact OG1-CB 3.45Å; T224-L226 VanDerWaalsContact OG1-CG 3.25Å; T224-L226 WeakPolarHBondContact OG1-CG 3.45Å; T224-L226 PolarHBondContact OG1-N 3.27Å; L226-L228 PolarHBondContact O-N 3.46Å; L226-T229 WeakPolarHBondContact CA-OG1 3.37Å; L226-T229 PolarHBondContact O-N 3.04Å; L226-A230 HydrophobicContact CB-CB 4.48Å; L226-A230 HydrophobicContact CD2-CB 4.13Å; L226-A230 WeakPolarHBondContact O-CB 3.48Å; L226-A230 PolarHBondContact O-N 2.84Å; L226-F235 HydrophobicContact CB-CD1 3.67Å; L226-F235 HydrophobicContact CB-CE1 3.57Å; L226-F235 HydrophobicContact CB-CG 4.4Å; L226-F235 HydrophobicContact CB-CZ 4.23Å; L226-F235 HydrophobicContact CD1-CZ 4.46Å; L226-I307 HydrophobicContact CD1-CG2 3.78Å; L226-I307 HydrophobicContact CD2-CB 4.34Å; L226-I307 HydrophobicContact CD2-CG1 3.92Å; L226-I307 HydrophobicContact CD2-CG2 3.88Å; L226-I311 HydrophobicContact CD1-CD1 3.64Å; L226-I311 HydrophobicContact CD1-CG1 4.13Å
227C97.2Very high97.3Very high9 Ų915.8 Ų15.86%0.0619%0.086CC..Hα-helixtrans-66.6-17174.763.20000114.1Y222 D225Y222-C227 HydrophobicContact CD1-CB 3.93Å; Y222-C227 HydrophobicContact CE1-CB 3.68Å; D225-C227 PolarHBondContact O-N 3.22Å
228L97.8Very high97.3Very high1 Ų114.2 Ų14.21%0.0058%0.079CC..Hα-helixtrans-108.2-23.8178.6-62.3174.5000112.6H12 F13 L18 K98 R99 L102 D225 L226H12-L228 WeakPolarHBondContact CA-O 3.46Å; F13-L228 HydrophobicContact CD2-CB 4.3Å; F13-L228 PolarHBondContact N-O 3.18Å; L18-L228 HydrophobicContact CD1-CB 4.24Å; L18-L228 HydrophobicContact CD1-CD1 4.41Å; L18-L228 HydrophobicContact CD2-CB 4.47Å; L18-L228 HydrophobicContact CD2-CD1 4.09Å; K98-L228 HydrophobicContact CB-CD1 4.11Å; K98-L228 HydrophobicContact CB-CG 4.49Å; R99-L228 HydrophobicContact CG-CD2 3.85Å; L102-L228 HydrophobicContact CD1-CD1 3.94Å; L102-L228 HydrophobicContact CD1-CD2 4.39Å; L102-L228 HydrophobicContact CD2-CD1 4.15Å; L102-L228 HydrophobicContact CG-CD1 4.33Å; D225-L228 PolarHBondContact O-N 3.09Å; L226-L228 PolarHBondContact O-N 3.46Å
229T97.2Very high97.3Very high8 Ų814.2 Ų14.25%0.0498%0.079CC..Hα-helixtrans-108.8-25.9-173.258.70000113.7H12 F13 L18 D225 L226 R303H12-T229 PolarHBondContact CE1-O 3.37Å; F13-T229 WeakPolarHBondContact O-CA 3.39Å; F13-T229 WeakPolarHBondContact O-CG2 3.19Å; L18-T229 HydrophobicContact CD1-CG2 3.49Å; L18-T229 VanDerWaalsContact CD1-CG2 3.49Å; D225-T229 HydrophobicContact CB-CG2 4.23Å; D225-T229 WeakPolarHBondContact O-CG2 3.5Å; D225-T229 PolarHBondContact O-N 3.43Å; D225-T229 PolarHBondContact O-OG1 3.26Å; L226-T229 WeakPolarHBondContact CA-OG1 3.37Å; L226-T229 PolarHBondContact O-N 3.04Å; T229-R303 PolarHBondContact O-NH2 3.23Å
230A96.3Very high97.3Very high3 Ų313.8 Ų13.83%0.0258%0.077CC..SBendtrans-106.6152.2-178.100000111.6L226 F235 I307L226-A230 HydrophobicContact CB-CB 4.48Å; L226-A230 HydrophobicContact CD2-CB 4.13Å; L226-A230 WeakPolarHBondContact O-CB 3.48Å; L226-A230 PolarHBondContact O-N 2.84Å; A230-F235 HydrophobicContact CB-CB 4.41Å; A230-I307 HydrophobicContact CB-CD1 4.1Å
231H95.7Very high97.2Very high40 Ų4011.9 Ų11.919%0.1857%0.067CC..  trans-68141.9166.8-76.1-146.4000108.9Y2 F8 H12 S233 Q234 F235Y2-H231 AromaticContact CD1-ND1 3.72Å; Y2-H231 HydrophobicContact CE1-CB 4.12Å; Y2-H231 AromaticContact CE1-CD2 3.71Å; Y2-H231 AromaticContact CE1-CE1 3.75Å; Y2-H231 AromaticContact CE1-CG 3.55Å; Y2-H231 AromaticContact CE1-ND1 3.58Å; Y2-H231 AromaticContact CE1-NE2 3.82Å; F8-H231 AromaticContact CD2-NE2 3.9Å; F8-H231 AromaticContact CE2-CE1 3.9Å; F8-H231 AromaticContact CE2-NE2 3.46Å; F8-H231 WeakPolarHBondContact CE2-NE2 3.31Å; H12-H231 AromaticContact CE1-CD2 3.67Å; H231-S233 PolarHBondContact O-N 2.85Å; H231-S233 VanDerWaalsContact O-N 3.15Å; H231-Q234 HydrophobicContact CB-CB 4.14Å; H231-Q234 HydrophobicContact CB-CG 3.98Å; H231-Q234 CarbonylContact O-C 3.4Å; H231-Q234 WeakPolarHBondContact O-CA 3.46Å; H231-Q234 WeakPolarHBondContact O-CB 3.47Å; H231-Q234 PolarHBondContact O-N 3.46Å; H231-F235 PolarHBondContact O-N 2.87Å
232P96.9Very high97.1Very high11 Ų1113.8 Ų13.87%0.0718%0.077CC..Hα-helixtrans-55.8-36.3-179.5-26.933.4000113.6Y2 Y168 P170 A236Y2-P232 HydrophobicContact CD2-CG 3.85Å; Y2-P232 HydrophobicContact CE2-CG 3.68Å; Y2-P232 VanDerWaalsContact CZ-CD 3.47Å; Y168-P232 WeakPolarHBondContact O-CB 3.46Å; Y168-P232 WeakPolarHBondContact O-CG 3.5Å; P170-P232 WeakPolarHBondContact CB-O 3.28Å; P232-A236 WeakPolarHBondContact O-CB 3.22Å; P232-A236 PolarHBondContact O-N 3.5Å
233S95.6Very high97Very high57 Ų5713.8 Ų13.840%0.3998%0.077SC..Hα-helixtrans-69.2-36.9173.755.50000113F177 H231 A236 L237F177-S233 WeakPolarHBondContact CE2-O 3.49Å; H231-S233 PolarHBondContact O-N 2.85Å; H231-S233 VanDerWaalsContact O-N 3.15Å; S233-A236 PolarHBondContact O-N 3.27Å; S233-L237 VanDerWaalsContact O-CB 3.24Å; S233-L237 WeakPolarHBondContact O-CB 3.25Å; S233-L237 PolarHBondContact O-N 3.07Å
234Q95.9Very high96.8Very high43 Ų4314 Ų1420%0.2018%0.081CC..Hα-helixtrans-71.3-37.3175.5-69.4174.1-2.900111.6H231 L237 A238 L300 I307H231-Q234 HydrophobicContact CB-CB 4.14Å; H231-Q234 HydrophobicContact CB-CG 3.98Å; H231-Q234 CarbonylContact O-C 3.4Å; H231-Q234 WeakPolarHBondContact O-CA 3.46Å; H231-Q234 WeakPolarHBondContact O-CB 3.47Å; H231-Q234 PolarHBondContact O-N 3.46Å; Q234-L237 PolarHBondContact O-N 3.44Å; Q234-A238 WeakPolarHBondContact O-CB 3.39Å; Q234-A238 PolarHBondContact O-N 3.26Å; Q234-L300 HydrophobicContact CG-CD1 4.41Å; Q234-I307 HydrophobicContact CB-CD1 4.36Å
235F97.8Very high96.5Very high4 Ų417.7 Ų17.72%0.01810%0.097CC..Hα-helixtrans-58.1-55.5170.6-170.1150.8000109P170 I218 W221 L226 A230 H231 L237 A238 V239P170-F235 HydrophobicContact CB-CB 4.14Å; P170-F235 HydrophobicContact CB-CD2 4.18Å; P170-F235 HydrophobicContact CB-CG 4.09Å; P170-F235 HydrophobicContact CG-CD1 4.23Å; P170-F235 HydrophobicContact CG-CD2 4.09Å; P170-F235 HydrophobicContact CG-CE1 4.42Å; P170-F235 HydrophobicContact CG-CE2 4.3Å; P170-F235 HydrophobicContact CG-CG 4.07Å; P170-F235 HydrophobicContact CG-CZ 4.46Å; I218-F235 HydrophobicContact CG1-CE2 4.23Å; I218-F235 HydrophobicContact CG2-CE2 4.48Å; W221-F235 HydrophobicContact CB-CE2 3.67Å; W221-F235 HydrophobicContact CB-CZ 3.55Å; W221-F235 HydrophobicContact CD2-CE2 4.29Å; W221-F235 HydrophobicContact CE3-CD2 4Å; W221-F235 AromaticContact CE3-CE2 3.64Å; W221-F235 HydrophobicContact CE3-CE2 3.64Å; W221-F235 HydrophobicContact CE3-CZ 4.49Å; W221-F235 HydrophobicContact CG-CE2 4.37Å; L226-F235 HydrophobicContact CB-CD1 3.67Å; L226-F235 HydrophobicContact CB-CE1 3.57Å; L226-F235 HydrophobicContact CB-CG 4.4Å; L226-F235 HydrophobicContact CB-CZ 4.23Å; L226-F235 HydrophobicContact CD1-CZ 4.46Å; A230-F235 HydrophobicContact CB-CB 4.41Å; H231-F235 PolarHBondContact O-N 2.87Å; F235-L237 VanDerWaalsContact C-N 3.28Å; F235-L237 PolarHBondContact O-N 2.88Å; F235-A238 PolarHBondContact O-N 2.98Å; F235-A238 VanDerWaalsContact O-N 3.16Å; F235-V239 HydrophobicContact CD2-CG2 3.94Å; F235-V239 HydrophobicContact CE2-CG2 3.96Å; F235-V239 PolarHBondContact O-N 2.83Å
236A98.1Very high96.1Very high0 Ų020.7 Ų20.70%012%0.117CC..Hα-helixtrans-57.5-39.9178.700000113P170 A173 L174 F177 P232 S233 V239 L240P170-A236 HydrophobicContact CB-CB 3.86Å; P170-A236 WeakPolarHBondContact O-CB 3.25Å; A173-A236 HydrophobicContact CB-CB 3.66Å; L174-A236 HydrophobicContact CB-CB 4.11Å; F177-A236 HydrophobicContact CD2-CB 4.03Å; F177-A236 HydrophobicContact CE2-CB 3.98Å; P232-A236 WeakPolarHBondContact O-CB 3.22Å; P232-A236 PolarHBondContact O-N 3.5Å; S233-A236 PolarHBondContact O-N 3.27Å; A236-V239 WeakPolarHBondContact O-CB 3.43Å; A236-V239 PolarHBondContact O-N 3.06Å; A236-L240 PolarHBondContact O-N 3.38Å
237L97.3Very high95.8Very high4 Ų422.3 Ų22.32%0.02112%0.123CC..Hα-helixtrans-68.4-39.7177.6-168.866.5000112.3F177 S233 Q234 F235 V239 L240 V241 V256 L260 L300 L304F177-L237 HydrophobicContact CD2-CD1 4.37Å; F177-L237 HydrophobicContact CE2-CB 4.11Å; F177-L237 HydrophobicContact CE2-CD1 4.41Å; F177-L237 HydrophobicContact CG-CD1 4.43Å; F177-L237 HydrophobicContact CZ-CD1 4.49Å; S233-L237 VanDerWaalsContact O-CB 3.24Å; S233-L237 WeakPolarHBondContact O-CB 3.25Å; S233-L237 PolarHBondContact O-N 3.07Å; Q234-L237 PolarHBondContact O-N 3.44Å; F235-L237 VanDerWaalsContact C-N 3.28Å; F235-L237 PolarHBondContact O-N 2.88Å; L237-V239 VanDerWaalsContact C-N 3.28Å; L237-V239 PolarHBondContact O-N 3.31Å; L237-L240 HydrophobicContact CD1-CD2 4.29Å; L237-L240 WeakPolarHBondContact O-CB 3.23Å; L237-L240 PolarHBondContact O-N 3.19Å; L237-L240 VanDerWaalsContact O-N 3.13Å; L237-V241 WeakPolarHBondContact O-CG2 3.38Å; L237-V241 PolarHBondContact O-N 2.96Å; L237-V256 HydrophobicContact CD1-CG1 4.44Å; L237-V256 HydrophobicContact CD1-CG2 3.7Å; L237-V256 HydrophobicContact CD2-CG1 3.97Å; L237-V256 HydrophobicContact CG-CG2 4.39Å; L237-L260 HydrophobicContact CD1-CD2 4Å; L237-L260 HydrophobicContact CD2-CD2 3.87Å; L237-L300 HydrophobicContact CD2-CD1 3.98Å; L237-L300 HydrophobicContact CD2-CD2 3.74Å; L237-L300 HydrophobicContact CD2-CG 4.14Å; L237-L304 HydrophobicContact CB-CD2 4.26Å; L237-L304 HydrophobicContact CD2-CD1 4.04Å; L237-L304 HydrophobicContact CD2-CD2 4.27Å; L237-L304 HydrophobicContact CG-CD1 4.37Å; L237-L304 HydrophobicContact CG-CD2 4.24Å
238A97.7Very high95.4Very high6 Ų626.1 Ų26.15%0.0515%0.148CC..Hα-helixtrans-62.3-37.817400000111.5W221 Q234 F235 V241 E242 L304 I307W221-A238 HydrophobicContact CH2-CB 4.23Å; W221-A238 HydrophobicContact CZ3-CB 3.77Å; Q234-A238 WeakPolarHBondContact O-CB 3.39Å; Q234-A238 PolarHBondContact O-N 3.26Å; F235-A238 PolarHBondContact O-N 2.98Å; F235-A238 VanDerWaalsContact O-N 3.16Å; A238-V241 PolarHBondContact O-N 3.36Å; A238-E242 PolarHBondContact O-N 3.45Å; A238-L304 HydrophobicContact CB-CD2 3.76Å; A238-I307 HydrophobicContact CB-CB 4.17Å; A238-I307 HydrophobicContact CB-CD1 4.07Å; A238-I307 HydrophobicContact CB-CG2 3.59Å
239V98.1Very high94.8Very high0 Ų029.8 Ų29.80%017%0.165CC..Hα-helixtrans-63.8-43171.4171.30000111.2L174 L217 I218 W221 F235 A236 L237 V241 E242 L243L174-V239 HydrophobicContact CD1-CB 4.48Å; L174-V239 HydrophobicContact CD1-CG1 4Å; L174-V239 HydrophobicContact CD2-CG1 4.44Å; L217-V239 HydrophobicContact CB-CG1 3.86Å; L217-V239 HydrophobicContact CB-CG2 4.45Å; L217-V239 HydrophobicContact CD1-CG1 4.08Å; I218-V239 HydrophobicContact CG1-CB 4.44Å; I218-V239 HydrophobicContact CG1-CG1 4.28Å; I218-V239 HydrophobicContact CG1-CG2 3.84Å; W221-V239 HydrophobicContact CD2-CG2 4.1Å; W221-V239 HydrophobicContact CE3-CG2 3.5Å; W221-V239 HydrophobicContact CH2-CG2 4.07Å; W221-V239 HydrophobicContact CZ3-CB 4.4Å; W221-V239 HydrophobicContact CZ3-CG2 3.48Å; W221-V239 VanDerWaalsContact CZ3-CG2 3.48Å; F235-V239 HydrophobicContact CD2-CG2 3.94Å; F235-V239 HydrophobicContact CE2-CG2 3.96Å; F235-V239 PolarHBondContact O-N 2.83Å; A236-V239 WeakPolarHBondContact O-CB 3.43Å; A236-V239 PolarHBondContact O-N 3.06Å; L237-V239 VanDerWaalsContact C-N 3.28Å; L237-V239 PolarHBondContact O-N 3.31Å; V239-V241 VanDerWaalsContact C-N 3.32Å; V239-V241 PolarHBondContact O-N 3Å; V239-E242 WeakPolarHBondContact O-CB 3.47Å; V239-E242 PolarHBondContact O-N 2.86Å; V239-L243 WeakPolarHBondContact O-CG 3.49Å; V239-L243 PolarHBondContact O-N 2.95Å
240L97.5Very high94.3Very high1 Ų129.8 Ų29.81%0.00517%0.165CC..Hα-helixtrans-60.8-42.3176-171.669.9000111.6F177 V178 L181 A236 L237 L243 G244 V252 F255F177-L240 HydrophobicContact CB-CD2 3.75Å; V178-L240 HydrophobicContact CG2-CD1 3.79Å; L181-L240 HydrophobicContact CD2-CD1 3.89Å; L181-L240 HydrophobicContact CD2-CD2 4.48Å; L181-L240 HydrophobicContact CD2-CG 4.43Å; A236-L240 PolarHBondContact O-N 3.38Å; L237-L240 HydrophobicContact CD1-CD2 4.29Å; L237-L240 WeakPolarHBondContact O-CB 3.23Å; L237-L240 PolarHBondContact O-N 3.19Å; L237-L240 VanDerWaalsContact O-N 3.13Å; L240-L243 WeakPolarHBondContact O-CB 3.35Å; L240-L243 PolarHBondContact O-N 2.96Å; L240-G244 PolarHBondContact O-N 2.82Å; L240-V252 HydrophobicContact CD2-CG1 3.99Å; L240-V252 HydrophobicContact CG-CG1 3.81Å; L240-F255 HydrophobicContact CD2-CD1 4.28Å; L240-F255 HydrophobicContact CD2-CE1 4Å
241V96.1Very high94Very high17 Ų1733.9 Ų33.910%0.10319%0.186CC..Hα-helixtrans-63-42.2175.8169.30000110.8L237 A238 V239 L243 G244 H245 V252 L304L237-V241 WeakPolarHBondContact O-CG2 3.38Å; L237-V241 PolarHBondContact O-N 2.96Å; A238-V241 PolarHBondContact O-N 3.36Å; V239-V241 VanDerWaalsContact C-N 3.32Å; V239-V241 PolarHBondContact O-N 3Å; V241-L243 VanDerWaalsContact C-N 3.34Å; V241-L243 PolarHBondContact O-N 2.87Å; V241-G244 CarbonylContact O-C 3.57Å; V241-G244 WeakPolarHBondContact O-CA 3.27Å; V241-G244 PolarHBondContact O-N 3.13Å; V241-H245 VanDerWaalsContact CG1-CE1 3.4Å; V241-H245 WeakPolarHBondContact CG1-CE1 3.29Å; V241-H245 PolarHBondContact O-N 2.8Å; V241-H245 PolarHBondContact O-ND1 2.86Å; V241-V252 HydrophobicContact CG2-CG1 4.18Å; V241-L304 HydrophobicContact CG2-CD1 4.23Å
242E96Very high93.8Very high47 Ų4732.2 Ų32.222%0.2218%0.179CC..Hα-helixtrans-60.2-42.7174.4-170.662.2-152.500111.8L217 W221 A238 V239 G244 H245 T246L217-E242 HydrophobicContact CD1-CB 4.2Å; L217-E242 HydrophobicContact CD1-CG 3.99Å; W221-E242 HydrophobicContact CH2-CB 4.06Å; W221-E242 HydrophobicContact CZ2-CB 4.01Å; W221-E242 HydrophobicContact CZ2-CG 3.97Å; A238-E242 PolarHBondContact O-N 3.45Å; V239-E242 WeakPolarHBondContact O-CB 3.47Å; V239-E242 PolarHBondContact O-N 2.86Å; E242-G244 VanDerWaalsContact C-N 3.26Å; E242-G244 PolarHBondContact O-N 3.16Å; E242-H245 WeakPolarHBondContact O-CB 3.32Å; E242-H245 PolarHBondContact O-N 3.29Å; E242-H245 VanDerWaalsContact O-N 3.14Å; E242-T246 PolarHBondContact O-N 3.32Å
243L95.4Very high93.5Very high4 Ų436.4 Ų36.42%0.02120%0.197CC..Hα-helixtrans-59.3-39.7172.3-66.9174.9000111.5L210 D213 L217 V239 L240 V241 H245 T246 R247L210-L243 WeakPolarHBondContact O-CD1 3.11Å; D213-L243 HydrophobicContact CB-CD2 3.64Å; L217-L243 HydrophobicContact CD1-CD2 3.72Å; L217-L243 HydrophobicContact CD1-CG 4.06Å; V239-L243 WeakPolarHBondContact O-CG 3.49Å; V239-L243 PolarHBondContact O-N 2.95Å; L240-L243 WeakPolarHBondContact O-CB 3.35Å; L240-L243 PolarHBondContact O-N 2.96Å; V241-L243 VanDerWaalsContact C-N 3.34Å; V241-L243 PolarHBondContact O-N 2.87Å; L243-H245 VanDerWaalsContact C-N 3.34Å; L243-H245 PolarHBondContact O-N 3.41Å; L243-T246 PolarHBondContact O-N 3.49Å; L243-T246 PolarHBondContact O-OG1 3.01Å; L243-R247 WeakPolarHBondContact O-CB 3.39Å; L243-R247 PolarHBondContact O-N 2.85Å; L243-R247 VanDerWaalsContact O-N 3.08Å
244G93.2Very high93.3Very high10 Ų1036.1 Ų36.110%0.10319%0.193CC..Hα-helixtrans-62.7-34.7174.700000114L240 V241 E242 R247 P248 V252L240-G244 PolarHBondContact O-N 2.82Å; V241-G244 CarbonylContact O-C 3.57Å; V241-G244 WeakPolarHBondContact O-CA 3.27Å; V241-G244 PolarHBondContact O-N 3.13Å; E242-G244 VanDerWaalsContact C-N 3.26Å; E242-G244 PolarHBondContact O-N 3.16Å; G244-R247 CarbonylContact O-C 2.95Å; G244-R247 PolarHBondContact O-N 3.42Å; G244-R247 VanDerWaalsContact O-N 3.17Å; G244-R247 VanDerWaalsContact O-O 3.08Å; G244-P248 WeakPolarHBondContact O-CA 3.49Å; G244-P248 VanDerWaalsContact O-N 3.15Å; G244-V252 VanDerWaalsContact CA-CG2 3.45Å
245H91.3Very high93.1Very high78 Ų7834.2 Ų34.236%0.36118%0.184SC..Hα-helixtrans-66-39.7175.4-75.377.5000112V241 E242 L243 R247 E253 R308V241-H245 VanDerWaalsContact CG1-CE1 3.4Å; V241-H245 WeakPolarHBondContact CG1-CE1 3.29Å; V241-H245 PolarHBondContact O-N 2.8Å; V241-H245 PolarHBondContact O-ND1 2.86Å; E242-H245 WeakPolarHBondContact O-CB 3.32Å; E242-H245 PolarHBondContact O-N 3.29Å; E242-H245 VanDerWaalsContact O-N 3.14Å; L243-H245 VanDerWaalsContact C-N 3.34Å; L243-H245 PolarHBondContact O-N 3.41Å; H245-R247 PolarHBondContact O-N 2.9Å; H245-E253 IonicContact CE1-OE1 3.77Å; H245-E253 IonicContact NE2-OE1 2.82Å; H245-R308 PolarHBondContact CE1-NH1 2.86Å; H245-R308 PolarHBondContact NE2-NH1 3.32Å
246T90.2Very high92.9Very high90 Ų9034 Ų3455%0.55218%0.183SC*.Hα-helixtrans-72.5-19.7174.767.10000113E242 L243E242-T246 PolarHBondContact O-N 3.32Å; L243-T246 PolarHBondContact O-N 3.49Å; L243-T246 PolarHBondContact O-OG1 3.01Å
247R90.4Very high92.6Very high35 Ų3538.7 Ų38.713%0.13220%0.201CC..  trans-134.670.6-176.2-65.4176173101.8-8.9110.6E209 D213 L243 G244 H245 Q249 L250E209-R247 IonicContact OE1-CZ 3.05Å; E209-R247 IonicContact OE1-NE 2.71Å; E209-R247 IonicContact OE1-NH2 2.64Å; E209-R247 PolarHBondContact OE1-NH2 3.46Å; D213-R247 IonicContact OD2-CZ 3.56Å; D213-R247 VanDerWaalsContact OD2-CZ 3.23Å; D213-R247 IonicContact OD2-NH1 3.74Å; D213-R247 PolarHBondContact OD2-NH1 3.03Å; D213-R247 IonicContact OD2-NH2 3.51Å; D213-R247 PolarHBondContact OD2-NH2 3.4Å; L243-R247 WeakPolarHBondContact O-CB 3.39Å; L243-R247 PolarHBondContact O-N 2.85Å; L243-R247 VanDerWaalsContact O-N 3.08Å; G244-R247 CarbonylContact O-C 2.95Å; G244-R247 PolarHBondContact O-N 3.42Å; G244-R247 VanDerWaalsContact O-N 3.17Å; G244-R247 VanDerWaalsContact O-O 3.08Å; H245-R247 PolarHBondContact O-N 2.9Å; R247-Q249 VanDerWaalsContact CA-OE1 3.23Å; R247-Q249 PolarHBondContact O-N 3.44Å; R247-L250 HydrophobicContact CB-CD1 3.76Å; R247-L250 HydrophobicContact CB-CG 4.05Å; R247-L250 HydrophobicContact CG-CD1 4.47Å; R247-L250 WeakPolarHBondContact O-CB 3.31Å; R247-L250 PolarHBondContact O-N 2.99Å
248P88.2Confident92.2Very high89 Ų8939.1 Ų39.158%0.57820%0.203SC*.G310 helixtrans-54.3-27.7-175.2-26.735.2000113.6G244 L250 D251G244-P248 WeakPolarHBondContact O-CA 3.49Å; G244-P248 VanDerWaalsContact O-N 3.15Å; P248-L250 PolarHBondContact O-N 3.09Å; P248-L250 VanDerWaalsContact O-N 3.11Å; P248-D251 PolarHBondContact O-N 3.49Å; P248-D251 VanDerWaalsContact O-N 3.13Å
249Q85.5Confident91.7Very high78 Ų7841.2 Ų41.236%0.36421%0.212SC..G310 helixtrans-62.8-14178.675-88.310.100115.2Q185 L197 R247 D251Q185-Q249 PolarHBondContact NE2-O 3.04Å; L197-Q249 HydrophobicContact CD1-CB 3.51Å; L197-Q249 HydrophobicContact CD1-CG 3.67Å; L197-Q249 WeakPolarHBondContact CD1-O 3.46Å; L197-Q249 HydrophobicContact CD2-CB 4.14Å; L197-Q249 HydrophobicContact CD2-CG 3.86Å; L197-Q249 HydrophobicContact CG-CB 4.46Å; L197-Q249 HydrophobicContact CG-CG 4.41Å; R247-Q249 VanDerWaalsContact CA-OE1 3.23Å; R247-Q249 PolarHBondContact O-N 3.44Å; Q249-D251 VanDerWaalsContact C-N 3.35Å
250L87.2Confident91.2Very high9 Ų944.6 Ų44.65%0.04723%0.23CC..G310 helixtrans-83.3-11.4177.1-67176.4000113.1L181 Q185 L210 R247 P248 V252L181-L250 HydrophobicContact CD2-CB 4.46Å; L181-L250 HydrophobicContact CD2-CD1 4.4Å; Q185-L250 PolarHBondContact NE2-O 2.54Å; L210-L250 HydrophobicContact CD1-CD1 4.13Å; L210-L250 HydrophobicContact CD2-CD1 3.8Å; R247-L250 HydrophobicContact CB-CD1 3.76Å; R247-L250 HydrophobicContact CB-CG 4.05Å; R247-L250 HydrophobicContact CG-CD1 4.47Å; R247-L250 WeakPolarHBondContact O-CB 3.31Å; R247-L250 PolarHBondContact O-N 2.99Å; P248-L250 PolarHBondContact O-N 3.09Å; P248-L250 VanDerWaalsContact O-N 3.11Å; L250-V252 HydrophobicContact CB-CG2 3.8Å; L250-V252 PolarHBondContact O-N 3.24Å; L250-V252 VanDerWaalsContact O-N 3.11Å
251D89.1Confident90.8Very high89 Ų8944.7 Ų44.748%0.47623%0.23SC..  trans46.743179.7-66.4-44.3000113P248 Q249 E253 V254 F255P248-D251 PolarHBondContact O-N 3.49Å; P248-D251 VanDerWaalsContact O-N 3.13Å; Q249-D251 VanDerWaalsContact C-N 3.35Å; D251-E253 VanDerWaalsContact C-N 3.31Å; D251-E253 PolarHBondContact O-N 3.47Å; D251-V254 HydrophobicContact CB-CB 4.18Å; D251-V254 HydrophobicContact CB-CG2 4.14Å; D251-V254 WeakPolarHBondContact O-CB 3.48Å; D251-V254 PolarHBondContact O-N 2.92Å; D251-V254 VanDerWaalsContact O-N 3.1Å; D251-F255 PolarHBondContact O-N 2.91Å
252V92.3Very high90.4Very high5 Ų545.1 Ų45.13%0.0324%0.238CC..Hα-helixtrans-58.9-41.9-172.31780000111.7L181 L240 V241 G244 L250 V254 F255 V256L181-V252 HydrophobicContact CD1-CG2 4.25Å; L181-V252 HydrophobicContact CD2-CG2 3.81Å; L240-V252 HydrophobicContact CD2-CG1 3.99Å; L240-V252 HydrophobicContact CG-CG1 3.81Å; V241-V252 HydrophobicContact CG2-CG1 4.18Å; G244-V252 VanDerWaalsContact CA-CG2 3.45Å; L250-V252 HydrophobicContact CB-CG2 3.8Å; L250-V252 PolarHBondContact O-N 3.24Å; L250-V252 VanDerWaalsContact O-N 3.11Å; V252-V254 VanDerWaalsContact C-N 3.29Å; V252-V254 PolarHBondContact O-N 2.64Å; V252-F255 WeakPolarHBondContact O-CB 3.36Å; V252-F255 PolarHBondContact O-N 3.02Å; V252-V256 HydrophobicContact CG1-CG2 4.26Å; V252-V256 WeakPolarHBondContact O-CG2 3.12Å; V252-V256 PolarHBondContact O-N 3.2Å
253E91.7Very high89.7Confident98 Ų9844.7 Ų44.746%0.45824%0.24SC..Hα-helixtrans-62.6-38.1179.1-65.9-173.6175.200112.1H245 D251 V256 R257H245-E253 IonicContact CE1-OE1 3.77Å; H245-E253 IonicContact NE2-OE1 2.82Å; D251-E253 VanDerWaalsContact C-N 3.31Å; D251-E253 PolarHBondContact O-N 3.47Å; E253-V256 PolarHBondContact O-N 3.41Å; E253-R257 WeakPolarHBondContact O-CB 3.38Å; E253-R257 PolarHBondContact O-N 3.12Å
254V90.5Very high89.1Confident51 Ų5149.9 Ų49.931%0.30927%0.268SS..Hα-helixtrans-64.9-46.3175.1-1750000109.6D251 V252 V256 R257 D258D251-V254 HydrophobicContact CB-CB 4.18Å; D251-V254 HydrophobicContact CB-CG2 4.14Å; D251-V254 WeakPolarHBondContact O-CB 3.48Å; D251-V254 PolarHBondContact O-N 2.92Å; D251-V254 VanDerWaalsContact O-N 3.1Å; V252-V254 VanDerWaalsContact C-N 3.29Å; V252-V254 PolarHBondContact O-N 2.64Å; V254-V256 VanDerWaalsContact C-N 3.33Å; V254-V256 PolarHBondContact O-N 3Å; V254-R257 PolarHBondContact O-N 3.41Å; V254-D258 WeakPolarHBondContact CG1-OD2 3.38Å; V254-D258 VanDerWaalsContact O-CB 3.22Å; V254-D258 WeakPolarHBondContact O-CB 3.32Å; V254-D258 PolarHBondContact O-N 3.2Å
255F92.5Very high88.4Confident4 Ų451.4 Ų51.42%0.01828%0.276CS..Hα-helixtrans-55.4-46.5174.3163.1-107.5000112.3D180 L181 Y184 L240 D251 V252 E259 L260D180-F255 HydrophobicContact CB-CE2 4.15Å; D180-F255 HydrophobicContact CB-CZ 3.7Å; L181-F255 HydrophobicContact CB-CD1 4.24Å; L181-F255 HydrophobicContact CB-CE1 4.11Å; L181-F255 HydrophobicContact CB-CZ 4.35Å; L181-F255 HydrophobicContact CD1-CB 3.72Å; L181-F255 HydrophobicContact CD1-CD1 3.73Å; L181-F255 HydrophobicContact CD1-CD2 4.34Å; L181-F255 HydrophobicContact CD1-CE1 4.45Å; L181-F255 HydrophobicContact CD1-CG 3.65Å; Y184-F255 HydrophobicContact CD1-CB 3.76Å; Y184-F255 AromaticContact CD1-CD2 3.74Å; Y184-F255 HydrophobicContact CD1-CD2 3.74Å; Y184-F255 HydrophobicContact CD1-CG 4.16Å; Y184-F255 AromaticContact CD2-CD2 3.93Å; Y184-F255 HydrophobicContact CD2-CD2 3.93Å; Y184-F255 HydrophobicContact CE1-CB 3.7Å; Y184-F255 HydrophobicContact CE1-CD2 4.34Å; Y184-F255 HydrophobicContact CG-CB 4.37Å; Y184-F255 AromaticContact CG-CD2 3.49Å; Y184-F255 HydrophobicContact CG-CD2 3.49Å; Y184-F255 VanDerWaalsContact CG-CD2 3.49Å; Y184-F255 HydrophobicContact CG-CE2 4.26Å; Y184-F255 HydrophobicContact CG-CG 4.36Å; L240-F255 HydrophobicContact CD2-CD1 4.28Å; L240-F255 HydrophobicContact CD2-CE1 4Å; D251-F255 PolarHBondContact O-N 2.91Å; V252-F255 WeakPolarHBondContact O-CB 3.36Å; V252-F255 PolarHBondContact O-N 3.02Å; F255-E259 HydrophobicContact CD2-CB 3.85Å; F255-E259 HydrophobicContact CD2-CG 4.35Å; F255-E259 HydrophobicContact CE2-CB 3.97Å; F255-E259 HydrophobicContact CE2-CG 4.03Å; F255-E259 WeakPolarHBondContact O-CB 3.5Å; F255-E259 PolarHBondContact O-N 3Å; F255-L260 PolarHBondContact O-N 3.37Å
256V92.6Very high87.4Confident0 Ų051.3 Ų51.30%028%0.281CS..Iπ-helixtrans-65.9-45.2-179.8178.60000111.3L237 V252 E253 V254 L260 C261 W297 L300L237-V256 HydrophobicContact CD1-CG1 4.44Å; L237-V256 HydrophobicContact CD1-CG2 3.7Å; L237-V256 HydrophobicContact CD2-CG1 3.97Å; L237-V256 HydrophobicContact CG-CG2 4.39Å; V252-V256 HydrophobicContact CG1-CG2 4.26Å; V252-V256 WeakPolarHBondContact O-CG2 3.12Å; V252-V256 PolarHBondContact O-N 3.2Å; E253-V256 PolarHBondContact O-N 3.41Å; V254-V256 VanDerWaalsContact C-N 3.33Å; V254-V256 PolarHBondContact O-N 3Å; V256-L260 HydrophobicContact CG1-CD2 4.17Å; V256-L260 VanDerWaalsContact O-CB 3.32Å; V256-L260 WeakPolarHBondContact O-CB 3.42Å; V256-L260 PolarHBondContact O-N 3.36Å; V256-C261 PolarHBondContact O-N 3.14Å; V256-W297 HydrophobicContact CB-CZ3 4.08Å; V256-W297 HydrophobicContact CG1-CE3 4.22Å; V256-W297 HydrophobicContact CG1-CZ3 3.63Å; V256-L300 HydrophobicContact CG1-CD2 3.86Å
257R91.1Very high86.2Confident97 Ų9752.2 Ų52.237%0.36628%0.278SS..Iπ-helixtrans-65.5-47.2179.1-172.5-169.171-167.7-4.3111.9E253 V254 C261 G262 C263 W297E253-R257 WeakPolarHBondContact O-CB 3.38Å; E253-R257 PolarHBondContact O-N 3.12Å; V254-R257 PolarHBondContact O-N 3.41Å; R257-C261 WeakPolarHBondContact O-CB 3.36Å; R257-G262 PolarHBondContact O-N 2.87Å; R257-C263 HydrophobicContact CG-CB 3.98Å; R257-C263 WeakPolarHBondContact O-CB 3.24Å; R257-C263 PolarHBondContact O-N 3.13Å; R257-W297 HydrophobicContact CB-CD2 3.91Å; R257-W297 HydrophobicContact CB-CE3 3.98Å; R257-W297 HydrophobicContact CB-CG 4.44Å; R257-W297 HydrophobicContact CB-CH2 4.39Å; R257-W297 HydrophobicContact CB-CZ2 4.32Å; R257-W297 HydrophobicContact CB-CZ3 4.23Å; R257-W297 HydrophobicContact CG-CB 4.47Å; R257-W297 HydrophobicContact CG-CD2 3.79Å; R257-W297 HydrophobicContact CG-CE3 4.34Å; R257-W297 HydrophobicContact CG-CG 3.82Å
258D88.9Confident84.3Confident13 Ų1359.3 Ų59.37%0.0731%0.31CS..Iπ-helixtrans-87.8-46.6-166.2-66.2-12.3000111.8V254 G262 D264 P265V254-D258 WeakPolarHBondContact CG1-OD2 3.38Å; V254-D258 VanDerWaalsContact O-CB 3.22Å; V254-D258 WeakPolarHBondContact O-CB 3.32Å; V254-D258 PolarHBondContact O-N 3.2Å; D258-G262 VanDerWaalsContact O-CA 3.28Å; D258-G262 WeakPolarHBondContact O-CA 3.31Å; D258-G262 PolarHBondContact O-N 3.37Å; D258-D264 WeakPolarHBondContact CB-O 3.39Å; D258-P265 WeakPolarHBondContact O-CA 3.13Å
259E87.5Confident82.1Confident50 Ų5063.4 Ų63.423%0.23432%0.319CS..Iπ-helixtrans-89.1-45.3-178.1-168.179.4170.900112.2Y184 R187 F255Y184-E259 HydrophobicContact CD2-CB 4.02Å; Y184-E259 HydrophobicContact CD2-CG 4.31Å; Y184-E259 HydrophobicContact CE2-CB 4.16Å; R187-E259 IonicContact CZ-OE1 3.4Å; R187-E259 IonicContact NH1-OE1 2.81Å; R187-E259 PolarHBondContact NH1-OE1 3.24Å; R187-E259 IonicContact NH1-OE2 3.87Å; R187-E259 IonicContact NH2-OE1 3.22Å; R187-E259 PolarHBondContact NH2-OE1 2.93Å; F255-E259 HydrophobicContact CD2-CB 3.85Å; F255-E259 HydrophobicContact CD2-CG 4.35Å; F255-E259 HydrophobicContact CE2-CB 3.97Å; F255-E259 HydrophobicContact CE2-CG 4.03Å; F255-E259 WeakPolarHBondContact O-CB 3.5Å; F255-E259 PolarHBondContact O-N 3Å
260L88.3Confident79.6Confident72 Ų7269.1 Ų69.138%0.37734%0.343SS..Iπ-helixtrans-81.2-43.5-174.7-173.466.4000112.9F177 L237 F255 V256F177-L260 HydrophobicContact CE1-CD1 4.34Å; F177-L260 HydrophobicContact CE1-CD2 4.19Å; L237-L260 HydrophobicContact CD1-CD2 4Å; L237-L260 HydrophobicContact CD2-CD2 3.87Å; F255-L260 PolarHBondContact O-N 3.37Å; V256-L260 HydrophobicContact CG1-CD2 4.17Å; V256-L260 VanDerWaalsContact O-CB 3.32Å; V256-L260 WeakPolarHBondContact O-CB 3.42Å; V256-L260 PolarHBondContact O-N 3.36Å
261C89.6Confident77.1Confident2 Ų276.7 Ų76.71%0.01438%0.378CS..SBendtrans-82.4-26.1175.9-69.70000112.7V256 R257 R296 W297V256-C261 PolarHBondContact O-N 3.14Å; R257-C261 WeakPolarHBondContact O-CB 3.36Å; C261-R296 PolarHBondContact O-NH1 3.44Å; C261-W297 HydrophobicContact CB-CB 4.08Å
262G86.4Confident74.3Confident26 Ų2679.5 Ų79.527%0.26839%0.388SS..  trans82.427.3178.800000113.8R257 D258 P293R257-G262 PolarHBondContact O-N 2.87Å; D258-G262 VanDerWaalsContact O-CA 3.28Å; D258-G262 WeakPolarHBondContact O-CA 3.31Å; D258-G262 PolarHBondContact O-N 3.37Å; G262-P293 WeakPolarHBondContact O-CB 3.31Å
263C82.3Confident71.4Confident38 Ų3884.3 Ų84.326%0.25742%0.422SS..SBendtrans-67.8-40.6177.4-66.40000112R257 P293R257-C263 HydrophobicContact CG-CB 3.98Å; R257-C263 WeakPolarHBondContact O-CB 3.24Å; R257-C263 PolarHBondContact O-N 3.13Å; C263-P293 PolarHBondContact SG-O 3.24Å
264D81.7Confident68.4Low113 Ų11386.4 Ų86.460%0.60443%0.432SS*.SBendtrans-147.770.9173.3-162.510.6000111.2D258 V266D258-D264 WeakPolarHBondContact CB-O 3.39Å; D264-V266 PolarHBondContact O-N 3.44Å
265P78.6Confident65.5Low43 Ų4393 Ų9328%0.27946%0.459SS..  trans-67.9134.7-172.128.2-34.6000111.2D258 Q267D258-P265 WeakPolarHBondContact O-CA 3.13Å; P265-Q267 CarbonylContact O-C 3.52Å; P265-Q267 PolarHBondContact O-N 2.92Å
266V70.5Confident62.3Low76 Ų76100.4 Ų100.446%0.46149%0.494SS..SBendtrans-60.7-31.9176177.70000110.5Y184 I188 D264Y184-V266 HydrophobicContact CD2-CG2 4.25Å; Y184-V266 HydrophobicContact CE2-CG2 3.71Å; I188-V266 HydrophobicContact CD1-CG2 4.47Å; I188-V266 HydrophobicContact CG1-CG2 4.35Å; D264-V266 PolarHBondContact O-N 3.44Å
267Q64.5Low59.2Low108 Ų108107.8 Ų107.851%0.50553%0.533SS..SBendtrans-88.9100.4165.7-66.5-1748.600110.2P265 F269P265-Q267 CarbonylContact O-C 3.52Å; P265-Q267 PolarHBondContact O-N 2.92Å; Q267-F269 PolarHBondContact O-N 3.44Å
268K50.6Low56Low184 Ų184106.5 Ų106.580%0.855%0.55SS**  trans-62.3109.4148.7-70.6-174.8-178.2179.60105.6K270K268-K270 PolarHBondContact O-N 3.16Å
269F42.8Very low53Low175 Ų175113.8 Ų113.877%0.76859%0.589SS**  trans-44.4111.8167.3-86.8-92.6000107.1Q267 Q271Q267-F269 PolarHBondContact O-N 3.44Å; F269-Q271 PolarHBondContact O-N 2.92Å
270K33.8Very low50.1Low199 Ų199120.6 Ų120.687%0.86562%0.621SS**  trans-6387.2159.8-80.9-176.2175.8-178.70104.7K268 H272K268-K270 PolarHBondContact O-N 3.16Å; K270-H272 PolarHBondContact O-N 3.01Å
271Q34Very low47.2Very low167 Ų167122.5 Ų122.578%0.7864%0.641SS**  trans-55115.7153.6-74.8-175.9-6.200104F269 S273F269-Q271 PolarHBondContact O-N 2.92Å; Q271-S273 PolarHBondContact O-N 3.21Å
272H29Very low44.3Very low148 Ų148130 Ų13069%0.68568%0.68SS**  trans-49.497.2164.3-87.8-104.6000107.1K270 E274K270-H272 PolarHBondContact O-N 3.01Å; H272-E274 HydrophobicContact CB-CG 4.28Å; H272-E274 IonicContact CE1-OE1 3.8Å; H272-E274 PolarHBondContact CE1-OE1 2.97Å; H272-E274 VanDerWaalsContact CE1-OE1 3.23Å; H272-E274 IonicContact CG-OE1 3.46Å; H272-E274 VanDerWaalsContact ND1-CD 3.31Å; H272-E274 IonicContact ND1-OE1 2.66Å; H272-E274 PolarHBondContact ND1-OE1 3.3Å; H272-E274 PolarHBondContact O-N 2.91Å; H272-E274 VanDerWaalsContact O-N 3.11Å
273S31.9Very low41.4Very low107 Ų107134.8 Ų134.875%0.74871%0.705SS**  trans-74.469.3146.9570000105.6Q271 E275Q271-S273 PolarHBondContact O-N 3.21Å; S273-E275 PolarHBondContact O-N 3.37Å
274E29.1Very low38.7Very low142 Ų142142.2 Ų142.266%0.66473%0.733SS**  trans-76.288.3151.6-78.6173.9-170.800104.8H272 E276H272-E274 HydrophobicContact CB-CG 4.28Å; H272-E274 IonicContact CE1-OE1 3.8Å; H272-E274 PolarHBondContact CE1-OE1 2.97Å; H272-E274 VanDerWaalsContact CE1-OE1 3.23Å; H272-E274 IonicContact CG-OE1 3.46Å; H272-E274 VanDerWaalsContact ND1-CD 3.31Å; H272-E274 IonicContact ND1-OE1 2.66Å; H272-E274 PolarHBondContact ND1-OE1 3.3Å; H272-E274 PolarHBondContact O-N 2.91Å; H272-E274 VanDerWaalsContact O-N 3.11Å; E274-E276 PolarHBondContact O-N 3.34Å; E274-E276 VanDerWaalsContact O-N 3.16Å
275E29.3Very low36.2Very low188 Ų188142.4 Ų142.488%0.87974%0.74SS**  trans-75.965.6153.4-69.8-177.2171.700107.4S273S273-E275 PolarHBondContact O-N 3.37Å
276E25.3Very low33.8Very low161 Ų161149.4 Ų149.475%0.75277%0.766SS**  trans-138112.5157.8-75.4-166.9170.600108.8E274E274-E276 PolarHBondContact O-N 3.34Å; E274-E276 VanDerWaalsContact O-N 3.16Å
277D27.9Very low32.2Very low155 Ų155155 Ų15583%0.82978%0.784SS**  trans74.8124.7149.8-57.8-28.3000120.1
278G23.4Very low31.2Very low70 Ų70156.4 Ų156.472%0.72280%0.795SS**  trans-69.7146.9176.400000112.1
279D26.5Very low31Very low166 Ų166153.8 Ų153.889%0.88880%0.795SS**  -160.8142.1122-112.2-26.6000109.3S281D279-S281 PolarHBondContact O-N 3.48Å
280E27.1Very low31.8Very low192 Ų192154 Ų15490%0.89780%0.795SS**  trans-61.5117.2178-63.2174.7150.600110.5
281S26Very low33.3Very low113 Ų113147.3 Ų147.379%0.7977%0.773SS**  trans-164.4136.713744.50000111.8D279 T283D279-S281 PolarHBondContact O-N 3.48Å; S281-T283 PolarHBondContact O-N 2.89Å
282D28.4Very low35.9Very low158 Ų158144 Ų14485%0.84576%0.761SS**  trans-38.7122.5175.3-65.9-60.8000114
283T26.3Very low38.7Very low127 Ų127139 Ų13978%0.77974%0.742SS**  -179.988.9105.8-52.50000107S281 P285S281-T283 PolarHBondContact O-N 2.89Å; T283-P285 WeakPolarHBondContact O-CD 3.46Å
284K26.1Very low41.5Very low194 Ų194137.7 Ų137.784%0.84372%0.724SS**  trans-57.1123168.4-77.6177.4177.7172.70107.6K286K284-K286 PolarHBondContact O-N 2.83Å; K284-K286 VanDerWaalsContact O-N 3.16Å
285P29.9Very low44.4Very low118 Ų118133.4 Ų133.477%0.76671%0.707SS**  trans-58.6128.2173.924.1-30.3000106.6T283 K287T283-P285 WeakPolarHBondContact O-CD 3.46Å; P285-K287 PolarHBondContact O-N 2.86Å
286K28.1Very low47.4Very low190 Ų190129.7 Ų129.783%0.82669%0.685SS**  trans-51.2103.9174.6-73.3176176.4175.80107.2K284 D288K284-K286 PolarHBondContact O-N 2.83Å; K284-K286 VanDerWaalsContact O-N 3.16Å; K286-D288 PolarHBondContact O-N 3.47Å
287K36Very low50.6Low193 Ų193123.9 Ų123.984%0.83966%0.657SS**  trans-61.591.7160.4-100.5-177.8171.9179.30104.7P285 T289P285-K287 PolarHBondContact O-N 2.86Å; K287-T289 VanDerWaalsContact C-N 3.25Å; K287-T289 PolarHBondContact O-N 3.23Å
288D43.6Very low53.7Low137 Ų137121.8 Ų121.873%0.73364%0.642SS**  trans-61.298.1166-79.1-34.8000106.7K286 K290K286-D288 PolarHBondContact O-N 3.47Å; D288-K290 PolarHBondContact O-N 3.32Å; D288-K290 VanDerWaalsContact O-N 3.13Å
289T46.1Very low57Low129 Ų129124.3 Ų124.379%0.79164%0.635SS**  trans-45.1114.4160.8-48.10000107.7K287K287-T289 VanDerWaalsContact C-N 3.25Å; K287-T289 PolarHBondContact O-N 3.23Å
290K60.2Low60.2Low179 Ų179117.7 Ų117.778%0.77860%0.599SS**  trans-171.6111.7160.8-101.2141.8-164.8-167.50113.9D288D288-K290 PolarHBondContact O-N 3.32Å; D288-K290 VanDerWaalsContact O-N 3.13Å
291C65.5Low63.4Low60 Ų60110 Ų11041%0.40557%0.566SS.*  trans69.3124.5165-130.90000117.3T295C291-T295 VanDerWaalsContact SG-CB 3.59Å; C291-T295 WeakPolarHBondContact SG-CG2 3.49Å
292D88.4Confident66.7Low98 Ų98108.4 Ų108.452%0.52456%0.555SS.*  trans-56.7140.6168.3-174.949.3000110E294 T295 R296D292-E294 PolarHBondContact O-N 3.45Å; D292-E294 VanDerWaalsContact O-N 3.17Å; D292-E294 WeakPolarHBondContact OD2-CB 3.41Å; D292-T295 PolarHBondContact O-N 3.5Å; D292-T295 VanDerWaalsContact O-N 3.11Å; D292-R296 PolarHBondContact O-N 3.13Å
293P87.8Confident69.9Low43 Ų43103.9 Ų103.928%0.27953%0.526SS..Hα-helixtrans-52.1-37.7179.3-29.537.4000113.2G262 C263 R296 W297G262-P293 WeakPolarHBondContact O-CB 3.31Å; C263-P293 PolarHBondContact SG-O 3.24Å; P293-R296 WeakPolarHBondContact O-CB 3.43Å; P293-R296 PolarHBondContact O-N 3.49Å; P293-W297 PolarHBondContact O-N 3.46Å
294E89.9Confident73.2Confident79 Ų7998.5 Ų98.537%0.36949%0.493SS..Hα-helixtrans-69.9-41.8179.8-169.655.9-148.800112D292 R296 W297 Q298D292-E294 PolarHBondContact O-N 3.45Å; D292-E294 VanDerWaalsContact O-N 3.17Å; D292-E294 WeakPolarHBondContact OD2-CB 3.41Å; E294-R296 VanDerWaalsContact C-N 3.31Å; E294-R296 PolarHBondContact O-N 3.06Å; E294-W297 PolarHBondContact O-N 2.84Å; E294-Q298 VanDerWaalsContact O-CG 3.27Å; E294-Q298 WeakPolarHBondContact O-CG 3.37Å; E294-Q298 PolarHBondContact O-N 2.89Å
295T91.4Very high76.5Confident52 Ų5292.3 Ų92.332%0.31947%0.469SS..Hα-helixtrans-63.2-39.5173.3-53.90000111.4C291 D292 W297 Q298 E299C291-T295 VanDerWaalsContact SG-CB 3.59Å; C291-T295 WeakPolarHBondContact SG-CG2 3.49Å; D292-T295 PolarHBondContact O-N 3.5Å; D292-T295 VanDerWaalsContact O-N 3.11Å; T295-W297 PolarHBondContact O-N 3.49Å; T295-Q298 PolarHBondContact O-N 3.12Å; T295-E299 WeakPolarHBondContact O-CG 3.41Å; T295-E299 PolarHBondContact O-N 3.13Å
296R91.3Very high79.6Confident109 Ų10990.2 Ų90.241%0.41145%0.448SS..Hα-helixtrans-62.1-43.2175.4-174.2-174.2-60.1155.84.4111.7C261 D292 P293 E294 L300C261-R296 PolarHBondContact O-NH1 3.44Å; D292-R296 PolarHBondContact O-N 3.13Å; P293-R296 WeakPolarHBondContact O-CB 3.43Å; P293-R296 PolarHBondContact O-N 3.49Å; E294-R296 VanDerWaalsContact C-N 3.31Å; E294-R296 PolarHBondContact O-N 3.06Å; R296-L300 VanDerWaalsContact O-CB 3.29Å; R296-L300 WeakPolarHBondContact O-CB 3.46Å; R296-L300 PolarHBondContact O-N 3.11Å
297W92.8Very high82.9Confident40 Ų4081.1 Ų81.115%0.15241%0.408CS..Hα-helixtrans-61.4-45.3174.1168.1-117.4000111.5V256 R257 C261 P293 E294 T295 E299 L300 S301V256-W297 HydrophobicContact CB-CZ3 4.08Å; V256-W297 HydrophobicContact CG1-CE3 4.22Å; V256-W297 HydrophobicContact CG1-CZ3 3.63Å; R257-W297 HydrophobicContact CB-CD2 3.91Å; R257-W297 HydrophobicContact CB-CE3 3.98Å; R257-W297 HydrophobicContact CB-CG 4.44Å; R257-W297 HydrophobicContact CB-CH2 4.39Å; R257-W297 HydrophobicContact CB-CZ2 4.32Å; R257-W297 HydrophobicContact CB-CZ3 4.23Å; R257-W297 HydrophobicContact CG-CB 4.47Å; R257-W297 HydrophobicContact CG-CD2 3.79Å; R257-W297 HydrophobicContact CG-CE3 4.34Å; R257-W297 HydrophobicContact CG-CG 3.82Å; C261-W297 HydrophobicContact CB-CB 4.08Å; P293-W297 PolarHBondContact O-N 3.46Å; E294-W297 PolarHBondContact O-N 2.84Å; T295-W297 PolarHBondContact O-N 3.49Å; W297-E299 PolarHBondContact O-N 3.26Å; W297-L300 PolarHBondContact O-N 3.01Å; W297-S301 VanDerWaalsContact O-CB 3.22Å; W297-S301 WeakPolarHBondContact O-CB 3.46Å; W297-S301 PolarHBondContact O-N 3.16Å
298Q92.7Very high85.8Confident110 Ų11075.8 Ų75.851%0.51438%0.383SS..Hα-helixtrans-60.8-45.6178.6-71.7170.36.700112.7E294 T295 S302E294-Q298 VanDerWaalsContact O-CG 3.27Å; E294-Q298 WeakPolarHBondContact O-CG 3.37Å; E294-Q298 PolarHBondContact O-N 2.89Å; T295-Q298 PolarHBondContact O-N 3.12Å; Q298-S302 VanDerWaalsContact O-CB 3.29Å; Q298-S302 WeakPolarHBondContact O-CB 3.43Å; Q298-S302 PolarHBondContact O-N 3.02Å
299E93.4Very high88.3Confident123 Ų12374.1 Ų74.158%0.57537%0.371SS*.Hα-helixtrans-62-44.7175.9-72.8177.2178.900111.6T295 W297 R303T295-E299 WeakPolarHBondContact O-CG 3.41Å; T295-E299 PolarHBondContact O-N 3.13Å; W297-E299 PolarHBondContact O-N 3.26Å; E299-R303 WeakPolarHBondContact O-CB 3.4Å; E299-R303 PolarHBondContact O-N 2.66Å; E299-R303 VanDerWaalsContact O-N 3.11Å
300L94.2Very high90.6Very high27 Ų2770 Ų7014%0.14135%0.345CS..Hα-helixtrans-67.5-46.2179.7-175.160.3000111.9Q234 L237 V256 R296 W297 S302 R303 L304Q234-L300 HydrophobicContact CG-CD1 4.41Å; L237-L300 HydrophobicContact CD2-CD1 3.98Å; L237-L300 HydrophobicContact CD2-CD2 3.74Å; L237-L300 HydrophobicContact CD2-CG 4.14Å; V256-L300 HydrophobicContact CG1-CD2 3.86Å; R296-L300 VanDerWaalsContact O-CB 3.29Å; R296-L300 WeakPolarHBondContact O-CB 3.46Å; R296-L300 PolarHBondContact O-N 3.11Å; W297-L300 PolarHBondContact O-N 3.01Å; L300-S302 PolarHBondContact O-N 3.28Å; L300-R303 WeakPolarHBondContact O-CB 3.32Å; L300-R303 PolarHBondContact O-N 3.23Å; L300-R303 VanDerWaalsContact O-N 3.12Å; L300-L304 HydrophobicContact CD1-CD1 4.47Å; L300-L304 HydrophobicContact CD1-CG 4.42Å; L300-L304 HydrophobicContact CG-CD1 4.04Å; L300-L304 HydrophobicContact CG-CG 4.43Å; L300-L304 VanDerWaalsContact O-CG 3.28Å; L300-L304 WeakPolarHBondContact O-CG 3.3Å; L300-L304 PolarHBondContact O-N 2.76Å
301S94Very high92.4Very high30 Ų3062 Ų6221%0.2131%0.311CS..Hα-helixtrans-58.6-48.6177.3-173.20000110.7W297 R303 L304 D305W297-S301 VanDerWaalsContact O-CB 3.22Å; W297-S301 WeakPolarHBondContact O-CB 3.46Å; W297-S301 PolarHBondContact O-N 3.16Å; S301-R303 PolarHBondContact O-N 3.41Å; S301-L304 PolarHBondContact O-N 2.81Å; S301-L304 VanDerWaalsContact O-N 3.13Å; S301-D305 WeakPolarHBondContact O-CB 3.4Å; S301-D305 VanDerWaalsContact O-CG 3.32Å; S301-D305 PolarHBondContact O-N 2.75Å
302S95.2Very high93.8Very high80 Ų8064.7 Ų64.756%0.55932%0.321SS*.Hα-helixtrans-56.5-39.5175.7178.60000112Q298 L300 F306Q298-S302 VanDerWaalsContact O-CB 3.29Å; Q298-S302 WeakPolarHBondContact O-CB 3.43Å; Q298-S302 PolarHBondContact O-N 3.02Å; L300-S302 PolarHBondContact O-N 3.28Å; S302-F306 PolarHBondContact O-N 3.48Å
303R94.7Very high94.2Very high63 Ų6366.5 Ų66.524%0.23833%0.327CS..Hα-helixtrans-69.1-40.9177.5-169.458.4173.3148.7-5.2112.9T229 E299 L300 S301 F306 I307T229-R303 PolarHBondContact O-NH2 3.23Å; E299-R303 WeakPolarHBondContact O-CB 3.4Å; E299-R303 PolarHBondContact O-N 2.66Å; E299-R303 VanDerWaalsContact O-N 3.11Å; L300-R303 WeakPolarHBondContact O-CB 3.32Å; L300-R303 PolarHBondContact O-N 3.23Å; L300-R303 VanDerWaalsContact O-N 3.12Å; S301-R303 PolarHBondContact O-N 3.41Å; R303-F306 PolarHBondContact O-N 3.31Å; R303-I307 WeakPolarHBondContact O-CG1 3.43Å; R303-I307 PolarHBondContact O-N 2.95Å; R303-I307 VanDerWaalsContact O-N 3.13Å
304L96Very high94.5Very high14 Ų1466.2 Ų66.27%0.07332%0.321CS..Hα-helixtrans-67.4-38.9176.5-66.4171.3000111.2L237 A238 V241 L300 S301 F306 I307 R308L237-L304 HydrophobicContact CB-CD2 4.26Å; L237-L304 HydrophobicContact CD2-CD1 4.04Å; L237-L304 HydrophobicContact CD2-CD2 4.27Å; L237-L304 HydrophobicContact CG-CD1 4.37Å; L237-L304 HydrophobicContact CG-CD2 4.24Å; A238-L304 HydrophobicContact CB-CD2 3.76Å; V241-L304 HydrophobicContact CG2-CD1 4.23Å; L300-L304 HydrophobicContact CD1-CD1 4.47Å; L300-L304 HydrophobicContact CD1-CG 4.42Å; L300-L304 HydrophobicContact CG-CD1 4.04Å; L300-L304 HydrophobicContact CG-CG 4.43Å; L300-L304 VanDerWaalsContact O-CG 3.28Å; L300-L304 WeakPolarHBondContact O-CG 3.3Å; L300-L304 PolarHBondContact O-N 2.76Å; S301-L304 PolarHBondContact O-N 2.81Å; S301-L304 VanDerWaalsContact O-N 3.13Å; L304-F306 VanDerWaalsContact C-N 3.35Å; L304-F306 PolarHBondContact O-N 3.28Å; L304-I307 PolarHBondContact O-N 3.46Å; L304-R308 WeakPolarHBondContact O-CB 3.32Å; L304-R308 PolarHBondContact O-N 2.95Å
305D95.5Very high94.8Very high64 Ų6469.9 Ų69.934%0.34234%0.338SS..Hα-helixtrans-61.1-43.2174.3-75.5-37.4000111.8S301 I307 R308 Q309S301-D305 WeakPolarHBondContact O-CB 3.4Å; S301-D305 VanDerWaalsContact O-CG 3.32Å; S301-D305 PolarHBondContact O-N 2.75Å; D305-I307 PolarHBondContact O-N 3.27Å; D305-R308 PolarHBondContact O-N 2.96Å; D305-R308 IonicContact OD1-CZ 3.24Å; D305-R308 IonicContact OD1-NE 2.59Å; D305-R308 IonicContact OD1-NH2 3.82Å; D305-R308 PolarHBondContact OD1-NH2 3.08Å; D305-Q309 WeakPolarHBondContact O-CB 3.43Å; D305-Q309 PolarHBondContact O-N 3.44Å
306F95.7Very high95Very high74 Ų7469.8 Ų69.833%0.32533%0.334SS..Hα-helixtrans-61.7-43.1174.5179.2-91.7000112.3P15 S302 R303 L304 Q309 T310P15-F306 HydrophobicContact CG-CE1 4.36Å; P15-F306 HydrophobicContact CG-CZ 3.89Å; S302-F306 PolarHBondContact O-N 3.48Å; R303-F306 PolarHBondContact O-N 3.31Å; L304-F306 VanDerWaalsContact C-N 3.35Å; L304-F306 PolarHBondContact O-N 3.28Å; F306-Q309 PolarHBondContact O-N 3.35Å; F306-T310 WeakPolarHBondContact O-CB 3.29Å; F306-T310 PolarHBondContact O-N 2.87Å; F306-T310 PolarHBondContact O-OG1 3.26Å
307I96.9Very high95.1Very high0 Ų065.7 Ų65.70%032%0.321CS..Hα-helixtrans-62-47.8176.1-68.1170.2000109.7W221 L226 A230 Q234 A238 R303 L304 D305 Q309 T310 I311W221-I307 HydrophobicContact CZ3-CG2 4.08Å; L226-I307 HydrophobicContact CD1-CG2 3.78Å; L226-I307 HydrophobicContact CD2-CB 4.34Å; L226-I307 HydrophobicContact CD2-CG1 3.92Å; L226-I307 HydrophobicContact CD2-CG2 3.88Å; A230-I307 HydrophobicContact CB-CD1 4.1Å; Q234-I307 HydrophobicContact CB-CD1 4.36Å; A238-I307 HydrophobicContact CB-CB 4.17Å; A238-I307 HydrophobicContact CB-CD1 4.07Å; A238-I307 HydrophobicContact CB-CG2 3.59Å; R303-I307 WeakPolarHBondContact O-CG1 3.43Å; R303-I307 PolarHBondContact O-N 2.95Å; R303-I307 VanDerWaalsContact O-N 3.13Å; L304-I307 PolarHBondContact O-N 3.46Å; D305-I307 PolarHBondContact O-N 3.27Å; I307-Q309 PolarHBondContact O-N 3.14Å; I307-T310 WeakPolarHBondContact O-CB 3.46Å; I307-T310 PolarHBondContact O-N 3.36Å; I307-T310 VanDerWaalsContact O-N 3.16Å; I307-I311 HydrophobicContact CG2-CG1 4.35Å; I307-I311 WeakPolarHBondContact O-CG1 3.44Å; I307-I311 PolarHBondContact O-N 3.36Å
308R95.6Very high94.9Very high80 Ų8068.7 Ų68.730%0.30234%0.343SS..Hα-helixtrans-60-43.8178.7-178.2171.861.7173.7-3112H245 L304 D305 I311 N312H245-R308 PolarHBondContact CE1-NH1 2.86Å; H245-R308 PolarHBondContact NE2-NH1 3.32Å; L304-R308 WeakPolarHBondContact O-CB 3.32Å; L304-R308 PolarHBondContact O-N 2.95Å; D305-R308 PolarHBondContact O-N 2.96Å; D305-R308 IonicContact OD1-CZ 3.24Å; D305-R308 IonicContact OD1-NE 2.59Å; D305-R308 IonicContact OD1-NH2 3.82Å; D305-R308 PolarHBondContact OD1-NH2 3.08Å; R308-I311 PolarHBondContact O-N 2.98Å; R308-N312 WeakPolarHBondContact O-CB 3.28Å; R308-N312 VanDerWaalsContact O-CG 3.24Å; R308-N312 PolarHBondContact O-N 3.44Å; R308-N312 PolarHBondContact O-ND2 3.4Å
309Q96.2Very high94.8Very high102 Ų10268.3 Ų68.348%0.47735%0.345SS..Hα-helixtrans-59.1-48.1174.2-177.6179.26.300111D305 F306 I307 I311 N312 E313D305-Q309 WeakPolarHBondContact O-CB 3.43Å; D305-Q309 PolarHBondContact O-N 3.44Å; F306-Q309 PolarHBondContact O-N 3.35Å; I307-Q309 PolarHBondContact O-N 3.14Å; Q309-I311 VanDerWaalsContact C-N 3.28Å; Q309-I311 PolarHBondContact O-N 2.96Å; Q309-N312 PolarHBondContact O-N 2.77Å; Q309-E313 HydrophobicContact CG-CG 4.45Å; Q309-E313 VanDerWaalsContact CG-OE1 3.27Å; Q309-E313 WeakPolarHBondContact CG-OE1 3.43Å; Q309-E313 PolarHBondContact NE2-OE1 3.28Å; Q309-E313 WeakPolarHBondContact O-CG 3.48Å; Q309-E313 PolarHBondContact O-N 2.83Å
310T95.6Very high94.3Very high42 Ų4267.5 Ų67.526%0.25834%0.344SS..Hα-helixtrans-56-45.1177.7-56.90000111F306 I307 F314F306-T310 WeakPolarHBondContact O-CB 3.29Å; F306-T310 PolarHBondContact O-N 2.87Å; F306-T310 PolarHBondContact O-OG1 3.26Å; I307-T310 WeakPolarHBondContact O-CB 3.46Å; I307-T310 PolarHBondContact O-N 3.36Å; I307-T310 VanDerWaalsContact O-N 3.16Å; T310-F314 VanDerWaalsContact O-CB 3.27Å; T310-F314 WeakPolarHBondContact O-CB 3.45Å; T310-F314 PolarHBondContact O-N 3.11Å; T310-F314 VanDerWaalsContact O-N 3.12Å
311I96.5Very high93.5Very high12 Ų1268 Ų686%0.06236%0.355CS..Hα-helixtrans-65.5-44.9178.6-66.8-64000111.8W221 T224 L226 I307 R308 Q309 E313 F314 F316W221-I311 HydrophobicContact CB-CD1 4.17Å; W221-I311 HydrophobicContact CD2-CD1 3.44Å; W221-I311 VanDerWaalsContact CD2-CD1 3.44Å; W221-I311 HydrophobicContact CD2-CG1 3.9Å; W221-I311 HydrophobicContact CE3-CD1 3.93Å; W221-I311 HydrophobicContact CE3-CG1 4.12Å; W221-I311 HydrophobicContact CG-CD1 3.53Å; W221-I311 HydrophobicContact CG-CG1 4.48Å; W221-I311 HydrophobicContact CH2-CG1 4.15Å; W221-I311 HydrophobicContact CZ2-CB 4.43Å; W221-I311 HydrophobicContact CZ2-CD1 4.31Å; W221-I311 HydrophobicContact CZ2-CG1 3.91Å; W221-I311 HydrophobicContact CZ2-CG2 3.93Å; W221-I311 HydrophobicContact CZ3-CG1 4.24Å; T224-I311 HydrophobicContact CG2-CD1 3.81Å; L226-I311 HydrophobicContact CD1-CD1 3.64Å; L226-I311 HydrophobicContact CD1-CG1 4.13Å; I307-I311 HydrophobicContact CG2-CG1 4.35Å; I307-I311 WeakPolarHBondContact O-CG1 3.44Å; I307-I311 PolarHBondContact O-N 3.36Å; R308-I311 PolarHBondContact O-N 2.98Å; Q309-I311 VanDerWaalsContact C-N 3.28Å; Q309-I311 PolarHBondContact O-N 2.96Å; I311-E313 VanDerWaalsContact C-N 3.31Å; I311-E313 PolarHBondContact O-N 3.05Å; I311-F314 WeakPolarHBondContact O-CB 3.47Å; I311-F314 PolarHBondContact O-N 3.39Å; I311-F314 VanDerWaalsContact O-N 3.14Å; I311-F316 HydrophobicContact CD1-CZ 3.87Å; I311-F316 HydrophobicContact CG2-CE2 4.07Å; I311-F316 HydrophobicContact CG2-CZ 4.14Å
312N96Very high92.6Very high116 Ų11672.4 Ų72.462%0.6238%0.384SS*.Hα-helixtrans-65.4-34.1-178.5-73.4-20.3000112.9R308 Q309 F314R308-N312 WeakPolarHBondContact O-CB 3.28Å; R308-N312 VanDerWaalsContact O-CG 3.24Å; R308-N312 PolarHBondContact O-N 3.44Å; R308-N312 PolarHBondContact O-ND2 3.4Å; Q309-N312 PolarHBondContact O-N 2.77Å; N312-F314 VanDerWaalsContact C-N 3.34Å
313E95.8Very high91.5Very high136 Ų13673.2 Ų73.264%0.63639%0.385SS*.Hα-helixtrans-81.7-16176.6-67.6174-172.700112.3Q309 I311Q309-E313 HydrophobicContact CG-CG 4.45Å; Q309-E313 VanDerWaalsContact CG-OE1 3.27Å; Q309-E313 WeakPolarHBondContact CG-OE1 3.43Å; Q309-E313 PolarHBondContact NE2-OE1 3.28Å; Q309-E313 WeakPolarHBondContact O-CG 3.48Å; Q309-E313 PolarHBondContact O-N 2.83Å; I311-E313 VanDerWaalsContact C-N 3.31Å; I311-E313 PolarHBondContact O-N 3.05Å
314F95.9Very high90.9Very high37 Ų3771.4 Ų71.416%0.16239%0.386CS..  trans-78.5127-174.9-164.1-93.7000112.6F63 K67 Q223 T224 T310 I311 N312 F316F63-F314 HydrophobicContact CE1-CE2 4.02Å; F63-F314 HydrophobicContact CE1-CZ 4.42Å; F63-F314 HydrophobicContact CZ-CE2 4.19Å; K67-F314 HydrophobicContact CD-CE1 3.58Å; K67-F314 HydrophobicContact CD-CZ 3.43Å; K67-F314 VanDerWaalsContact CD-CZ 3.43Å; K67-F314 HydrophobicContact CG-CE1 4.36Å; K67-F314 HydrophobicContact CG-CZ 4.16Å; Q223-F314 HydrophobicContact CB-CE1 3.86Å; Q223-F314 HydrophobicContact CB-CZ 4.27Å; Q223-F314 WeakPolarHBondContact O-CZ 3.43Å; T224-F314 HydrophobicContact CG2-CB 4.23Å; T224-F314 HydrophobicContact CG2-CD1 3.7Å; T224-F314 HydrophobicContact CG2-CD2 3.78Å; T224-F314 HydrophobicContact CG2-CE1 3.87Å; T224-F314 HydrophobicContact CG2-CE2 3.95Å; T224-F314 HydrophobicContact CG2-CG 3.63Å; T224-F314 HydrophobicContact CG2-CZ 3.98Å; T310-F314 VanDerWaalsContact O-CB 3.27Å; T310-F314 WeakPolarHBondContact O-CB 3.45Å; T310-F314 PolarHBondContact O-N 3.11Å; T310-F314 VanDerWaalsContact O-N 3.12Å; I311-F314 WeakPolarHBondContact O-CB 3.47Å; I311-F314 PolarHBondContact O-N 3.39Å; I311-F314 VanDerWaalsContact O-N 3.14Å; N312-F314 VanDerWaalsContact C-N 3.34Å; F314-F316 HydrophobicContact CB-CE2 4.04Å; F314-F316 HydrophobicContact CB-CZ 4.16Å; F314-F316 AromaticContact CD1-CD1 3.67Å; F314-F316 HydrophobicContact CD1-CD1 3.67Å; F314-F316 HydrophobicContact CD1-CD2 4.02Å; F314-F316 AromaticContact CD1-CE1 3.59Å; F314-F316 HydrophobicContact CD1-CE1 3.59Å; F314-F316 AromaticContact CD1-CE2 3.95Å; F314-F316 HydrophobicContact CD1-CE2 3.95Å; F314-F316 AromaticContact CD1-CG 3.89Å; F314-F316 HydrophobicContact CD1-CG 3.89Å; F314-F316 AromaticContact CD1-CZ 3.72Å; F314-F316 HydrophobicContact CD1-CZ 3.72Å; F314-F316 AromaticContact CE1-CD1 3.91Å; F314-F316 HydrophobicContact CE1-CD1 3.91Å; F314-F316 AromaticContact CE1-CE1 3.99Å; F314-F316 HydrophobicContact CE1-CE1 3.99Å; F314-F316 HydrophobicContact CE1-CG 4.41Å; F314-F316 HydrophobicContact CG-CE2 4.46Å; F314-F316 HydrophobicContact CG-CZ 4.29Å; F314-F316 WeakPolarHBondContact O-CD2 3.42Å; F314-F316 PolarHBondContact O-N 3.2Å
315Q94.5Very high90.5Very high156 Ų15678.4 Ų78.473%0.72942%0.418SS*.  trans-83.996.5174-65.5179.61.100110.6K67K67-Q315 PolarHBondContact NZ-O 3.28Å
316F95.8Very high90.3Very high50 Ų5077.2 Ų77.222%0.21941%0.411CS..  trans-70.9142.6176.6-68-80.4000112.8L220 W221 Q223 T224 I311 F314 T318L220-F316 HydrophobicContact CD1-CB 4.03Å; L220-F316 HydrophobicContact CD1-CD1 3.58Å; L220-F316 HydrophobicContact CD1-CE1 4.32Å; L220-F316 HydrophobicContact CD1-CG 3.93Å; L220-F316 HydrophobicContact CD2-CD1 4.39Å; L220-F316 HydrophobicContact CD2-CG 4.47Å; L220-F316 HydrophobicContact CG-CD1 3.64Å; L220-F316 HydrophobicContact CG-CE1 3.89Å; L220-F316 HydrophobicContact CG-CG 4.14Å; L220-F316 WeakPolarHBondContact O-CE1 3.46Å; W221-F316 AromaticContact CD1-CZ 3.97Å; Q223-F316 HydrophobicContact CB-CD1 4.16Å; Q223-F316 HydrophobicContact CB-CE1 4.37Å; T224-F316 HydrophobicContact CG2-CE1 3.79Å; T224-F316 HydrophobicContact CG2-CZ 3.85Å; I311-F316 HydrophobicContact CD1-CZ 3.87Å; I311-F316 HydrophobicContact CG2-CE2 4.07Å; I311-F316 HydrophobicContact CG2-CZ 4.14Å; F314-F316 HydrophobicContact CB-CE2 4.04Å; F314-F316 HydrophobicContact CB-CZ 4.16Å; F314-F316 AromaticContact CD1-CD1 3.67Å; F314-F316 HydrophobicContact CD1-CD1 3.67Å; F314-F316 HydrophobicContact CD1-CD2 4.02Å; F314-F316 AromaticContact CD1-CE1 3.59Å; F314-F316 HydrophobicContact CD1-CE1 3.59Å; F314-F316 AromaticContact CD1-CE2 3.95Å; F314-F316 HydrophobicContact CD1-CE2 3.95Å; F314-F316 AromaticContact CD1-CG 3.89Å; F314-F316 HydrophobicContact CD1-CG 3.89Å; F314-F316 AromaticContact CD1-CZ 3.72Å; F314-F316 HydrophobicContact CD1-CZ 3.72Å; F314-F316 AromaticContact CE1-CD1 3.91Å; F314-F316 HydrophobicContact CE1-CD1 3.91Å; F314-F316 AromaticContact CE1-CE1 3.99Å; F314-F316 HydrophobicContact CE1-CE1 3.99Å; F314-F316 HydrophobicContact CE1-CG 4.41Å; F314-F316 HydrophobicContact CG-CE2 4.46Å; F314-F316 HydrophobicContact CG-CZ 4.29Å; F314-F316 WeakPolarHBondContact O-CD2 3.42Å; F314-F316 PolarHBondContact O-N 3.2Å; F316-T318 HydrophobicContact CB-CG2 4.4Å
317V93.3Very high90Very high24 Ų2474.7 Ų74.715%0.14540%0.4CS..  trans-82.8122.9166.7-176.50000107.6K67 Y71 Q223K67-V317 HydrophobicContact CD-CG2 4.09Å; K67-V317 HydrophobicContact CG-CG2 3.99Å; Y71-V317 HydrophobicContact CD1-CG1 3.74Å; Y71-V317 HydrophobicContact CD2-CG1 4.35Å; Y71-V317 WeakPolarHBondContact CD2-O 3.48Å; Y71-V317 HydrophobicContact CE1-CG1 4.23Å; Y71-V317 HydrophobicContact CG-CB 4.25Å; Y71-V317 HydrophobicContact CG-CG1 3.8Å; Q223-V317 PolarHBondContact NE2-O 2.97Å
318T90.1Very high89.7Confident102 Ų10278.1 Ų78.163%0.62642%0.421SS*.  trans-119.6-18.9-176.758.20000113.1Y71 F316Y71-T318 PolarHBondContact OH-O 3.47Å; F316-T318 HydrophobicContact CB-CG2 4.4Å
319D89.1Confident89.5Confident103 Ų10376.2 Ų76.255%0.55142%0.416SS*.SBendtrans-134.8158.5-177.763.5-25.3000113Y71 G321Y71-D319 WeakPolarHBondContact OH-CA 3.46Å; Y71-D319 PolarHBondContact OH-N 3.45Å; D319-G321 PolarHBondContact O-N 2.9Å; D319-G321 VanDerWaalsContact O-N 3.1Å
320L82.9Confident89.3Confident106 Ų10671.4 Ų71.456%0.55539%0.393SS*.  trans-8173.1166.1-64171.6000107.9Y71 L72 I75Y71-L320 HydrophobicContact CD1-CD2 4.35Å; Y71-L320 HydrophobicContact CE1-CD2 3.81Å; Y71-L320 HydrophobicContact CE1-CG 4.06Å; L72-L320 HydrophobicContact CD2-CD2 3.24Å; I75-L320 HydrophobicContact CD1-CD1 4.04Å; I75-L320 HydrophobicContact CD1-CD2 3.68Å; I75-L320 HydrophobicContact CD1-CG 3.86Å
321G77.7Confident89Confident36 Ų3674 Ų7437%0.37141%0.406SS..  trans-60.1-177.2170.900000112.5D319D319-G321 PolarHBondContact O-N 2.9Å; D319-G321 VanDerWaalsContact O-N 3.1Å
322P75.8Confident88.6Confident124 Ų12480.3 Ų80.381%0.80544%0.435SS*.SBendtrans-57.1156.7169.528-34.6000110.8G324P322-G324 PolarHBondContact O-N 2.66Å; P322-G324 VanDerWaalsContact O-N 3.12Å
323V73Confident88.2Confident96 Ų9675.2 Ų75.258%0.58241%0.408SS*.PPolyproline II helixtrans-48.2120.9169.5175.70000108.1E327 V328V323-E327 HydrophobicContact CG1-CB 3.69Å; V323-E327 WeakPolarHBondContact CG1-OE2 3.26Å; V323-V328 HydrophobicContact CG1-CG2 4.05Å
324G81.2Confident87.9Confident26 Ų2670.8 Ų70.827%0.26839%0.386SS..PPolyproline II helixtrans-65.5153.2-177.800000111.2P322 E326 E327 V328P322-G324 PolarHBondContact O-N 2.66Å; P322-G324 VanDerWaalsContact O-N 3.12Å; G324-E326 PolarHBondContact O-N 2.82Å; G324-E327 PolarHBondContact O-N 2.74Å; G324-V328 PolarHBondContact O-N 3.38Å
325E87.9Confident87.5Confident161 Ų16169.1 Ų69.175%0.75238%0.378SS*.Hα-helixtrans-55.1-34.4174.5-65.1-179.8175.500110.9E327 V328 I329E325-E327 PolarHBondContact O-N 3.3Å; E325-V328 PolarHBondContact O-N 3.36Å; E325-I329 WeakPolarHBondContact O-CG1 3.27Å; E325-I329 PolarHBondContact O-N 3.33Å; E325-I329 VanDerWaalsContact O-N 3.09Å
326E90.5Very high87.1Confident38 Ų3862.8 Ų62.818%0.17835%0.351CS..Hα-helixtrans-65.6-33.9177.6-57.188.6165.300113.1Q61 K64 I65 G324 L330Q61-E326 HydrophobicContact CB-CB 4.49Å; Q61-E326 HydrophobicContact CB-CG 3.97Å; Q61-E326 HydrophobicContact CG-CG 3.86Å; K64-E326 HydrophobicContact CD-CG 4.27Å; K64-E326 WeakPolarHBondContact CD-OE1 3.39Å; K64-E326 IonicContact NZ-OE1 3.68Å; K64-E326 PolarHBondContact NZ-OE1 3.29Å; I65-E326 HydrophobicContact CD1-CB 4.01Å; I65-E326 HydrophobicContact CG1-CB 3.88Å; G324-E326 PolarHBondContact O-N 2.82Å; E326-L330 WeakPolarHBondContact O-CB 3.35Å; E326-L330 PolarHBondContact O-N 2.93Å
327E90.6Very high86.6Confident22 Ų2264 Ų6410%0.10336%0.359CS..Hα-helixtrans-72.2-35.2176.5-69.1-165.114500111.7H68 Y69 V323 G324 E325 L330 D331H68-E327 IonicContact CD2-OE1 3.02Å; H68-E327 PolarHBondContact CD2-OE1 2.95Å; H68-E327 VanDerWaalsContact CD2-OE1 3.24Å; H68-E327 IonicContact NE2-OE1 3.14Å; Y69-E327 VanDerWaalsContact CE2-OE1 3.29Å; Y69-E327 WeakPolarHBondContact CE2-OE1 3.41Å; V323-E327 HydrophobicContact CG1-CB 3.69Å; V323-E327 WeakPolarHBondContact CG1-OE2 3.26Å; G324-E327 PolarHBondContact O-N 2.74Å; E325-E327 PolarHBondContact O-N 3.3Å; E327-L330 WeakPolarHBondContact O-CB 3.4Å; E327-L330 PolarHBondContact O-N 3.34Å; E327-D331 PolarHBondContact O-N 3.01Å
328V89.7Confident86.2Confident72 Ų7267.4 Ų67.444%0.43637%0.37SS..Hα-helixtrans-63.7-45.2173.9-179.90000110.3V323 G324 E325 L330 D331 E332V323-V328 HydrophobicContact CG1-CG2 4.05Å; G324-V328 PolarHBondContact O-N 3.38Å; E325-V328 PolarHBondContact O-N 3.36Å; V328-L330 VanDerWaalsContact C-N 3.31Å; V328-L330 PolarHBondContact O-N 2.93Å; V328-D331 PolarHBondContact O-N 3.2Å; V328-E332 PolarHBondContact O-N 3.42Å
329I91.2Very high85.9Confident39 Ų3963.9 Ų63.920%0.235%0.348CS..Hα-helixtrans-62.3-40.7175.7-63.6164.2000110.6V55 L57 E325 D331 E332 C333V55-I329 HydrophobicContact CG1-CG2 4.27Å; L57-I329 HydrophobicContact CD2-CB 3.82Å; L57-I329 HydrophobicContact CD2-CG2 3.53Å; L57-I329 HydrophobicContact CG-CG2 4.1Å; E325-I329 WeakPolarHBondContact O-CG1 3.27Å; E325-I329 PolarHBondContact O-N 3.33Å; E325-I329 VanDerWaalsContact O-N 3.09Å; I329-D331 VanDerWaalsContact C-N 3.33Å; I329-D331 PolarHBondContact O-N 3.17Å; I329-E332 PolarHBondContact O-N 3.39Å; I329-E332 VanDerWaalsContact O-N 3.16Å; I329-C333 PolarHBondContact O-N 3.47Å; I329-C333 PolarHBondContact O-SG 2.96Å
330L93Very high85.5Confident1 Ų161.7 Ų61.71%0.00534%0.335CS..Hα-helixtrans-58.8-43.9177.1177.959.6000112.1L57 I65 V106 M107 Y110 P111 E326 E327 V328 E332 C333 R334L57-L330 HydrophobicContact CD1-CB 4.06Å; L57-L330 HydrophobicContact CD1-CD1 3.84Å; L57-L330 HydrophobicContact CD1-CG 4.49Å; I65-L330 HydrophobicContact CD1-CB 4.05Å; I65-L330 HydrophobicContact CD1-CD2 4.13Å; I65-L330 HydrophobicContact CG2-CD2 4.14Å; V106-L330 HydrophobicContact CB-CD1 4.28Å; V106-L330 HydrophobicContact CG2-CD1 4.1Å; V106-L330 WeakPolarHBondContact O-CD1 3.37Å; M107-L330 HydrophobicContact CG-CD1 4.38Å; Y110-L330 HydrophobicContact CD2-CD2 3.98Å; Y110-L330 HydrophobicContact CD2-CG 4.36Å; Y110-L330 HydrophobicContact CE2-CD2 3.66Å; Y110-L330 HydrophobicContact CE2-CG 4.03Å; P111-L330 HydrophobicContact CG-CD2 4.03Å; E326-L330 WeakPolarHBondContact O-CB 3.35Å; E326-L330 PolarHBondContact O-N 2.93Å; E327-L330 WeakPolarHBondContact O-CB 3.4Å; E327-L330 PolarHBondContact O-N 3.34Å; V328-L330 VanDerWaalsContact C-N 3.31Å; V328-L330 PolarHBondContact O-N 2.93Å; L330-E332 PolarHBondContact O-N 3.3Å; L330-C333 PolarHBondContact O-N 2.75Å; L330-R334 PolarHBondContact O-N 2.99Å
331D89Confident85.3Confident97 Ų9762.6 Ų62.652%0.51934%0.337SS..Hα-helixtrans-65.9-29.7179-74.4-16.7000111.7Y110 E327 V328 I329Y110-D331 PolarHBondContact OH-OD1 3.05Å; Y110-D331 VanDerWaalsContact OH-OD1 3.1Å; E327-D331 PolarHBondContact O-N 3.01Å; V328-D331 PolarHBondContact O-N 3.2Å; I329-D331 VanDerWaalsContact C-N 3.33Å; I329-D331 PolarHBondContact O-N 3.17Å
332E87.5Confident85.6Confident145 Ų14561.5 Ų61.568%0.67832%0.323SS*.Hα-helixtrans-77.8-32.4175-68.9-177.8176.300113.7V328 I329 L330V328-E332 PolarHBondContact O-N 3.42Å; I329-E332 PolarHBondContact O-N 3.39Å; I329-E332 VanDerWaalsContact O-N 3.16Å; L330-E332 PolarHBondContact O-N 3.3Å
333C88.2Confident86Confident8 Ų861.3 Ų61.35%0.05432%0.315CS..Hα-helixtrans-103.79.6-174.574.80000114.4V55 I329 L330 N335V55-C333 WeakPolarHBondContact O-CB 3.32Å; I329-C333 PolarHBondContact O-N 3.47Å; I329-C333 PolarHBondContact O-SG 2.96Å; L330-C333 PolarHBondContact O-N 2.75Å; C333-N335 PolarHBondContact O-N 3.49Å
334R89.4Confident86.5Confident44 Ų4459.9 Ų59.917%0.16630%0.303CS..  trans-58.2129.4179.4-172.8175.6-175.7-171.50.4111.2L330 P336 N339 E341L330-R334 PolarHBondContact O-N 2.99Å; R334-P336 WeakPolarHBondContact O-CD 3.22Å; R334-N339 HydrophobicContact CG-CB 4.45Å; R334-N339 PolarHBondContact NH1-OD1 3.26Å; R334-N339 PolarHBondContact NH2-OD1 2.96Å; R334-E341 IonicContact NH1-OE2 2.65Å
335N87.7Confident86.7Confident1 Ų161.4 Ų61.41%0.00530%0.301CS..  trans-65.5117.6177.5-168.8-24.6000110.6L33 M107 D108 C333 L337 Y338 N339L33-N335 HydrophobicContact CD2-CB 3.63Å; M107-N335 WeakPolarHBondContact O-CB 3.34Å; M107-N335 PolarHBondContact O-N 2.92Å; D108-N335 PolarHBondContact OD1-ND2 2.92Å; C333-N335 PolarHBondContact O-N 3.49Å; N335-L337 PolarHBondContact O-N 2.86Å; N335-L337 WeakPolarHBondContact OD1-CB 3.44Å; N335-L337 PolarHBondContact OD1-N 2.76Å; N335-Y338 HydrophobicContact CB-CD2 4.02Å; N335-Y338 WeakPolarHBondContact ND2-CD2 3.28Å; N335-Y338 PolarHBondContact O-N 3.29Å; N335-N339 PolarHBondContact O-N 3.17Å
336P85.4Confident86.5Confident24 Ų2456.4 Ų56.416%0.15629%0.286CS..G310 helixtrans-63.6-32.1-178.925.9-34000111.5T36 R334 Y338 N339 S342 E344T36-P336 HydrophobicContact CG2-CG 3.89Å; R334-P336 WeakPolarHBondContact O-CD 3.22Å; P336-Y338 PolarHBondContact O-N 3.06Å; P336-Y338 VanDerWaalsContact O-N 3.1Å; P336-N339 PolarHBondContact O-N 3.34Å; P336-N339 VanDerWaalsContact O-N 3.11Å; P336-S342 WeakPolarHBondContact O-CB 3.41Å; P336-S342 PolarHBondContact O-OG 3.17Å; P336-E344 HydrophobicContact CB-CB 4.11Å; P336-E344 HydrophobicContact CB-CG 4.03Å; P336-E344 HydrophobicContact CG-CG 4.39Å
337L84.7Confident86.4Confident74 Ų7461 Ų6139%0.38731%0.308SS..G310 helixtrans-64.4-18.3179.7-67.3172.3000114.3T36 N335 E344 Y345T36-L337 HydrophobicContact CG2-CD1 4.33Å; T36-L337 HydrophobicContact CG2-CG 4.37Å; N335-L337 PolarHBondContact O-N 2.86Å; N335-L337 WeakPolarHBondContact OD1-CB 3.44Å; N335-L337 PolarHBondContact OD1-N 2.76Å; L337-E344 HydrophobicContact CD2-CB 4.22Å; L337-Y345 WeakPolarHBondContact O-CD2 3.43Å
338Y84.9Confident86.1Confident97 Ų9762.1 Ų62.138%0.3832%0.321SS..G310 helixtrans-1154.2177.8-62.2-66.6000112.7D108 F109 N335 P336D108-Y338 HydrophobicContact CB-CD2 3.68Å; D108-Y338 HydrophobicContact CB-CE2 4.06Å; D108-Y338 HydrophobicContact CB-CG 4.39Å; D108-Y338 WeakPolarHBondContact O-CB 3.07Å; F109-Y338 HydrophobicContact CE1-CD1 4.02Å; F109-Y338 HydrophobicContact CE1-CE1 4.3Å; F109-Y338 HydrophobicContact CE1-CG 4.48Å; F109-Y338 HydrophobicContact CZ-CD1 4.14Å; F109-Y338 HydrophobicContact CZ-CE1 4.01Å; N335-Y338 HydrophobicContact CB-CD2 4.02Å; N335-Y338 WeakPolarHBondContact ND2-CD2 3.28Å; N335-Y338 PolarHBondContact O-N 3.29Å; P336-Y338 PolarHBondContact O-N 3.06Å; P336-Y338 VanDerWaalsContact O-N 3.1Å
339N84.4Confident86Confident28 Ų2862.5 Ų62.515%0.1532%0.316CS..  trans-90.8111.3173.3-179.58.9000110.2R334 N335 P336 E341 S342 Y345R334-N339 HydrophobicContact CG-CB 4.45Å; R334-N339 PolarHBondContact NH1-OD1 3.26Å; R334-N339 PolarHBondContact NH2-OD1 2.96Å; N335-N339 PolarHBondContact O-N 3.17Å; P336-N339 PolarHBondContact O-N 3.34Å; P336-N339 VanDerWaalsContact O-N 3.11Å; N339-E341 PolarHBondContact O-N 3.11Å; N339-E341 PolarHBondContact OD1-N 3.45Å; N339-S342 WeakPolarHBondContact O-CB 3.43Å; N339-S342 PolarHBondContact O-N 3.11Å; N339-S342 PolarHBondContact O-OG 3.44Å; N339-Y345 WeakPolarHBondContact O-CB 3.49Å
340I80.4Confident85.8Confident57 Ų5764.4 Ų64.429%0.29233%0.333SS..THydrogen-bonded Turntrans-57.3-23.5179.9-57.7170.6000112.9L149 Y345L149-I340 HydrophobicContact CD1-CD1 3.93Å; L149-I340 HydrophobicContact CG-CD1 4.4Å; I340-Y345 HydrophobicContact CB-CD1 4.42Å; I340-Y345 HydrophobicContact CB-CE1 4.28Å; I340-Y345 HydrophobicContact CG1-CE1 4.16Å; I340-Y345 HydrophobicContact CG1-CE2 4.34Å; I340-Y345 HydrophobicContact CG2-CD1 4.44Å; I340-Y345 HydrophobicContact CG2-CE1 4.1Å
341E79.7Confident85.6Confident125 Ų12571.2 Ų71.258%0.58436%0.363SS*.THydrogen-bonded Turntrans-88-4.9179.4-64.3166.4141.800113.8R145 R334 N339R145-E341 IonicContact CZ-OE1 2.68Å; R145-E341 IonicContact CZ-OE2 3.38Å; R145-E341 VanDerWaalsContact NH1-CG 3.25Å; R145-E341 IonicContact NH1-OE1 2.74Å; R145-E341 PolarHBondContact NH1-OE1 2.76Å; R145-E341 IonicContact NH1-OE2 3.47Å; R145-E341 PolarHBondContact NH1-OE2 3.21Å; R145-E341 IonicContact NH2-OE1 2.78Å; R145-E341 IonicContact NH2-OE2 2.92Å; R145-E341 PolarHBondContact NH2-OE2 3.24Å; R334-E341 IonicContact NH1-OE2 2.65Å; N339-E341 PolarHBondContact O-N 3.11Å; N339-E341 PolarHBondContact OD1-N 3.45Å
342S83.7Confident85.5Confident13 Ų1368.9 Ų68.99%0.09136%0.357CS..SBendtrans-85.3151.6-179.178.10000111.9P336 N339 E344 Y345 A346P336-S342 WeakPolarHBondContact O-CB 3.41Å; P336-S342 PolarHBondContact O-OG 3.17Å; N339-S342 WeakPolarHBondContact O-CB 3.43Å; N339-S342 PolarHBondContact O-N 3.11Å; N339-S342 PolarHBondContact O-OG 3.44Å; S342-E344 WeakPolarHBondContact CB-OE2 3.33Å; S342-E344 PolarHBondContact O-N 3.37Å; S342-Y345 PolarHBondContact O-N 2.96Å; S342-Y345 VanDerWaalsContact OG-CB 3.23Å; S342-Y345 WeakPolarHBondContact OG-CB 3.43Å; S342-Y345 PolarHBondContact OG-N 3.04Å; S342-A346 PolarHBondContact O-N 2.98Å
343D84.1Confident85.5Confident119 Ų11966.2 Ų66.264%0.63635%0.347SS*.Hα-helixtrans-66.9-32.5173.3-71.7-30.8000110.8A346 Q347D343-A346 PolarHBondContact O-N 3.32Å; D343-Q347 WeakPolarHBondContact O-CB 3.5Å; D343-Q347 VanDerWaalsContact O-CG 3.25Å; D343-Q347 WeakPolarHBondContact O-CG 3.3Å; D343-Q347 PolarHBondContact O-N 2.92Å
344E84.2Confident85.6Confident67 Ų6768.7 Ų68.731%0.31337%0.365SS..Hα-helixtrans-63.7-43.3177.8-64.273.7-162.100111.5P336 L337 S342 Q347 A348P336-E344 HydrophobicContact CB-CB 4.11Å; P336-E344 HydrophobicContact CB-CG 4.03Å; P336-E344 HydrophobicContact CG-CG 4.39Å; L337-E344 HydrophobicContact CD2-CB 4.22Å; S342-E344 WeakPolarHBondContact CB-OE2 3.33Å; S342-E344 PolarHBondContact O-N 3.37Å; E344-Q347 PolarHBondContact O-N 3.32Å; E344-A348 WeakPolarHBondContact O-CB 3.29Å; E344-A348 PolarHBondContact O-N 3.13Å
345Y84.2Confident85.5Confident58 Ų5871.2 Ų71.223%0.22738%0.381CS..Hα-helixtrans-65-43.7174.8179.4-87.6000110.8L337 N339 I340 S342 Q347 A348 K349L337-Y345 WeakPolarHBondContact O-CD2 3.43Å; N339-Y345 WeakPolarHBondContact O-CB 3.49Å; I340-Y345 HydrophobicContact CB-CD1 4.42Å; I340-Y345 HydrophobicContact CB-CE1 4.28Å; I340-Y345 HydrophobicContact CG1-CE1 4.16Å; I340-Y345 HydrophobicContact CG1-CE2 4.34Å; I340-Y345 HydrophobicContact CG2-CD1 4.44Å; I340-Y345 HydrophobicContact CG2-CE1 4.1Å; S342-Y345 PolarHBondContact O-N 2.96Å; S342-Y345 VanDerWaalsContact OG-CB 3.23Å; S342-Y345 WeakPolarHBondContact OG-CB 3.43Å; S342-Y345 PolarHBondContact OG-N 3.04Å; Y345-Q347 VanDerWaalsContact C-N 3.32Å; Y345-Q347 PolarHBondContact O-N 3.32Å; Y345-A348 PolarHBondContact O-N 3.11Å; Y345-K349 HydrophobicContact CE1-CB 4.39Å; Y345-K349 HydrophobicContact CE1-CD 4.14Å; Y345-K349 VanDerWaalsContact O-CB 3.3Å; Y345-K349 WeakPolarHBondContact O-CB 3.41Å; Y345-K349 PolarHBondContact O-N 3.03Å
346A85.3Confident85.4Confident55 Ų5576.8 Ų76.846%0.45541%0.409SS..Hα-helixtrans-60.5-41.8177.800000112S342 D343 S350S342-A346 PolarHBondContact O-N 2.98Å; D343-A346 PolarHBondContact O-N 3.32Å; A346-S350 WeakPolarHBondContact O-CB 3.21Å; A346-S350 PolarHBondContact O-N 3.48Å
347Q87Confident85.4Confident136 Ų13678.7 Ų78.764%0.63643%0.426SS*.Hα-helixtrans-65.5-45.3175-72.2173.635.200112.1D343 E344 Y345 K349 S350 K351D343-Q347 WeakPolarHBondContact O-CB 3.5Å; D343-Q347 VanDerWaalsContact O-CG 3.25Å; D343-Q347 WeakPolarHBondContact O-CG 3.3Å; D343-Q347 PolarHBondContact O-N 2.92Å; E344-Q347 PolarHBondContact O-N 3.32Å; Y345-Q347 VanDerWaalsContact C-N 3.32Å; Y345-Q347 PolarHBondContact O-N 3.32Å; Q347-K349 PolarHBondContact O-N 2.8Å; Q347-S350 PolarHBondContact O-N 2.88Å; Q347-K351 WeakPolarHBondContact O-CB 3.16Å; Q347-K351 PolarHBondContact O-N 3.47Å
348A85.1Confident85.4Confident44 Ų4481.9 Ų81.936%0.36444%0.441SS..Hα-helixtrans-61.8-43.8177.700000111.5E344 Y345 K351 A352E344-A348 WeakPolarHBondContact O-CB 3.29Å; E344-A348 PolarHBondContact O-N 3.13Å; Y345-A348 PolarHBondContact O-N 3.11Å; A348-K351 PolarHBondContact O-N 3.5Å; A348-A352 PolarHBondContact O-N 3.29Å
349K86.3Confident85.2Confident80 Ų8084 Ų8435%0.34846%0.458SS..Hα-helixtrans-63.1-49.7176-175.5178.2176.7-174.60111.6Y148 Y345 Q347 K351 A352 D353Y148-K349 PolarHBondContact OH-NZ 2.86Å; Y345-K349 HydrophobicContact CE1-CB 4.39Å; Y345-K349 HydrophobicContact CE1-CD 4.14Å; Y345-K349 VanDerWaalsContact O-CB 3.3Å; Y345-K349 WeakPolarHBondContact O-CB 3.41Å; Y345-K349 PolarHBondContact O-N 3.03Å; Q347-K349 PolarHBondContact O-N 2.8Å; K349-K351 PolarHBondContact O-N 3.11Å; K349-A352 WeakPolarHBondContact O-CB 3.12Å; K349-A352 PolarHBondContact O-N 3.02Å; K349-D353 VanDerWaalsContact O-CG 3.31Å; K349-D353 PolarHBondContact O-N 3.3Å
350S88.5Confident84.5Confident79 Ų7993.4 Ų93.455%0.55250%0.501SS*.Hα-helixtrans-58.4-37.9177.71780000112.3A346 Q347 S354A346-S350 WeakPolarHBondContact O-CB 3.21Å; A346-S350 PolarHBondContact O-N 3.48Å; Q347-S350 PolarHBondContact O-N 2.88Å; S350-S354 VanDerWaalsContact O-CB 3.31Å; S350-S354 WeakPolarHBondContact O-CB 3.47Å; S350-S354 PolarHBondContact O-N 3.46Å
351K87.8Confident84.7Confident144 Ų14495.2 Ų95.263%0.62651%0.511SS*.Hα-helixtrans-66.4-43.3174.2-174.3179.6179.9-177.80112.1Q347 A348 K349 S354 L355Q347-K351 WeakPolarHBondContact O-CB 3.16Å; Q347-K351 PolarHBondContact O-N 3.47Å; A348-K351 PolarHBondContact O-N 3.5Å; K349-K351 PolarHBondContact O-N 3.11Å; K351-S354 PolarHBondContact O-N 3.14Å; K351-L355 HydrophobicContact CG-CD1 4.45Å; K351-L355 WeakPolarHBondContact O-CG 3.41Å; K351-L355 PolarHBondContact O-N 3.09Å
352A86.9Confident85Confident48 Ų4893.6 Ų93.640%0.39751%0.508SS..Hα-helixtrans-63.3-46.5176.500000111.5A348 K349 S354 L355 M356A348-A352 PolarHBondContact O-N 3.29Å; K349-A352 WeakPolarHBondContact O-CB 3.12Å; K349-A352 PolarHBondContact O-N 3.02Å; A352-S354 VanDerWaalsContact C-N 3.3Å; A352-S354 PolarHBondContact O-N 3.11Å; A352-L355 PolarHBondContact O-N 2.99Å; A352-L355 VanDerWaalsContact O-N 3.13Å; A352-M356 WeakPolarHBondContact O-CG 3.22Å; A352-M356 PolarHBondContact O-N 3.1Å
353D88.2Confident85Confident89 Ų8998.1 Ų98.148%0.47653%0.531SS..Hα-helixtrans-59.9-41.5177.1-67.4-17.6000111.1K349 M356 A357K349-D353 VanDerWaalsContact O-CG 3.31Å; K349-D353 PolarHBondContact O-N 3.3Å; D353-M356 PolarHBondContact O-N 2.82Å; D353-A357 WeakPolarHBondContact O-CB 3.43Å; D353-A357 PolarHBondContact O-N 3.44Å
354S90.3Very high85.1Confident60 Ų6096.9 Ų96.942%0.4253%0.525SS..Hα-helixtrans-62.1-41.7174.6-177.90000112.6S350 K351 A352 M358S350-S354 VanDerWaalsContact O-CB 3.31Å; S350-S354 WeakPolarHBondContact O-CB 3.47Å; S350-S354 PolarHBondContact O-N 3.46Å; K351-S354 PolarHBondContact O-N 3.14Å; A352-S354 VanDerWaalsContact C-N 3.3Å; A352-S354 PolarHBondContact O-N 3.11Å; S354-M358 WeakPolarHBondContact O-CG 3.38Å; S354-M358 PolarHBondContact O-N 3.48Å
355L87.2Confident85.1Confident98 Ų9898.8 Ų98.851%0.51354%0.538SS..Hα-helixtrans-68.4-39.1176.3-70.9170.3000112.3K351 A352 M358 L359K351-L355 HydrophobicContact CG-CD1 4.45Å; K351-L355 WeakPolarHBondContact O-CG 3.41Å; K351-L355 PolarHBondContact O-N 3.09Å; A352-L355 PolarHBondContact O-N 2.99Å; A352-L355 VanDerWaalsContact O-N 3.13Å; L355-M358 PolarHBondContact O-N 2.7Å; L355-L359 PolarHBondContact O-N 3.41Å
356M84.5Confident85.2Confident118 Ų118101.5 Ų101.558%0.58156%0.558SS**Hα-helixtrans-66.1-40.9176.4-70.7-61.8-65.900111.4A352 D353 M358 L359 E360A352-M356 WeakPolarHBondContact O-CG 3.22Å; A352-M356 PolarHBondContact O-N 3.1Å; D353-M356 PolarHBondContact O-N 2.82Å; M356-M358 PolarHBondContact O-N 3.33Å; M356-L359 WeakPolarHBondContact O-CB 3.27Å; M356-L359 PolarHBondContact O-N 3.18Å; M356-L359 HydrophobicContact SD-CD1 4.12Å; M356-E360 PolarHBondContact O-N 3.09Å
357A85.8Confident85.2Confident63 Ų63104.8 Ų104.852%0.52157%0.566SS.*Hα-helixtrans-65.7-17.1174.900000113.8D353D353-A357 WeakPolarHBondContact O-CB 3.43Å; D353-A357 PolarHBondContact O-N 3.44Å
358M85.2Confident85.1Confident141 Ų141102.4 Ų102.470%0.69556%0.561SS**THydrogen-bonded Turntrans-85.3-13.9171.9-68.7-177.9-16200113.4S354 L355 M356S354-M358 WeakPolarHBondContact O-CG 3.38Å; S354-M358 PolarHBondContact O-N 3.48Å; L355-M358 PolarHBondContact O-N 2.7Å; M356-M358 PolarHBondContact O-N 3.33Å
359L79.7Confident85.1Confident142 Ų142107.3 Ų107.374%0.74358%0.577SS**THydrogen-bonded Turntrans-90.1-23.2177.8-69.5170000112.6L355 M356L355-L359 PolarHBondContact O-N 3.41Å; M356-L359 WeakPolarHBondContact O-CB 3.27Å; M356-L359 PolarHBondContact O-N 3.18Å; M356-L359 HydrophobicContact SD-CD1 4.12Å
360E70.3Confident84.9Confident225 Ų225109.7 Ų109.7100%1.05160%0.598SS**  trans-75.90168.2-63.9-175.8170.200111.4M356M356-E360 PolarHBondContact O-N 3.09Å

Retrieved 360 of 360 residues in 149.9 ms (Link to these results)

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