G4VJR3_SCHMA Loading...

Putative peptide (Allatostatin/somatostatin)-like receptor

AlphaFold DB , UniProt , Accession G4VJR3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 342 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
1M38.3Very low59.9Low242 Ų242119.5 Ų119.5100%1.19264%0.637SS**  0103.10-70.3176.3-165.300107.4H3M1-H3 PolarHBondContact O-N 2.91Å
2L39.2Very low62.5Low166 Ų166119.9 Ų119.987%0.86963%0.632SS**  trans-65.4107169.1-86.4104.3000106.9N4L2-N4 PolarHBondContact O-N 2.95Å
3H44Very low65Low167 Ų167118 Ų11877%0.77362%0.622SS**  trans-65.386.9160.4-117.7-55.5000105.9M1 T5M1-H3 PolarHBondContact O-N 2.91Å; H3-T5 PolarHBondContact O-N 3.2Å; H3-T5 PolarHBondContact O-OG1 2.97Å
4N46Very low67.1Low140 Ų140110.2 Ų110.275%0.74958%0.581SS**  trans-66.267.2151.7-95.41.1000106.2L2 T6L2-N4 PolarHBondContact O-N 2.95Å; N4-T6 PolarHBondContact O-N 3.46Å
5T51Low69Low90 Ų90103.7 Ų103.755%0.55255%0.551SS**  trans-63.597.3156.226.20000104.5H3 T7H3-T5 PolarHBondContact O-N 3.2Å; H3-T5 PolarHBondContact O-OG1 2.97Å; T5-T7 PolarHBondContact O-N 3.34Å
6T53.9Low70.7Confident128 Ų12898.2 Ų98.279%0.78553%0.526SS*.  trans-52.487.3154.141.50000106.3N4 I8N4-T6 PolarHBondContact O-N 3.46Å; T6-I8 PolarHBondContact O-N 3.34Å
7T57.6Low72.3Confident78 Ų7893.9 Ų93.948%0.47950%0.502SS..  trans-61.9109.1173.8460000105.6T5 D9 P279T5-T7 PolarHBondContact O-N 3.34Å; T7-D9 PolarHBondContact O-N 3.16Å; T7-P279 HydrophobicContact CG2-CB 3.64Å
8I71.1Confident73.7Confident102 Ų10289.8 Ų89.852%0.52348%0.478SS..  trans-60111.1177.9-61.6172000106.7T6 Y10 N283T6-I8 PolarHBondContact O-N 3.34Å; I8-Y10 HydrophobicContact CB-CE2 4.01Å; I8-Y10 HydrophobicContact CG2-CD1 4.07Å; I8-Y10 HydrophobicContact CG2-CD2 4.31Å; I8-Y10 HydrophobicContact CG2-CE1 3.65Å; I8-Y10 HydrophobicContact CG2-CE2 3.92Å; I8-Y10 HydrophobicContact CG2-CG 4.38Å; I8-Y10 WeakPolarHBondContact O-CD2 3.44Å; I8-Y10 PolarHBondContact O-N 3.17Å; I8-Y10 VanDerWaalsContact O-N 3.13Å; I8-N283 PolarHBondContact O-OD1 3.49Å
9D79.1Confident74.9Confident91 Ų9185.2 Ų85.249%0.48745%0.454SS..  trans-78.696.5178.6-176.84.6000109.5T7 S11T7-D9 PolarHBondContact O-N 3.16Å; D9-S11 PolarHBondContact O-N 3.42Å; D9-S11 WeakPolarHBondContact OD1-CB 3.48Å; D9-S11 PolarHBondContact OD1-N 2.92Å; D9-S11 PolarHBondContact OD1-OG 3.13Å; D9-S11 PolarHBondContact OD2-OG 3.46Å; D9-S11 VanDerWaalsContact OD2-OG 3.12Å
10Y90.1Very high76Confident59 Ų5987.6 Ų87.623%0.23146%0.458CS..THydrogen-bonded Turntrans-74.9-7.6177.2-66.2-72.3000112.9I8 Q12 L13 V14 N283 L287I8-Y10 HydrophobicContact CB-CE2 4.01Å; I8-Y10 HydrophobicContact CG2-CD1 4.07Å; I8-Y10 HydrophobicContact CG2-CD2 4.31Å; I8-Y10 HydrophobicContact CG2-CE1 3.65Å; I8-Y10 HydrophobicContact CG2-CE2 3.92Å; I8-Y10 HydrophobicContact CG2-CG 4.38Å; I8-Y10 WeakPolarHBondContact O-CD2 3.44Å; I8-Y10 PolarHBondContact O-N 3.17Å; I8-Y10 VanDerWaalsContact O-N 3.13Å; Y10-Q12 VanDerWaalsContact C-N 3.27Å; Y10-Q12 PolarHBondContact O-N 2.75Å; Y10-L13 HydrophobicContact CD1-CD2 4.14Å; Y10-L13 WeakPolarHBondContact O-CB 3.39Å; Y10-L13 PolarHBondContact O-N 2.94Å; Y10-L13 VanDerWaalsContact O-N 3.09Å; Y10-V14 WeakPolarHBondContact O-CG2 3.45Å; Y10-V14 PolarHBondContact O-N 3.38Å; Y10-N283 HydrophobicContact CD2-CB 4.16Å; Y10-N283 HydrophobicContact CE2-CB 4.26Å; Y10-L287 HydrophobicContact CD1-CD2 3.79Å; Y10-L287 HydrophobicContact CD1-CG 4.42Å; Y10-L287 HydrophobicContact CD2-CD1 4.28Å; Y10-L287 HydrophobicContact CD2-CD2 4.26Å; Y10-L287 HydrophobicContact CD2-CG 4Å; Y10-L287 HydrophobicContact CE1-CD2 3.94Å; Y10-L287 HydrophobicContact CE2-CD1 4.02Å; Y10-L287 HydrophobicContact CE2-CD2 4.39Å; Y10-L287 HydrophobicContact CE2-CG 4.21Å; Y10-L287 HydrophobicContact CG-CD2 3.96Å; Y10-L287 HydrophobicContact CG-CG 4.1Å
11S88.3Confident77.1Confident52 Ų5287.2 Ų87.236%0.36446%0.456SS..Hα-helixtrans-61.7-36.8-179.776.20000112.1D9 L13 V14 G15D9-S11 PolarHBondContact O-N 3.42Å; D9-S11 WeakPolarHBondContact OD1-CB 3.48Å; D9-S11 PolarHBondContact OD1-N 2.92Å; D9-S11 PolarHBondContact OD1-OG 3.13Å; D9-S11 PolarHBondContact OD2-OG 3.46Å; D9-S11 VanDerWaalsContact OD2-OG 3.12Å; S11-L13 VanDerWaalsContact C-N 3.35Å; S11-V14 PolarHBondContact O-N 3.24Å; S11-G15 PolarHBondContact O-N 2.82Å
12Q91.9Very high79.9Confident124 Ų12475.7 Ų75.758%0.57940%0.399SS*.Hα-helixtrans-64.9-39.2174.8-64.5-168.8-5.600111.8Y10 G15 G16Y10-Q12 VanDerWaalsContact C-N 3.27Å; Y10-Q12 PolarHBondContact O-N 2.75Å; Q12-G15 PolarHBondContact O-N 2.97Å; Q12-G16 PolarHBondContact O-N 2.93Å
13L94.2Very high82.7Confident95 Ų9568.9 Ų68.950%0.49737%0.365SS..Hα-helixtrans-65.9-42.1177-175.463.9000111.3Y10 S11 F17 L290Y10-L13 HydrophobicContact CD1-CD2 4.14Å; Y10-L13 WeakPolarHBondContact O-CB 3.39Å; Y10-L13 PolarHBondContact O-N 2.94Å; Y10-L13 VanDerWaalsContact O-N 3.09Å; S11-L13 VanDerWaalsContact C-N 3.35Å; L13-F17 WeakPolarHBondContact O-CB 3.29Å; L13-F17 PolarHBondContact O-N 3.41Å; L13-L290 HydrophobicContact CD2-CD2 3.52Å; L13-L290 HydrophobicContact CG-CD1 4.26Å; L13-L290 HydrophobicContact CG-CD2 3.97Å
14V95.6Very high85.3Confident9 Ų965.5 Ų65.56%0.05535%0.351CS..Hα-helixtrans-61.5-47.6173.8177.30000110.6Y10 S11 F17 R18 D286 R289 L290Y10-V14 WeakPolarHBondContact O-CG2 3.45Å; Y10-V14 PolarHBondContact O-N 3.38Å; S11-V14 PolarHBondContact O-N 3.24Å; V14-F17 PolarHBondContact O-N 2.98Å; V14-R18 WeakPolarHBondContact O-CB 3.33Å; V14-R18 WeakPolarHBondContact O-CG 3.16Å; V14-R18 PolarHBondContact O-N 2.93Å; V14-D286 HydrophobicContact CG2-CB 4.29Å; V14-D286 WeakPolarHBondContact CG2-O 3.29Å; V14-R289 HydrophobicContact CG1-CB 4.04Å; V14-R289 HydrophobicContact CG2-CB 4.25Å; V14-L290 HydrophobicContact CG2-CB 3.88Å
15G94.5Very high87.8Confident12 Ų1259.9 Ų59.912%0.12432%0.321CS..Hα-helixtrans-59.9-49.1178.700000112.2S11 Q12 R18 A19S11-G15 PolarHBondContact O-N 2.82Å; Q12-G15 PolarHBondContact O-N 2.97Å; G15-R18 PolarHBondContact O-N 3.23Å; G15-A19 VanDerWaalsContact O-CB 3.22Å; G15-A19 WeakPolarHBondContact O-CB 3.15Å; G15-A19 PolarHBondContact O-N 2.93Å
16G96.3Very high90.1Very high16 Ų1655.7 Ų55.717%0.16530%0.296CS..Hα-helixtrans-61.3-45.3177.100000113Q12 R18 A19 Y20Q12-G16 PolarHBondContact O-N 2.93Å; G16-R18 VanDerWaalsContact C-N 3.35Å; G16-R18 PolarHBondContact O-N 2.65Å; G16-A19 PolarHBondContact O-N 2.99Å; G16-Y20 VanDerWaalsContact O-CD2 3.25Å; G16-Y20 WeakPolarHBondContact O-CD2 3.45Å; G16-Y20 PolarHBondContact O-N 3.21Å
17F97.9Very high92.2Very high26 Ų2655 Ų5511%0.11429%0.285CS..Iπ-helixtrans-59.1-47.4176.9-172.1-81.7000111.3L13 V14 A19 L21 C22 I25 L290 V294 I297L13-F17 WeakPolarHBondContact O-CB 3.29Å; L13-F17 PolarHBondContact O-N 3.41Å; V14-F17 PolarHBondContact O-N 2.98Å; F17-A19 PolarHBondContact O-N 3.2Å; F17-L21 HydrophobicContact CD1-CB 4.45Å; F17-L21 HydrophobicContact CD2-CB 4.27Å; F17-L21 HydrophobicContact CD2-CD1 3.42Å; F17-L21 VanDerWaalsContact CD2-CD1 3.42Å; F17-L21 HydrophobicContact CD2-CG 4.39Å; F17-L21 HydrophobicContact CE1-CB 4.33Å; F17-L21 HydrophobicContact CE2-CB 4.12Å; F17-L21 HydrophobicContact CE2-CD1 3.41Å; F17-L21 VanDerWaalsContact CE2-CD1 3.41Å; F17-L21 HydrophobicContact CE2-CG 4.41Å; F17-L21 HydrophobicContact CG-CB 4.4Å; F17-L21 HydrophobicContact CG-CD1 4.23Å; F17-L21 HydrophobicContact CZ-CB 4.15Å; F17-L21 HydrophobicContact CZ-CD1 4.24Å; F17-L21 WeakPolarHBondContact O-CA 3.43Å; F17-L21 WeakPolarHBondContact O-CB 3.26Å; F17-L21 PolarHBondContact O-N 3.47Å; F17-C22 PolarHBondContact O-N 3.21Å; F17-I25 HydrophobicContact CE1-CD1 4.11Å; F17-I25 HydrophobicContact CZ-CD1 3.84Å; F17-L290 HydrophobicContact CB-CD1 3.82Å; F17-L290 HydrophobicContact CD2-CD1 4.19Å; F17-L290 HydrophobicContact CG-CD1 4Å; F17-V294 HydrophobicContact CD2-CG2 4.04Å; F17-V294 HydrophobicContact CE1-CG2 4.28Å; F17-V294 HydrophobicContact CE2-CG2 3.58Å; F17-V294 HydrophobicContact CZ-CB 4.26Å; F17-V294 HydrophobicContact CZ-CG2 3.73Å; F17-I297 HydrophobicContact CZ-CD1 4.32Å
18R97.6Very high94.1Very high19 Ų1954.7 Ų54.77%0.07228%0.28CS..Iπ-helixtrans-67.4-34.3179.6-72.3177.3172.8179.9-18.9113.3V14 G15 G16 C22 D72 S293V14-R18 WeakPolarHBondContact O-CB 3.33Å; V14-R18 WeakPolarHBondContact O-CG 3.16Å; V14-R18 PolarHBondContact O-N 2.93Å; G15-R18 PolarHBondContact O-N 3.23Å; G16-R18 VanDerWaalsContact C-N 3.35Å; G16-R18 PolarHBondContact O-N 2.65Å; R18-C22 WeakPolarHBondContact O-CB 3.39Å; R18-D72 HydrophobicContact CG-CB 4.16Å; R18-D72 IonicContact CZ-OD1 3.32Å; R18-D72 IonicContact NE-OD1 3.24Å; R18-D72 PolarHBondContact NE-OD1 2.83Å; R18-D72 IonicContact NE-OD2 2.82Å; R18-D72 IonicContact NH2-OD1 3.3Å; R18-D72 PolarHBondContact NH2-OD1 3.06Å; R18-S293 PolarHBondContact NE-OG 3.29Å
19A97.1Very high95.4Very high3 Ų349.8 Ų49.83%0.02526%0.255CS..Iπ-helixtrans-70.8-45.8178.400000112.6G15 G16 F17 P23 F73 G77 Y80 L81G15-A19 VanDerWaalsContact O-CB 3.22Å; G15-A19 WeakPolarHBondContact O-CB 3.15Å; G15-A19 PolarHBondContact O-N 2.93Å; G16-A19 PolarHBondContact O-N 2.99Å; F17-A19 PolarHBondContact O-N 3.2Å; A19-P23 WeakPolarHBondContact O-CG 3.38Å; A19-F73 WeakPolarHBondContact O-CE2 3.35Å; A19-G77 WeakPolarHBondContact CB-O 3.35Å; A19-Y80 HydrophobicContact CB-CD1 3.79Å; A19-Y80 HydrophobicContact CB-CG 4.5Å; A19-L81 HydrophobicContact CB-CB 4.07Å
20Y97.4Very high96.3Very high132 Ų13247.3 Ų47.352%0.51824%0.243SC..Iπ-helixtrans-104.8-37-168.2-61.9-69.8000114G16 I24 Y80 L81G16-Y20 VanDerWaalsContact O-CD2 3.25Å; G16-Y20 WeakPolarHBondContact O-CD2 3.45Å; G16-Y20 PolarHBondContact O-N 3.21Å; Y20-I24 VanDerWaalsContact O-CD1 3.29Å; Y20-I24 WeakPolarHBondContact O-CD1 3.48Å; Y20-I24 WeakPolarHBondContact O-CG1 3.48Å; Y20-Y80 HydrophobicContact CE2-CE1 4.44Å; Y20-L81 HydrophobicContact CD1-CD1 4.03Å; Y20-L81 HydrophobicContact CE1-CD1 3.26Å
21L98Very high96.7Very high81 Ų8148.8 Ų48.842%0.42425%0.254SS..Iπ-helixtrans-95.4-42.2-173.1-64.6176.8000113.1F17 I24 I25F17-L21 HydrophobicContact CD1-CB 4.45Å; F17-L21 HydrophobicContact CD2-CB 4.27Å; F17-L21 HydrophobicContact CD2-CD1 3.42Å; F17-L21 VanDerWaalsContact CD2-CD1 3.42Å; F17-L21 HydrophobicContact CD2-CG 4.39Å; F17-L21 HydrophobicContact CE1-CB 4.33Å; F17-L21 HydrophobicContact CE2-CB 4.12Å; F17-L21 HydrophobicContact CE2-CD1 3.41Å; F17-L21 VanDerWaalsContact CE2-CD1 3.41Å; F17-L21 HydrophobicContact CE2-CG 4.41Å; F17-L21 HydrophobicContact CG-CB 4.4Å; F17-L21 HydrophobicContact CG-CD1 4.23Å; F17-L21 HydrophobicContact CZ-CB 4.15Å; F17-L21 HydrophobicContact CZ-CD1 4.24Å; F17-L21 WeakPolarHBondContact O-CA 3.43Å; F17-L21 WeakPolarHBondContact O-CB 3.26Å; F17-L21 PolarHBondContact O-N 3.47Å; L21-I24 PolarHBondContact O-N 2.93Å; L21-I24 VanDerWaalsContact O-N 3.13Å; L21-I25 HydrophobicContact CB-CD1 4.18Å; L21-I25 VanDerWaalsContact O-CG1 3.27Å; L21-I25 WeakPolarHBondContact O-CG1 3.41Å; L21-I25 PolarHBondContact O-N 3.29Å
22C98.2Very high97.2Very high0 Ų046.4 Ų46.40%024%0.237CC..Hα-helixtrans-52.5-45.4178.1-72.60000114.9F17 R18 I24 I25 A26 T68 D72 F73F17-C22 PolarHBondContact O-N 3.21Å; R18-C22 WeakPolarHBondContact O-CB 3.39Å; C22-I24 VanDerWaalsContact C-N 3.32Å; C22-I24 PolarHBondContact O-N 2.92Å; C22-I25 PolarHBondContact O-N 3.42Å; C22-A26 WeakPolarHBondContact O-CB 3.07Å; C22-A26 PolarHBondContact O-N 3.44Å; C22-T68 HydrophobicContact CB-CG2 3.94Å; C22-D72 HydrophobicContact CB-CB 4.48Å; C22-F73 HydrophobicContact CB-CB 4.25Å
23P97.8Very high97.5Very high23 Ų2340.5 Ų40.515%0.14921%0.21CC..Hα-helixtrans-64.7-36.8178.424.4-33.8000112.4A19 A26 M27 F73A19-P23 WeakPolarHBondContact O-CG 3.38Å; P23-A26 PolarHBondContact O-N 3.4Å; P23-M27 WeakPolarHBondContact O-CB 3.36Å; P23-M27 VanDerWaalsContact O-CG 3.28Å; P23-M27 WeakPolarHBondContact O-CG 3.46Å; P23-M27 PolarHBondContact O-N 3.47Å; P23-F73 HydrophobicContact CB-CD1 4.03Å; P23-F73 HydrophobicContact CB-CD2 3.98Å; P23-F73 HydrophobicContact CB-CE1 4.13Å; P23-F73 HydrophobicContact CB-CE2 4.09Å; P23-F73 HydrophobicContact CB-CG 3.94Å; P23-F73 HydrophobicContact CB-CZ 4.16Å; P23-F73 HydrophobicContact CG-CD2 3.69Å; P23-F73 HydrophobicContact CG-CE2 3.78Å; P23-F73 HydrophobicContact CG-CG 4.14Å; P23-F73 HydrophobicContact CG-CZ 4.29Å
24I98.1Very high97.7Very high95 Ų9538 Ų3849%0.48720%0.2SC..Hα-helixtrans-66.3-47176.7-60.2174.7000110.1Y20 L21 C22 A26 M27 I28Y20-I24 VanDerWaalsContact O-CD1 3.29Å; Y20-I24 WeakPolarHBondContact O-CD1 3.48Å; Y20-I24 WeakPolarHBondContact O-CG1 3.48Å; L21-I24 PolarHBondContact O-N 2.93Å; L21-I24 VanDerWaalsContact O-N 3.13Å; C22-I24 VanDerWaalsContact C-N 3.32Å; C22-I24 PolarHBondContact O-N 2.92Å; I24-A26 VanDerWaalsContact C-N 3.34Å; I24-A26 PolarHBondContact O-N 3.29Å; I24-M27 PolarHBondContact O-N 3.4Å; I24-I28 HydrophobicContact CG2-CD1 3.63Å; I24-I28 HydrophobicContact CG2-CG1 4.33Å; I24-I28 WeakPolarHBondContact O-CB 3.31Å; I24-I28 WeakPolarHBondContact O-CG1 3.36Å; I24-I28 PolarHBondContact O-N 2.94Å
25I98.4Very high97.8Very high22 Ų2240.5 Ų40.511%0.11321%0.21CC..Hα-helixtrans-58.3-46.7177-67.4162.6000110.4F17 L21 C22 G29 L64 T68 I297 A300F17-I25 HydrophobicContact CE1-CD1 4.11Å; F17-I25 HydrophobicContact CZ-CD1 3.84Å; L21-I25 HydrophobicContact CB-CD1 4.18Å; L21-I25 VanDerWaalsContact O-CG1 3.27Å; L21-I25 WeakPolarHBondContact O-CG1 3.41Å; L21-I25 PolarHBondContact O-N 3.29Å; C22-I25 PolarHBondContact O-N 3.42Å; I25-G29 WeakPolarHBondContact O-CA 3.33Å; I25-G29 PolarHBondContact O-N 2.91Å; I25-L64 HydrophobicContact CG2-CD2 4.05Å; I25-T68 HydrophobicContact CB-CG2 4.44Å; I25-T68 HydrophobicContact CG2-CG2 4.23Å; I25-I297 HydrophobicContact CD1-CD1 4.27Å; I25-I297 HydrophobicContact CD1-CG1 3.56Å; I25-I297 HydrophobicContact CG1-CG1 4.12Å; I25-A300 HydrophobicContact CG2-CB 3.95Å
26A98.3Very high98Very high3 Ų340 Ų403%0.02521%0.205CC..Hα-helixtrans-62.2-49.3178.800000111.9C22 P23 I24 G29 V30 T68 F69C22-A26 WeakPolarHBondContact O-CB 3.07Å; C22-A26 PolarHBondContact O-N 3.44Å; P23-A26 PolarHBondContact O-N 3.4Å; I24-A26 VanDerWaalsContact C-N 3.34Å; I24-A26 PolarHBondContact O-N 3.29Å; A26-G29 PolarHBondContact O-N 2.95Å; A26-V30 WeakPolarHBondContact O-CB 3.5Å; A26-V30 VanDerWaalsContact O-CG2 3.24Å; A26-V30 WeakPolarHBondContact O-CG2 3.47Å; A26-V30 PolarHBondContact O-N 2.95Å; A26-T68 HydrophobicContact CB-CG2 4.3Å; A26-F69 HydrophobicContact CB-CB 3.87Å; A26-F69 HydrophobicContact CB-CD2 4.32Å
27M97.9Very high98.1Very high112 Ų11240.5 Ų40.555%0.55220%0.203SC*.Hα-helixtrans-61.7-51.4-179.7-74.3-61.3-65.200112.1P23 I24 G29 I31P23-M27 WeakPolarHBondContact O-CB 3.36Å; P23-M27 VanDerWaalsContact O-CG 3.28Å; P23-M27 WeakPolarHBondContact O-CG 3.46Å; P23-M27 PolarHBondContact O-N 3.47Å; I24-M27 PolarHBondContact O-N 3.4Å; M27-G29 VanDerWaalsContact C-N 3.31Å; M27-G29 PolarHBondContact O-N 3.48Å; M27-I31 HydrophobicContact CE-CD1 4.39Å; M27-I31 WeakPolarHBondContact O-CB 3.23Å; M27-I31 WeakPolarHBondContact O-CD1 3.4Å; M27-I31 VanDerWaalsContact O-CG1 3.24Å; M27-I31 WeakPolarHBondContact O-CG1 3.3Å; M27-I31 PolarHBondContact O-N 3.43Å; M27-I31 VanDerWaalsContact O-N 3.11Å
28I98Very high98Very high72 Ų7243.3 Ų43.337%0.36922%0.219SC..Hα-helixtrans-61.7-43.7178.6-68.7176.9000110.4I24 G32 F304I24-I28 HydrophobicContact CG2-CD1 3.63Å; I24-I28 HydrophobicContact CG2-CG1 4.33Å; I24-I28 WeakPolarHBondContact O-CB 3.31Å; I24-I28 WeakPolarHBondContact O-CG1 3.36Å; I24-I28 PolarHBondContact O-N 2.94Å; I28-G32 PolarHBondContact O-N 3.19Å; I28-F304 HydrophobicContact CG2-CE2 3.43Å; I28-F304 VanDerWaalsContact CG2-CE2 3.43Å; I28-F304 HydrophobicContact CG2-CZ 3.54Å
29G98.4Very high98Very high0 Ų043 Ų430%022%0.218CC..Hα-helixtrans-67.3-43.5-177.900000113.2I25 A26 M27 G32 N33 L64I25-G29 WeakPolarHBondContact O-CA 3.33Å; I25-G29 PolarHBondContact O-N 2.91Å; A26-G29 PolarHBondContact O-N 2.95Å; M27-G29 VanDerWaalsContact C-N 3.31Å; M27-G29 PolarHBondContact O-N 3.48Å; G29-G32 PolarHBondContact O-N 2.94Å; G29-N33 WeakPolarHBondContact O-CB 3.46Å; G29-N33 PolarHBondContact O-N 3.43Å; G29-N33 PolarHBondContact O-ND2 2.95Å; G29-L64 VanDerWaalsContact C-CD1 3.46Å
30V98.6Very high98Very high39 Ų3943.1 Ų43.124%0.23622%0.219CC..Hα-helixtrans-65.9-44.8178.8170.70000110.7A26 S34 L64 I65A26-V30 WeakPolarHBondContact O-CB 3.5Å; A26-V30 VanDerWaalsContact O-CG2 3.24Å; A26-V30 WeakPolarHBondContact O-CG2 3.47Å; A26-V30 PolarHBondContact O-N 2.95Å; V30-S34 WeakPolarHBondContact O-CB 3.21Å; V30-S34 PolarHBondContact O-N 3.41Å; V30-S34 PolarHBondContact O-OG 2.92Å; V30-L64 HydrophobicContact CG2-CB 4.01Å; V30-I65 HydrophobicContact CG2-CD1 4.36Å; V30-I65 HydrophobicContact CG2-CG1 3.82Å
31I98.1Very high97.9Very high90 Ų9042 Ų4246%0.46222%0.221SC..Hα-helixtrans-62.1-48175.5-66.4169.4000110.4M27 S34 F35M27-I31 HydrophobicContact CE-CD1 4.39Å; M27-I31 WeakPolarHBondContact O-CB 3.23Å; M27-I31 WeakPolarHBondContact O-CD1 3.4Å; M27-I31 VanDerWaalsContact O-CG1 3.24Å; M27-I31 WeakPolarHBondContact O-CG1 3.3Å; M27-I31 PolarHBondContact O-N 3.43Å; M27-I31 VanDerWaalsContact O-N 3.11Å; I31-S34 WeakPolarHBondContact O-CB 3.15Å; I31-S34 PolarHBondContact O-N 2.71Å; I31-F35 HydrophobicContact CG2-CD2 3.9Å; I31-F35 HydrophobicContact CG2-CE2 3.6Å; I31-F35 VanDerWaalsContact O-CD2 3.28Å; I31-F35 WeakPolarHBondContact O-CD2 3.46Å; I31-F35 PolarHBondContact O-N 3.26Å
32G98.2Very high97.7Very high1 Ų144.6 Ų44.61%0.0123%0.229CC..Hα-helixtrans-60.2-49.2-179.900000112.8I28 G29 S34 F35 I36 F303I28-G32 PolarHBondContact O-N 3.19Å; G29-G32 PolarHBondContact O-N 2.94Å; G32-S34 VanDerWaalsContact C-N 3.29Å; G32-S34 PolarHBondContact O-N 3.31Å; G32-F35 WeakPolarHBondContact O-CB 3.44Å; G32-F35 PolarHBondContact O-N 3.49Å; G32-I36 VanDerWaalsContact O-CG1 3.31Å; G32-I36 WeakPolarHBondContact O-CG1 3.35Å; G32-I36 PolarHBondContact O-N 2.98Å; G32-F303 WeakPolarHBondContact O-CD2 3.34Å
33N98.6Very high97.3Very high1 Ų146.4 Ų46.41%0.00524%0.237CC..Hα-helixtrans-66.3-31.5178-75.5-68.6000112.2G29 I36 I37 A57 M61 Y299G29-N33 WeakPolarHBondContact O-CB 3.46Å; G29-N33 PolarHBondContact O-N 3.43Å; G29-N33 PolarHBondContact O-ND2 2.95Å; N33-I36 WeakPolarHBondContact O-CB 3.44Å; N33-I36 PolarHBondContact O-N 3.33Å; N33-I37 WeakPolarHBondContact O-CG1 3.43Å; N33-I37 PolarHBondContact O-N 3.01Å; N33-A57 HydrophobicContact CB-CB 4.04Å; N33-A57 WeakPolarHBondContact OD1-CA 2.91Å; N33-M61 HydrophobicContact CB-CG 3.47Å; N33-M61 VanDerWaalsContact CB-CG 3.47Å; N33-M61 HydrophobicContact CB-SD 3.96Å; N33-Y299 PolarHBondContact ND2-O 2.89Å
34S98.3Very high96.9Very high43 Ų4354.7 Ų54.730%0.30127%0.271SS..Hα-helixtrans-61.5-45.6171.4-60.70000111.4V30 I31 G32 I36 I37 L38V30-S34 WeakPolarHBondContact O-CB 3.21Å; V30-S34 PolarHBondContact O-N 3.41Å; V30-S34 PolarHBondContact O-OG 2.92Å; I31-S34 WeakPolarHBondContact O-CB 3.15Å; I31-S34 PolarHBondContact O-N 2.71Å; G32-S34 VanDerWaalsContact C-N 3.29Å; G32-S34 PolarHBondContact O-N 3.31Å; S34-I36 VanDerWaalsContact C-N 3.31Å; S34-I36 PolarHBondContact O-N 2.97Å; S34-I37 PolarHBondContact O-N 3.28Å; S34-L38 WeakPolarHBondContact O-CB 3.25Å; S34-L38 VanDerWaalsContact O-CG 3.25Å; S34-L38 WeakPolarHBondContact O-CG 3.08Å; S34-L38 PolarHBondContact O-N 3.43Å
35F98Very high96.5Very high61 Ų6153.6 Ų53.627%0.26827%0.27SS..Hα-helixtrans-62-38.8173-78.1-62.7000112.5I31 G32 I37 L38 I39 F303 F317 L320I31-F35 HydrophobicContact CG2-CD2 3.9Å; I31-F35 HydrophobicContact CG2-CE2 3.6Å; I31-F35 VanDerWaalsContact O-CD2 3.28Å; I31-F35 WeakPolarHBondContact O-CD2 3.46Å; I31-F35 PolarHBondContact O-N 3.26Å; G32-F35 WeakPolarHBondContact O-CB 3.44Å; G32-F35 PolarHBondContact O-N 3.49Å; F35-I37 VanDerWaalsContact C-N 3.35Å; F35-I37 PolarHBondContact O-N 2.92Å; F35-L38 PolarHBondContact O-N 3.22Å; F35-I39 HydrophobicContact CB-CD1 4.33Å; F35-I39 VanDerWaalsContact O-CB 3.32Å; F35-I39 WeakPolarHBondContact O-CB 3.09Å; F35-I39 WeakPolarHBondContact O-CD1 3.43Å; F35-I39 WeakPolarHBondContact O-CG1 3.39Å; F35-I39 PolarHBondContact O-N 3.41Å; F35-F303 HydrophobicContact CB-CD2 3.93Å; F35-F303 HydrophobicContact CB-CE2 3.61Å; F35-F303 HydrophobicContact CD2-CE2 4.1Å; F35-F303 HydrophobicContact CD2-CZ 4.29Å; F35-F303 HydrophobicContact CG-CE2 4.08Å; F35-F317 HydrophobicContact CD1-CD2 4.15Å; F35-F317 HydrophobicContact CD1-CE2 4.07Å; F35-F317 HydrophobicContact CD2-CE2 4.22Å; F35-F317 HydrophobicContact CE1-CD2 4.43Å; F35-F317 HydrophobicContact CE1-CE2 4.06Å; F35-F317 HydrophobicContact CE2-CE2 4.19Å; F35-F317 HydrophobicContact CG-CD2 4.38Å; F35-F317 HydrophobicContact CG-CE2 4.16Å; F35-F317 HydrophobicContact CZ-CE2 4.12Å; F35-L320 HydrophobicContact CD1-CD1 4.45Å
36I98.2Very high96.2Very high1 Ų155.4 Ų55.41%0.00528%0.28CS..Hα-helixtrans-55.7-51.8176.2-68.5169.9000110.6G32 N33 S34 F40 A57 N302 F303 Y306 F313G32-I36 VanDerWaalsContact O-CG1 3.31Å; G32-I36 WeakPolarHBondContact O-CG1 3.35Å; G32-I36 PolarHBondContact O-N 2.98Å; N33-I36 WeakPolarHBondContact O-CB 3.44Å; N33-I36 PolarHBondContact O-N 3.33Å; S34-I36 VanDerWaalsContact C-N 3.31Å; S34-I36 PolarHBondContact O-N 2.97Å; I36-F40 HydrophobicContact CG2-CD2 3.59Å; I36-F40 HydrophobicContact CG2-CE2 3.8Å; I36-F40 WeakPolarHBondContact O-CB 3.13Å; I36-F40 WeakPolarHBondContact O-CD2 3.29Å; I36-F40 PolarHBondContact O-N 3.22Å; I36-A57 HydrophobicContact CB-CB 4.12Å; I36-A57 HydrophobicContact CG2-CB 3.79Å; I36-N302 HydrophobicContact CD1-CB 3.91Å; I36-F303 HydrophobicContact CD1-CB 4.04Å; I36-F303 HydrophobicContact CG1-CB 4.36Å; I36-F303 HydrophobicContact CG1-CD2 4.38Å; I36-Y306 HydrophobicContact CD1-CD2 3.75Å; I36-Y306 HydrophobicContact CD1-CE2 3.75Å; I36-Y306 HydrophobicContact CG1-CD2 3.81Å; I36-Y306 HydrophobicContact CG1-CE2 4.08Å; I36-Y306 HydrophobicContact CG2-CD2 4.26Å; I36-Y306 HydrophobicContact CG2-CE2 3.89Å; I36-F313 HydrophobicContact CG1-CE2 4.2Å; I36-F313 HydrophobicContact CG1-CZ 3.91Å
37I98.2Very high95.9Very high27 Ų2755.3 Ų55.314%0.13828%0.279CS..Hα-helixtrans-60.7-51179.5-65.4167.1000110.3N33 S34 F35 I39 F40 L41 I54 A57 I58 M61N33-I37 WeakPolarHBondContact O-CG1 3.43Å; N33-I37 PolarHBondContact O-N 3.01Å; S34-I37 PolarHBondContact O-N 3.28Å; F35-I37 VanDerWaalsContact C-N 3.35Å; F35-I37 PolarHBondContact O-N 2.92Å; I37-I39 PolarHBondContact O-N 3.36Å; I37-F40 PolarHBondContact O-N 2.86Å; I37-L41 HydrophobicContact CG2-CD1 3.53Å; I37-L41 HydrophobicContact CG2-CG 4.2Å; I37-L41 VanDerWaalsContact O-CB 3.28Å; I37-L41 WeakPolarHBondContact O-CB 3.36Å; I37-L41 VanDerWaalsContact O-CG 3.22Å; I37-L41 WeakPolarHBondContact O-CG 3.36Å; I37-L41 PolarHBondContact O-N 2.9Å; I37-I54 HydrophobicContact CG1-CG2 4.47Å; I37-I54 HydrophobicContact CG2-CG2 4.48Å; I37-A57 HydrophobicContact CD1-CB 4.14Å; I37-A57 HydrophobicContact CG1-CB 3.73Å; I37-I58 HydrophobicContact CD1-CG1 3.74Å; I37-I58 HydrophobicContact CG1-CG1 4.43Å; I37-M61 HydrophobicContact CD1-CE 4.38Å; I37-M61 HydrophobicContact CD1-SD 3.64Å
38L96.9Very high95.7Very high85 Ų8550.3 Ų50.345%0.44525%0.254SS..Hα-helixtrans-62.2-39-177-70.3172.9000113.5S34 F35 K42 L320S34-L38 WeakPolarHBondContact O-CB 3.25Å; S34-L38 VanDerWaalsContact O-CG 3.25Å; S34-L38 WeakPolarHBondContact O-CG 3.08Å; S34-L38 PolarHBondContact O-N 3.43Å; F35-L38 PolarHBondContact O-N 3.22Å; L38-K42 VanDerWaalsContact O-CG 3.32Å; L38-K42 WeakPolarHBondContact O-CG 3.48Å; L38-L320 HydrophobicContact CB-CD1 4.44Å
39I97Very high95.5Very high11 Ų1146.9 Ų46.96%0.05624%0.236CC..Hα-helixtrans-72.8-48.7-179.6-69.3165.5000110.2F35 I37 K42 E43 F313 F317 L320F35-I39 HydrophobicContact CB-CD1 4.33Å; F35-I39 VanDerWaalsContact O-CB 3.32Å; F35-I39 WeakPolarHBondContact O-CB 3.09Å; F35-I39 WeakPolarHBondContact O-CD1 3.43Å; F35-I39 WeakPolarHBondContact O-CG1 3.39Å; F35-I39 PolarHBondContact O-N 3.41Å; I37-I39 PolarHBondContact O-N 3.36Å; I39-K42 PolarHBondContact O-N 3.16Å; I39-E43 PolarHBondContact O-N 3.09Å; I39-F313 HydrophobicContact CB-CD2 4.14Å; I39-F313 HydrophobicContact CB-CE2 3.84Å; I39-F313 HydrophobicContact CD1-CD2 4.16Å; I39-F313 HydrophobicContact CD1-CE1 4.03Å; I39-F313 HydrophobicContact CD1-CE2 3.63Å; I39-F313 HydrophobicContact CD1-CZ 3.56Å; I39-F313 HydrophobicContact CG1-CE2 4.33Å; I39-F313 HydrophobicContact CG2-CD2 3.61Å; I39-F313 HydrophobicContact CG2-CE2 3.86Å; I39-F313 HydrophobicContact CG2-CG 4.38Å; I39-F317 HydrophobicContact CD1-CB 3.75Å; I39-F317 HydrophobicContact CD1-CD2 4.14Å; I39-F317 HydrophobicContact CD1-CG 4.44Å; I39-L320 HydrophobicContact CD1-CD1 4.22Å; I39-L320 HydrophobicContact CG1-CD1 3.41Å; I39-L320 VanDerWaalsContact CG1-CD1 3.41Å
40F96.6Very high95.4Very high7 Ų746.9 Ų46.93%0.03124%0.236CC..Hα-helixtrans-72-30.8-176.4-76.7-46.6000113.5I36 I37 K42 E43 L46 F49 I54 Y306 L310 F313I36-F40 HydrophobicContact CG2-CD2 3.59Å; I36-F40 HydrophobicContact CG2-CE2 3.8Å; I36-F40 WeakPolarHBondContact O-CB 3.13Å; I36-F40 WeakPolarHBondContact O-CD2 3.29Å; I36-F40 PolarHBondContact O-N 3.22Å; I37-F40 PolarHBondContact O-N 2.86Å; F40-K42 PolarHBondContact O-N 2.9Å; F40-E43 VanDerWaalsContact CD1-OE2 3.31Å; F40-E43 WeakPolarHBondContact CD1-OE2 3.35Å; F40-E43 WeakPolarHBondContact O-CB 3.38Å; F40-E43 PolarHBondContact O-N 3.48Å; F40-L46 WeakPolarHBondContact O-CD1 3.32Å; F40-F49 HydrophobicContact CE1-CD1 4.11Å; F40-F49 HydrophobicContact CE1-CE1 4.13Å; F40-F49 HydrophobicContact CE2-CE1 4.09Å; F40-F49 AromaticContact CZ-CD1 3.95Å; F40-F49 HydrophobicContact CZ-CD1 3.95Å; F40-F49 AromaticContact CZ-CE1 3.53Å; F40-F49 HydrophobicContact CZ-CE1 3.53Å; F40-I54 HydrophobicContact CB-CD1 3.83Å; F40-I54 HydrophobicContact CB-CG1 3.74Å; F40-Y306 AromaticContact CE2-CD2 3.88Å; F40-Y306 HydrophobicContact CE2-CD2 3.88Å; F40-Y306 AromaticContact CE2-CE2 3.86Å; F40-Y306 HydrophobicContact CE2-CE2 3.86Å; F40-Y306 HydrophobicContact CZ-CD2 4.34Å; F40-L310 HydrophobicContact CZ-CD1 4.04Å; F40-F313 HydrophobicContact CD2-CE2 4.37Å; F40-F313 AromaticContact CE1-CD2 4Å; F40-F313 HydrophobicContact CE1-CD2 4Å; F40-F313 AromaticContact CE2-CD2 3.88Å; F40-F313 HydrophobicContact CE2-CD2 3.88Å; F40-F313 AromaticContact CE2-CE2 3.91Å; F40-F313 HydrophobicContact CE2-CE2 3.91Å; F40-F313 AromaticContact CZ-CD2 3.56Å; F40-F313 HydrophobicContact CZ-CD2 3.56Å; F40-F313 HydrophobicContact CZ-CE2 4.09Å; F40-F313 HydrophobicContact CZ-CG 4.47Å
41L95.5Very high95.4Very high109 Ų10945.5 Ų45.557%0.57123%0.228SC*.Hα-helixtrans-64.4-29.7171.3-76.8173.7000112.7I37 E43 I54I37-L41 HydrophobicContact CG2-CD1 3.53Å; I37-L41 HydrophobicContact CG2-CG 4.2Å; I37-L41 VanDerWaalsContact O-CB 3.28Å; I37-L41 WeakPolarHBondContact O-CB 3.36Å; I37-L41 VanDerWaalsContact O-CG 3.22Å; I37-L41 WeakPolarHBondContact O-CG 3.36Å; I37-L41 PolarHBondContact O-N 2.9Å; L41-E43 VanDerWaalsContact C-N 3.34Å; L41-I54 HydrophobicContact CD2-CD1 3.8Å; L41-I54 HydrophobicContact CG-CD1 3.92Å
42K94Very high95.4Very high135 Ų13541.9 Ų41.959%0.58721%0.208SC*.THydrogen-bonded Turntrans-85.6-6.9177.8-69.8-179.6-176.3-1730113.2L38 I39 F40 K44 L320L38-K42 VanDerWaalsContact O-CG 3.32Å; L38-K42 WeakPolarHBondContact O-CG 3.48Å; I39-K42 PolarHBondContact O-N 3.16Å; F40-K42 PolarHBondContact O-N 2.9Å; K42-K44 PolarHBondContact O-N 2.94Å; K42-L320 HydrophobicContact CD-CD2 4.14Å; K42-L320 VanDerWaalsContact NZ-CD2 3.28Å
43E90.7Very high95.4Very high37 Ų3741.9 Ų41.917%0.17321%0.208CC..  trans-68.8122.6179.1-168.3174.6-172.400110.4I39 F40 L41 P45 L46 S50 R241I39-E43 PolarHBondContact O-N 3.09Å; F40-E43 VanDerWaalsContact CD1-OE2 3.31Å; F40-E43 WeakPolarHBondContact CD1-OE2 3.35Å; F40-E43 WeakPolarHBondContact O-CB 3.38Å; F40-E43 PolarHBondContact O-N 3.48Å; L41-E43 VanDerWaalsContact C-N 3.34Å; E43-P45 CarbonylContact O-C 3.52Å; E43-L46 PolarHBondContact O-N 3.32Å; E43-S50 PolarHBondContact OE2-OG 2.97Å; E43-R241 IonicContact OE1-CZ 3.44Å; E43-R241 IonicContact OE1-NH2 3.71Å; E43-R241 PolarHBondContact OE1-NH2 2.96Å
44K89.7Confident95.3Very high197 Ų19742.6 Ų42.686%0.85721%0.212SC*.SBendtrans-122119.7176.2-64.9-171.8-178.6-174.20109.4K42K42-K44 PolarHBondContact O-N 2.94Å
45P88.6Confident95.4Very high73 Ų7342.1 Ų42.147%0.47420%0.204SC..SBendcis-75.3145.9-4.130.6-33.1000112.4E43 S47 I136E43-P45 CarbonylContact O-C 3.52Å; P45-S47 PolarHBondContact O-N 3.35Å; P45-I136 HydrophobicContact CB-CG2 4.44Å; P45-I136 HydrophobicContact CG-CD1 3.61Å; P45-I136 HydrophobicContact CG-CG1 4.31Å; P45-I136 HydrophobicContact CG-CG2 4.36Å
46L91.6Very high95.4Very high59 Ų5939.3 Ų39.331%0.30919%0.192SC..  trans-57.8132.3173-170.871000109.6F40 E43 I51 I54 K139F40-L46 WeakPolarHBondContact O-CD1 3.32Å; E43-L46 PolarHBondContact O-N 3.32Å; L46-I51 HydrophobicContact CD2-CD1 4.07Å; L46-I51 HydrophobicContact CD2-CG1 3.71Å; L46-I51 HydrophobicContact CG-CG1 4.05Å; L46-I54 HydrophobicContact CD1-CD1 4.38Å; L46-K139 WeakPolarHBondContact O-CD 3.14Å; L46-K139 WeakPolarHBondContact O-CE 3.41Å; L46-K139 PolarHBondContact O-NZ 3Å
47S92.5Very high95.4Very high1 Ų139.3 Ų39.31%0.00719%0.192CC..  trans-107159.9-178.783.30000111.1P45 F49 S50 I51 S135 R241P45-S47 PolarHBondContact O-N 3.35Å; S47-F49 PolarHBondContact O-N 3.04Å; S47-F49 WeakPolarHBondContact OG-CB 3.45Å; S47-F49 PolarHBondContact OG-N 2.71Å; S47-S50 WeakPolarHBondContact CB-OG 3.4Å; S47-S50 PolarHBondContact N-OG 2.98Å; S47-S50 WeakPolarHBondContact O-CB 3.35Å; S47-S50 PolarHBondContact O-N 3.12Å; S47-S50 PolarHBondContact O-OG 3.11Å; S47-S50 PolarHBondContact OG-N 2.66Å; S47-S50 VanDerWaalsContact OG-N 3.12Å; S47-S50 PolarHBondContact OG-OG 2.95Å; S47-I51 PolarHBondContact O-N 2.96Å; S47-S135 WeakPolarHBondContact CA-O 3.35Å; S47-S135 WeakPolarHBondContact CB-OG 3.48Å; S47-R241 PolarHBondContact OG-NH2 3.5Å
48R94Very high95.4Very high7 Ų740.9 Ų40.93%0.02620%0.2CC..Hα-helixtrans-55.2-39.7170.9-69.5-170.7-69.8146.718.9111.5S50 I51 Y52 D122 T126 F133 S135 Y137 K139 A142R48-S50 VanDerWaalsContact C-N 3.33Å; R48-S50 PolarHBondContact O-N 3.33Å; R48-I51 PolarHBondContact O-N 3.2Å; R48-Y52 HydrophobicContact CB-CE2 4.26Å; R48-Y52 WeakPolarHBondContact O-CD2 3.34Å; R48-Y52 PolarHBondContact O-N 3.36Å; R48-Y52 VanDerWaalsContact O-N 3.09Å; R48-D122 IonicContact CZ-OD1 3.69Å; R48-D122 IonicContact CZ-OD2 3.49Å; R48-D122 IonicContact NE-OD1 3.05Å; R48-D122 IonicContact NH1-OD1 2.7Å; R48-D122 PolarHBondContact NH1-OD1 2.94Å; R48-D122 IonicContact NH1-OD2 2.81Å; R48-D122 IonicContact NH2-OD1 3.98Å; R48-D122 IonicContact NH2-OD2 2.9Å; R48-T126 PolarHBondContact NH2-OG1 3.43Å; R48-T126 VanDerWaalsContact NH2-OG1 3.13Å; R48-F133 VanDerWaalsContact NH2-C 3.29Å; R48-F133 PolarHBondContact NH2-O 3.44Å; R48-S135 PolarHBondContact N-O 3.48Å; R48-Y137 WeakPolarHBondContact CD-O 3.39Å; R48-Y137 WeakPolarHBondContact CG-O 3.24Å; R48-Y137 PolarHBondContact NE-O 2.89Å; R48-Y137 VanDerWaalsContact NE-O 3.11Å; R48-K139 HydrophobicContact CG-CG 4.49Å; R48-A142 HydrophobicContact CB-CB 4.17Å; R48-A142 HydrophobicContact CG-CB 3.87Å
49F94.6Very high95.5Very high0 Ų036.9 Ų36.90%018%0.179CC..Hα-helixtrans-53.1-51.7172-174.7-72.2000111.2F40 S47 I51 Y52 S53 F119 R241 Y306 L310F40-F49 HydrophobicContact CE1-CD1 4.11Å; F40-F49 HydrophobicContact CE1-CE1 4.13Å; F40-F49 HydrophobicContact CE2-CE1 4.09Å; F40-F49 AromaticContact CZ-CD1 3.95Å; F40-F49 HydrophobicContact CZ-CD1 3.95Å; F40-F49 AromaticContact CZ-CE1 3.53Å; F40-F49 HydrophobicContact CZ-CE1 3.53Å; S47-F49 PolarHBondContact O-N 3.04Å; S47-F49 WeakPolarHBondContact OG-CB 3.45Å; S47-F49 PolarHBondContact OG-N 2.71Å; F49-I51 VanDerWaalsContact C-N 3.3Å; F49-I51 PolarHBondContact O-N 3.45Å; F49-Y52 PolarHBondContact O-N 3.49Å; F49-S53 WeakPolarHBondContact CD1-OG 3.42Å; F49-S53 WeakPolarHBondContact CE1-OG 3.34Å; F49-S53 WeakPolarHBondContact O-CB 3.19Å; F49-S53 PolarHBondContact O-N 3.43Å; F49-S53 PolarHBondContact O-OG 3.13Å; F49-S53 VanDerWaalsContact O-OG 3.07Å; F49-F119 HydrophobicContact CB-CZ 4.47Å; F49-F119 HydrophobicContact CD1-CZ 4.27Å; F49-F119 HydrophobicContact CD2-CE2 4.08Å; F49-F119 AromaticContact CD2-CZ 3.76Å; F49-F119 HydrophobicContact CD2-CZ 3.76Å; F49-F119 HydrophobicContact CE1-CZ 4.37Å; F49-F119 HydrophobicContact CE2-CE2 4.44Å; F49-F119 AromaticContact CE2-CZ 3.82Å; F49-F119 HydrophobicContact CE2-CZ 3.82Å; F49-F119 HydrophobicContact CG-CE2 4.33Å; F49-F119 AromaticContact CG-CZ 3.92Å; F49-F119 HydrophobicContact CG-CZ 3.92Å; F49-F119 HydrophobicContact CZ-CZ 4.12Å; F49-R241 HydrophobicContact CB-CG 4.26Å; F49-R241 HydrophobicContact CD2-CB 3.52Å; F49-R241 HydrophobicContact CD2-CG 3.5Å; F49-R241 VanDerWaalsContact CD2-CG 3.5Å; F49-R241 HydrophobicContact CE2-CB 3.95Å; F49-R241 HydrophobicContact CE2-CG 4.07Å; F49-R241 WeakPolarHBondContact CE2-O 3.38Å; F49-R241 HydrophobicContact CG-CB 4.34Å; F49-R241 HydrophobicContact CG-CG 3.84Å; F49-Y306 HydrophobicContact CE1-CD1 4.45Å; F49-Y306 AromaticContact CE1-CE1 3.99Å; F49-Y306 HydrophobicContact CE1-CE1 3.99Å; F49-Y306 HydrophobicContact CZ-CD1 4.08Å; F49-Y306 AromaticContact CZ-CE1 3.54Å; F49-Y306 HydrophobicContact CZ-CE1 3.54Å; F49-L310 HydrophobicContact CE1-CD1 3.67Å; F49-L310 HydrophobicContact CE1-CD2 4.48Å; F49-L310 HydrophobicContact CZ-CD1 3.62Å; F49-L310 HydrophobicContact CZ-CD2 4.29Å
50S95.9Very high95.6Very high0 Ų036.4 Ų36.40%018%0.177CC..Hα-helixtrans-59-42.1-178.3-35.20000111.2E43 S47 R48 S53 I54E43-S50 PolarHBondContact OE2-OG 2.97Å; S47-S50 WeakPolarHBondContact CB-OG 3.4Å; S47-S50 PolarHBondContact N-OG 2.98Å; S47-S50 WeakPolarHBondContact O-CB 3.35Å; S47-S50 PolarHBondContact O-N 3.12Å; S47-S50 PolarHBondContact O-OG 3.11Å; S47-S50 PolarHBondContact OG-N 2.66Å; S47-S50 VanDerWaalsContact OG-N 3.12Å; S47-S50 PolarHBondContact OG-OG 2.95Å; R48-S50 VanDerWaalsContact C-N 3.33Å; R48-S50 PolarHBondContact O-N 3.33Å; S50-S53 PolarHBondContact O-N 2.96Å; S50-I54 WeakPolarHBondContact O-CB 3.25Å; S50-I54 WeakPolarHBondContact O-CD1 3.43Å; S50-I54 WeakPolarHBondContact O-CG1 3.4Å; S50-I54 PolarHBondContact O-N 3.42Å
51I97.4Very high95.7Very high11 Ų1138 Ų386%0.05619%0.185CC..Hα-helixtrans-61.2-56.1177.8-64.5169.6000110.6L46 S47 R48 F49 S53 I54 F55 K139 A142L46-I51 HydrophobicContact CD2-CD1 4.07Å; L46-I51 HydrophobicContact CD2-CG1 3.71Å; L46-I51 HydrophobicContact CG-CG1 4.05Å; S47-I51 PolarHBondContact O-N 2.96Å; R48-I51 PolarHBondContact O-N 3.2Å; F49-I51 VanDerWaalsContact C-N 3.3Å; F49-I51 PolarHBondContact O-N 3.45Å; I51-S53 VanDerWaalsContact C-N 3.28Å; I51-S53 PolarHBondContact O-N 2.88Å; I51-I54 PolarHBondContact O-N 3.48Å; I51-I54 VanDerWaalsContact O-N 3.15Å; I51-F55 HydrophobicContact CG2-CD2 4Å; I51-F55 HydrophobicContact CG2-CE2 4.09Å; I51-F55 WeakPolarHBondContact O-CD2 3.48Å; I51-F55 PolarHBondContact O-N 2.89Å; I51-F55 VanDerWaalsContact O-N 3.08Å; I51-K139 HydrophobicContact CD1-CB 3.85Å; I51-A142 HydrophobicContact CD1-CB 4.47Å
52Y98Very high95.8Very high13 Ų1335.2 Ų35.25%0.05117%0.17CC..Hα-helixtrans-57.8-42.5179.3-67.7-61.4000111.8R48 F49 I54 F55 L56 I118 F119 D122 A142 C146R48-Y52 HydrophobicContact CB-CE2 4.26Å; R48-Y52 WeakPolarHBondContact O-CD2 3.34Å; R48-Y52 PolarHBondContact O-N 3.36Å; R48-Y52 VanDerWaalsContact O-N 3.09Å; F49-Y52 PolarHBondContact O-N 3.49Å; Y52-I54 PolarHBondContact O-N 2.91Å; Y52-F55 PolarHBondContact O-N 3.43Å; Y52-L56 WeakPolarHBondContact O-CB 2.84Å; Y52-L56 PolarHBondContact O-N 3.39Å; Y52-I118 HydrophobicContact CD1-CD1 4.02Å; Y52-I118 HydrophobicContact CD1-CG1 4.18Å; Y52-I118 HydrophobicContact CE1-CD1 3.61Å; Y52-I118 HydrophobicContact CE1-CG1 3.88Å; Y52-F119 AromaticContact CD2-CD2 3.47Å; Y52-F119 HydrophobicContact CD2-CD2 3.47Å; Y52-F119 VanDerWaalsContact CD2-CD2 3.47Å; Y52-F119 AromaticContact CD2-CE2 3.56Å; Y52-F119 HydrophobicContact CD2-CE2 3.56Å; Y52-F119 HydrophobicContact CD2-CG 4.22Å; Y52-F119 HydrophobicContact CD2-CZ 4.44Å; Y52-F119 HydrophobicContact CE2-CD2 4.28Å; Y52-F119 HydrophobicContact CG-CB 4.37Å; Y52-F119 AromaticContact CG-CD2 3.71Å; Y52-F119 HydrophobicContact CG-CD2 3.71Å; Y52-F119 AromaticContact CG-CE2 3.92Å; Y52-F119 HydrophobicContact CG-CE2 3.92Å; Y52-F119 HydrophobicContact CG-CG 4Å; Y52-F119 HydrophobicContact CG-CZ 4.47Å; Y52-D122 HydrophobicContact CE2-CB 3.77Å; Y52-D122 PolarHBondContact OH-OD1 3.07Å; Y52-A142 HydrophobicContact CE1-CB 4.3Å; Y52-A142 HydrophobicContact CE2-CB 3.96Å; Y52-C146 WeakPolarHBondContact CD1-SG 3.34Å
53S97.9Very high95.9Very high1 Ų128.8 Ų28.81%0.00714%0.142CC..Hα-helixtrans-64.5-36.2178.3-64.60000113.4F49 S50 I51 A57 Y306F49-S53 WeakPolarHBondContact CD1-OG 3.42Å; F49-S53 WeakPolarHBondContact CE1-OG 3.34Å; F49-S53 WeakPolarHBondContact O-CB 3.19Å; F49-S53 PolarHBondContact O-N 3.43Å; F49-S53 PolarHBondContact O-OG 3.13Å; F49-S53 VanDerWaalsContact O-OG 3.07Å; S50-S53 PolarHBondContact O-N 2.96Å; I51-S53 VanDerWaalsContact C-N 3.28Å; I51-S53 PolarHBondContact O-N 2.88Å; S53-A57 WeakPolarHBondContact O-CB 3.39Å; S53-A57 PolarHBondContact O-N 3Å; S53-Y306 PolarHBondContact OG-OH 3.43Å
54I98.3Very high96.3Very high16 Ų1627 Ų278%0.08213%0.134CC..Hα-helixtrans-67.5-50.8176.2-70.9160000110.3I37 F40 L41 L46 S50 I51 Y52 L56 A57 I58I37-I54 HydrophobicContact CG1-CG2 4.47Å; I37-I54 HydrophobicContact CG2-CG2 4.48Å; F40-I54 HydrophobicContact CB-CD1 3.83Å; F40-I54 HydrophobicContact CB-CG1 3.74Å; L41-I54 HydrophobicContact CD2-CD1 3.8Å; L41-I54 HydrophobicContact CG-CD1 3.92Å; L46-I54 HydrophobicContact CD1-CD1 4.38Å; S50-I54 WeakPolarHBondContact O-CB 3.25Å; S50-I54 WeakPolarHBondContact O-CD1 3.43Å; S50-I54 WeakPolarHBondContact O-CG1 3.4Å; S50-I54 PolarHBondContact O-N 3.42Å; I51-I54 PolarHBondContact O-N 3.48Å; I51-I54 VanDerWaalsContact O-N 3.15Å; Y52-I54 PolarHBondContact O-N 2.91Å; I54-L56 VanDerWaalsContact C-N 3.31Å; I54-L56 PolarHBondContact O-N 2.7Å; I54-A57 PolarHBondContact O-N 3.25Å; I54-I58 HydrophobicContact CG2-CD1 4.04Å; I54-I58 WeakPolarHBondContact O-CG1 3.37Å; I54-I58 PolarHBondContact O-N 2.91Å
55F98.7Very high96.7Very high34 Ų3420.8 Ų20.815%0.14911%0.109CC..Hα-helixtrans-61.5-41.7179.1-84.3-97.7000111.4I51 Y52 A57 I58 A59 L115 L143 C146 L147 Y150I51-F55 HydrophobicContact CG2-CD2 4Å; I51-F55 HydrophobicContact CG2-CE2 4.09Å; I51-F55 WeakPolarHBondContact O-CD2 3.48Å; I51-F55 PolarHBondContact O-N 2.89Å; I51-F55 VanDerWaalsContact O-N 3.08Å; Y52-F55 PolarHBondContact O-N 3.43Å; F55-A57 VanDerWaalsContact C-N 3.35Å; F55-A57 PolarHBondContact O-N 2.97Å; F55-I58 PolarHBondContact O-N 3.34Å; F55-A59 PolarHBondContact O-N 3.26Å; F55-A59 VanDerWaalsContact O-N 3.1Å; F55-L115 HydrophobicContact CB-CD1 4.15Å; F55-L115 HydrophobicContact CB-CD2 4.32Å; F55-L143 HydrophobicContact CE2-CD1 3.55Å; F55-L143 HydrophobicContact CZ-CD1 3.55Å; F55-C146 HydrophobicContact CB-CB 4.09Å; F55-C146 HydrophobicContact CD1-CB 3.61Å; F55-C146 HydrophobicContact CD2-CB 3.91Å; F55-C146 HydrophobicContact CE1-CB 3.95Å; F55-C146 HydrophobicContact CE2-CB 4.23Å; F55-C146 HydrophobicContact CG-CB 3.59Å; F55-C146 HydrophobicContact CZ-CB 4.25Å; F55-L147 HydrophobicContact CE1-CD2 3.84Å; F55-L147 HydrophobicContact CE1-CG 4.35Å; F55-L147 HydrophobicContact CZ-CD2 4.08Å; F55-L147 HydrophobicContact CZ-CG 4.39Å; F55-Y150 HydrophobicContact CB-CE2 4.28Å; F55-Y150 AromaticContact CD1-CD2 3.89Å; F55-Y150 HydrophobicContact CD1-CD2 3.89Å; F55-Y150 AromaticContact CD1-CE2 3.59Å; F55-Y150 HydrophobicContact CD1-CE2 3.59Å; F55-Y150 HydrophobicContact CE1-CD2 4.48Å; F55-Y150 HydrophobicContact CE1-CE2 4.48Å; F55-Y150 HydrophobicContact CG-CE2 4.43Å; F55-Y150 PolarHBondContact O-OH 2.94Å
56L98.6Very high97Very high2 Ų219.7 Ų19.71%0.0110%0.098CC..Hα-helixtrans-63.1-40.5175.2-177.461.1000111.9Y52 I54 I58 A59 N60 L115 I116 L248Y52-L56 WeakPolarHBondContact O-CB 2.84Å; Y52-L56 PolarHBondContact O-N 3.39Å; I54-L56 VanDerWaalsContact C-N 3.31Å; I54-L56 PolarHBondContact O-N 2.7Å; L56-I58 VanDerWaalsContact C-N 3.35Å; L56-I58 PolarHBondContact O-N 2.87Å; L56-A59 PolarHBondContact O-N 2.84Å; L56-N60 VanDerWaalsContact O-CB 3.28Å; L56-N60 WeakPolarHBondContact O-CB 3.25Å; L56-N60 PolarHBondContact O-N 3.37Å; L56-N60 PolarHBondContact O-OD1 3.25Å; L56-L115 HydrophobicContact CB-CD1 4.36Å; L56-L115 HydrophobicContact CD1-CB 4.12Å; L56-L115 HydrophobicContact CD1-CD1 4.47Å; L56-I116 HydrophobicContact CD1-CD1 4.45Å; L56-I116 HydrophobicContact CD1-CG1 4.02Å; L56-I116 HydrophobicContact CD2-CG1 4.03Å; L56-L248 HydrophobicContact CD2-CD1 4.29Å
57A98.6Very high97.3Very high1 Ų117.4 Ų17.41%0.0089%0.087CC..Hα-helixtrans-65.3-36.7177.400000112.7N33 I36 I37 S53 I54 F55 M61N33-A57 HydrophobicContact CB-CB 4.04Å; N33-A57 WeakPolarHBondContact OD1-CA 2.91Å; I36-A57 HydrophobicContact CB-CB 4.12Å; I36-A57 HydrophobicContact CG2-CB 3.79Å; I37-A57 HydrophobicContact CD1-CB 4.14Å; I37-A57 HydrophobicContact CG1-CB 3.73Å; S53-A57 WeakPolarHBondContact O-CB 3.39Å; S53-A57 PolarHBondContact O-N 3Å; I54-A57 PolarHBondContact O-N 3.25Å; F55-A57 VanDerWaalsContact C-N 3.35Å; F55-A57 PolarHBondContact O-N 2.97Å; A57-M61 WeakPolarHBondContact O-CB 3.49Å; A57-M61 WeakPolarHBondContact O-CG 3.33Å; A57-M61 PolarHBondContact O-N 3.29Å
58I98.5Very high97.5Very high60 Ų6017.4 Ų17.431%0.3089%0.086SC..Hα-helixtrans-64.4-50.5175.1-66.1166000110.3I37 I54 F55 L56 N60 M61 I62I37-I58 HydrophobicContact CD1-CG1 3.74Å; I37-I58 HydrophobicContact CG1-CG1 4.43Å; I54-I58 HydrophobicContact CG2-CD1 4.04Å; I54-I58 WeakPolarHBondContact O-CG1 3.37Å; I54-I58 PolarHBondContact O-N 2.91Å; F55-I58 PolarHBondContact O-N 3.34Å; L56-I58 VanDerWaalsContact C-N 3.35Å; L56-I58 PolarHBondContact O-N 2.87Å; I58-N60 VanDerWaalsContact C-N 3.33Å; I58-N60 PolarHBondContact O-N 3.15Å; I58-M61 PolarHBondContact O-N 2.71Å; I58-I62 HydrophobicContact CG2-CD1 4.09Å; I58-I62 WeakPolarHBondContact O-CG1 3.15Å; I58-I62 PolarHBondContact O-N 3.09Å; I58-I62 VanDerWaalsContact O-N 3.1Å
59A98.5Very high97.7Very high0 Ų020.5 Ų20.50%010%0.1CC..Hα-helixtrans-58.3-46.7177.800000111.2F55 L56 M61 I62 T63 M108 T111 S112 L115 Y150F55-A59 PolarHBondContact O-N 3.26Å; F55-A59 VanDerWaalsContact O-N 3.1Å; L56-A59 PolarHBondContact O-N 2.84Å; A59-M61 PolarHBondContact O-N 3.48Å; A59-I62 PolarHBondContact O-N 3.03Å; A59-T63 PolarHBondContact O-N 2.93Å; A59-T63 PolarHBondContact O-OG1 2.87Å; A59-M108 HydrophobicContact CB-SD 4.31Å; A59-T111 HydrophobicContact CB-CG2 4.18Å; A59-S112 WeakPolarHBondContact CB-OG 3.33Å; A59-L115 HydrophobicContact CB-CD1 4.33Å; A59-Y150 WeakPolarHBondContact CB-OH 3.34Å; A59-Y150 PolarHBondContact N-OH 3.05Å; A59-Y150 VanDerWaalsContact N-OH 3.17Å
60N98.6Very high97.8Very high2 Ų221.8 Ų21.81%0.01111%0.107CC..Hα-helixtrans-61.3-40.7177.4-72.40.2000113L56 I58 T63 L64 S112 Y299 N302L56-N60 VanDerWaalsContact O-CB 3.28Å; L56-N60 WeakPolarHBondContact O-CB 3.25Å; L56-N60 PolarHBondContact O-N 3.37Å; L56-N60 PolarHBondContact O-OD1 3.25Å; I58-N60 VanDerWaalsContact C-N 3.33Å; I58-N60 PolarHBondContact O-N 3.15Å; N60-T63 PolarHBondContact O-N 3.21Å; N60-L64 WeakPolarHBondContact O-CB 3.04Å; N60-L64 WeakPolarHBondContact O-CD1 3.34Å; N60-L64 WeakPolarHBondContact O-CG 3.39Å; N60-L64 PolarHBondContact O-N 2.86Å; N60-S112 PolarHBondContact OD1-OG 3.29Å; N60-Y299 HydrophobicContact CB-CD1 4.47Å; N60-Y299 VanDerWaalsContact OD1-CD1 3.26Å; N60-Y299 WeakPolarHBondContact OD1-CD1 3.27Å; N60-N302 PolarHBondContact ND2-ND2 3.34Å
61M98.2Very high97.7Very high41 Ų4122.2 Ų22.220%0.20211%0.109CC..Hα-helixtrans-60.6-45.9175.2-84.6174.830.500111.9N33 I37 A57 I58 A59 T63 L64 I65N33-M61 HydrophobicContact CB-CG 3.47Å; N33-M61 VanDerWaalsContact CB-CG 3.47Å; N33-M61 HydrophobicContact CB-SD 3.96Å; I37-M61 HydrophobicContact CD1-CE 4.38Å; I37-M61 HydrophobicContact CD1-SD 3.64Å; A57-M61 WeakPolarHBondContact O-CB 3.49Å; A57-M61 WeakPolarHBondContact O-CG 3.33Å; A57-M61 PolarHBondContact O-N 3.29Å; I58-M61 PolarHBondContact O-N 2.71Å; A59-M61 PolarHBondContact O-N 3.48Å; M61-T63 VanDerWaalsContact C-N 3.33Å; M61-T63 PolarHBondContact O-N 3.04Å; M61-L64 PolarHBondContact O-N 3.49Å; M61-I65 VanDerWaalsContact O-CG1 3.28Å; M61-I65 WeakPolarHBondContact O-CG1 3.38Å; M61-I65 PolarHBondContact O-N 2.85Å
62I97.8Very high97.7Very high50 Ų5021.8 Ų21.826%0.25611%0.107SC..Hα-helixtrans-64.1-43.4179.7-61.5166.5000109.6I58 A59 I65 M66 L104 M108I58-I62 HydrophobicContact CG2-CD1 4.09Å; I58-I62 WeakPolarHBondContact O-CG1 3.15Å; I58-I62 PolarHBondContact O-N 3.09Å; I58-I62 VanDerWaalsContact O-N 3.1Å; A59-I62 PolarHBondContact O-N 3.03Å; I62-I65 PolarHBondContact O-N 3.46Å; I62-M66 HydrophobicContact CG2-CG 3.99Å; I62-M66 VanDerWaalsContact O-CB 3.31Å; I62-M66 WeakPolarHBondContact O-CB 3.49Å; I62-M66 WeakPolarHBondContact O-CG 3.13Å; I62-M66 PolarHBondContact O-N 3.22Å; I62-L104 HydrophobicContact CG2-CD1 4.06Å; I62-L104 HydrophobicContact CG2-CD2 4.03Å; I62-L104 HydrophobicContact CG2-CG 3.93Å; I62-M108 HydrophobicContact CB-CG 3.83Å; I62-M108 HydrophobicContact CB-SD 4Å; I62-M108 HydrophobicContact CD1-SD 3.66Å; I62-M108 HydrophobicContact CG1-SD 4.43Å; I62-M108 HydrophobicContact CG2-CG 3.55Å; I62-M108 HydrophobicContact CG2-SD 4.11Å
63T98Very high97.7Very high0 Ų022.5 Ų22.50%011%0.11CC..Hα-helixtrans-58.9-46.9174.2-64.60000112.6A59 N60 M61 I65 N67 T68 M108 Y109 Y299A59-T63 PolarHBondContact O-N 2.93Å; A59-T63 PolarHBondContact O-OG1 2.87Å; N60-T63 PolarHBondContact O-N 3.21Å; M61-T63 VanDerWaalsContact C-N 3.33Å; M61-T63 PolarHBondContact O-N 3.04Å; T63-I65 VanDerWaalsContact C-N 3.31Å; T63-I65 PolarHBondContact O-N 3.29Å; T63-N67 HydrophobicContact CG2-CB 4.5Å; T63-N67 WeakPolarHBondContact O-CA 3.46Å; T63-N67 VanDerWaalsContact O-CB 3.3Å; T63-N67 WeakPolarHBondContact O-CB 3.33Å; T63-N67 PolarHBondContact O-N 3.17Å; T63-T68 PolarHBondContact O-N 2.66Å; T63-M108 WeakPolarHBondContact OG1-CB 3.48Å; T63-Y109 HydrophobicContact CG2-CD1 3.7Å; T63-Y109 HydrophobicContact CG2-CE1 3.29Å; T63-Y299 HydrophobicContact CG2-CD2 3.52Å; T63-Y299 HydrophobicContact CG2-CE2 3.37Å; T63-Y299 HydrophobicContact CG2-CG 4.25Å
64L98.5Very high97.6Very high0 Ų024 Ų240%012%0.118CC..Iπ-helixtrans-63.1-37.5179.7-73.7163.9000112.2I25 G29 V30 N60 M61 T68 F69 A300I25-L64 HydrophobicContact CG2-CD2 4.05Å; G29-L64 VanDerWaalsContact C-CD1 3.46Å; V30-L64 HydrophobicContact CG2-CB 4.01Å; N60-L64 WeakPolarHBondContact O-CB 3.04Å; N60-L64 WeakPolarHBondContact O-CD1 3.34Å; N60-L64 WeakPolarHBondContact O-CG 3.39Å; N60-L64 PolarHBondContact O-N 2.86Å; M61-L64 PolarHBondContact O-N 3.49Å; L64-T68 VanDerWaalsContact O-CB 3.31Å; L64-T68 WeakPolarHBondContact O-CB 3.45Å; L64-T68 PolarHBondContact O-N 3.14Å; L64-F69 WeakPolarHBondContact O-CB 3.48Å; L64-F69 PolarHBondContact O-N 3.43Å; L64-A300 HydrophobicContact CD2-CB 4.43Å
65I97.6Very high97.3Very high65 Ų6523.3 Ų23.333%0.33311%0.114SC..Iπ-helixtrans-73.8-55.1178.2-66.9166.2000110.3V30 M61 I62 T63 I70V30-I65 HydrophobicContact CG2-CD1 4.36Å; V30-I65 HydrophobicContact CG2-CG1 3.82Å; M61-I65 VanDerWaalsContact O-CG1 3.28Å; M61-I65 WeakPolarHBondContact O-CG1 3.38Å; M61-I65 PolarHBondContact O-N 2.85Å; I62-I65 PolarHBondContact O-N 3.46Å; T63-I65 VanDerWaalsContact C-N 3.31Å; T63-I65 PolarHBondContact O-N 3.29Å; I65-I70 HydrophobicContact CG2-CD1 4.02Å; I65-I70 WeakPolarHBondContact O-CB 3.5Å; I65-I70 VanDerWaalsContact O-CG1 3.27Å; I65-I70 WeakPolarHBondContact O-CG1 3.22Å; I65-I70 PolarHBondContact O-N 3.28Å
66M95.8Very high97.1Very high51 Ų5124.5 Ų24.525%0.25112%0.118SC..Iπ-helixtrans-73.9-44.6-170.6-66.5-64.9172.300112.6I62 I70 D71 L104I62-M66 HydrophobicContact CG2-CG 3.99Å; I62-M66 VanDerWaalsContact O-CB 3.31Å; I62-M66 WeakPolarHBondContact O-CB 3.49Å; I62-M66 WeakPolarHBondContact O-CG 3.13Å; I62-M66 PolarHBondContact O-N 3.22Å; M66-I70 HydrophobicContact SD-CD1 4.01Å; M66-D71 PolarHBondContact O-N 3.27Å; M66-L104 HydrophobicContact CE-CD2 3.79Å; M66-L104 HydrophobicContact CG-CD2 3.72Å; M66-L104 HydrophobicContact CG-CG 4.28Å; M66-L104 HydrophobicContact SD-CD2 4.02Å
67N96.5Very high97Very high11 Ų1124.4 Ų24.46%0.05912%0.118CC..Iπ-helixtrans-89.7-61.4-179.8-172.982.3000111.7T63 D71 D72 Y109 D296T63-N67 HydrophobicContact CG2-CB 4.5Å; T63-N67 WeakPolarHBondContact O-CA 3.46Å; T63-N67 VanDerWaalsContact O-CB 3.3Å; T63-N67 WeakPolarHBondContact O-CB 3.33Å; T63-N67 PolarHBondContact O-N 3.17Å; N67-D71 WeakPolarHBondContact O-CB 3.38Å; N67-D71 PolarHBondContact O-N 2.9Å; N67-D72 PolarHBondContact O-N 3.43Å; N67-Y109 WeakPolarHBondContact CB-OH 3.38Å; N67-Y109 PolarHBondContact ND2-OH 3.38Å; N67-Y109 PolarHBondContact OD1-OH 3.24Å; N67-D296 PolarHBondContact ND2-OD2 3.4Å
68T97.8Very high96.8Very high0 Ų026.2 Ų26.20%013%0.127CC..Iπ-helixtrans-69.1-44.2-167.7-41.70000112.3C22 I25 A26 T63 L64 D72 F73 D296C22-T68 HydrophobicContact CB-CG2 3.94Å; I25-T68 HydrophobicContact CB-CG2 4.44Å; I25-T68 HydrophobicContact CG2-CG2 4.23Å; A26-T68 HydrophobicContact CB-CG2 4.3Å; T63-T68 PolarHBondContact O-N 2.66Å; L64-T68 VanDerWaalsContact O-CB 3.31Å; L64-T68 WeakPolarHBondContact O-CB 3.45Å; L64-T68 PolarHBondContact O-N 3.14Å; T68-D72 WeakPolarHBondContact O-CB 3.38Å; T68-F73 PolarHBondContact O-N 3.33Å; T68-F73 VanDerWaalsContact O-N 3.1Å; T68-D296 HydrophobicContact CG2-CB 4.26Å; T68-D296 PolarHBondContact OG1-OD2 3.35Å
69F97.8Very high96.6Very high72 Ų7225.7 Ų25.732%0.31612%0.121SC..Iπ-helixtrans-84.1-55.3-178.4-173.8-111.1000112.8A26 L64 F73 L74A26-F69 HydrophobicContact CB-CB 3.87Å; A26-F69 HydrophobicContact CB-CD2 4.32Å; L64-F69 WeakPolarHBondContact O-CB 3.48Å; L64-F69 PolarHBondContact O-N 3.43Å; F69-F73 AromaticContact CD2-CD1 3.99Å; F69-F73 HydrophobicContact CD2-CD1 3.99Å; F69-F73 AromaticContact CE2-CD1 3.84Å; F69-F73 HydrophobicContact CE2-CD1 3.84Å; F69-F73 HydrophobicContact CE2-CE1 4.15Å; F69-F73 WeakPolarHBondContact O-CB 3.45Å; F69-L74 HydrophobicContact CD1-CD1 4.21Å; F69-L74 HydrophobicContact CE1-CD1 3.8Å; F69-L74 HydrophobicContact CE1-CG 4.37Å; F69-L74 HydrophobicContact CZ-CD1 4.23Å; F69-L74 HydrophobicContact CZ-CG 4.42Å; F69-L74 WeakPolarHBondContact O-CG 3.38Å; F69-L74 PolarHBondContact O-N 3.29Å
70I96.2Very high96.4Very high28 Ų2829.5 Ų29.514%0.14414%0.136CC..Iπ-helixtrans-74.3-52.4-174.5-66.9170.5000111.7I65 M66 L74 G75 L90I65-I70 HydrophobicContact CG2-CD1 4.02Å; I65-I70 WeakPolarHBondContact O-CB 3.5Å; I65-I70 VanDerWaalsContact O-CG1 3.27Å; I65-I70 WeakPolarHBondContact O-CG1 3.22Å; I65-I70 PolarHBondContact O-N 3.28Å; M66-I70 HydrophobicContact SD-CD1 4.01Å; I70-L74 WeakPolarHBondContact O-CB 3.34Å; I70-G75 PolarHBondContact O-N 3.4Å; I70-L90 HydrophobicContact CG2-CB 3.76Å; I70-L90 HydrophobicContact CG2-CD2 3.66Å; I70-L90 HydrophobicContact CG2-CG 4.36Å
71D95.1Very high96.2Very high9 Ų932.7 Ų32.75%0.04815%0.153CC..Iπ-helixtrans-79.7-57.2-175.4-177.439.3000112.4M66 N67 G75 R76M66-D71 PolarHBondContact O-N 3.27Å; N67-D71 WeakPolarHBondContact O-CB 3.38Å; N67-D71 PolarHBondContact O-N 2.9Å; D71-G75 VanDerWaalsContact O-CA 3.27Å; D71-G75 WeakPolarHBondContact O-CA 3.43Å; D71-G75 PolarHBondContact O-N 2.95Å; D71-R76 VanDerWaalsContact CG-CZ 3.41Å; D71-R76 VanDerWaalsContact CG-NH1 3.34Å; D71-R76 PolarHBondContact O-N 3.27Å; D71-R76 IonicContact OD1-CZ 3.73Å; D71-R76 IonicContact OD1-NE 3.81Å; D71-R76 IonicContact OD1-NH1 3.97Å; D71-R76 PolarHBondContact OD1-NH1 3.37Å; D71-R76 IonicContact OD1-NH2 2.66Å; D71-R76 PolarHBondContact OD1-NH2 3.35Å; D71-R76 IonicContact OD2-CZ 3.74Å; D71-R76 IonicContact OD2-NH1 2.7Å; D71-R76 PolarHBondContact OD2-NH1 2.8Å; D71-R76 IonicContact OD2-NH2 3.34Å; D71-R76 PolarHBondContact OD2-NH2 3.1Å
72D96.4Very high96Very high1 Ų132.4 Ų32.41%0.00515%0.153CC..Iπ-helixtrans-70.9-49.8-174.2-87.2-13.5000112.7R18 C22 N67 T68 R76 G77 S293R18-D72 HydrophobicContact CG-CB 4.16Å; R18-D72 IonicContact CZ-OD1 3.32Å; R18-D72 IonicContact NE-OD1 3.24Å; R18-D72 PolarHBondContact NE-OD1 2.83Å; R18-D72 IonicContact NE-OD2 2.82Å; R18-D72 IonicContact NH2-OD1 3.3Å; R18-D72 PolarHBondContact NH2-OD1 3.06Å; C22-D72 HydrophobicContact CB-CB 4.48Å; N67-D72 PolarHBondContact O-N 3.43Å; T68-D72 WeakPolarHBondContact O-CB 3.38Å; D72-R76 WeakPolarHBondContact O-CB 3.05Å; D72-R76 IonicContact OD1-NH1 3.94Å; D72-R76 PolarHBondContact OD1-NH1 3.19Å; D72-G77 PolarHBondContact O-N 3.09Å; D72-S293 VanDerWaalsContact CG-OG 3.27Å; D72-S293 WeakPolarHBondContact OD2-CB 3.41Å; D72-S293 PolarHBondContact OD2-OG 3.04Å
73F97.6Very high95.7Very high29 Ų2936.3 Ų36.313%0.12718%0.175CC..Iπ-helixtrans-78.1-69.1177.7174.8-115.4000112.1A19 C22 P23 T68 F69 G75 R76 G77 L78 L81A19-F73 WeakPolarHBondContact O-CE2 3.35Å; C22-F73 HydrophobicContact CB-CB 4.25Å; P23-F73 HydrophobicContact CB-CD1 4.03Å; P23-F73 HydrophobicContact CB-CD2 3.98Å; P23-F73 HydrophobicContact CB-CE1 4.13Å; P23-F73 HydrophobicContact CB-CE2 4.09Å; P23-F73 HydrophobicContact CB-CG 3.94Å; P23-F73 HydrophobicContact CB-CZ 4.16Å; P23-F73 HydrophobicContact CG-CD2 3.69Å; P23-F73 HydrophobicContact CG-CE2 3.78Å; P23-F73 HydrophobicContact CG-CG 4.14Å; P23-F73 HydrophobicContact CG-CZ 4.29Å; T68-F73 PolarHBondContact O-N 3.33Å; T68-F73 VanDerWaalsContact O-N 3.1Å; F69-F73 AromaticContact CD2-CD1 3.99Å; F69-F73 HydrophobicContact CD2-CD1 3.99Å; F69-F73 AromaticContact CE2-CD1 3.84Å; F69-F73 HydrophobicContact CE2-CD1 3.84Å; F69-F73 HydrophobicContact CE2-CE1 4.15Å; F69-F73 WeakPolarHBondContact O-CB 3.45Å; F73-G75 VanDerWaalsContact C-N 3.35Å; F73-G75 PolarHBondContact O-N 2.72Å; F73-R76 PolarHBondContact O-N 3.21Å; F73-G77 CarbonylContact O-C 3.59Å; F73-G77 VanDerWaalsContact O-CA 3.3Å; F73-G77 WeakPolarHBondContact O-CA 3.22Å; F73-G77 PolarHBondContact O-N 3.48Å; F73-L78 HydrophobicContact CZ-CD1 4.36Å; F73-L78 PolarHBondContact O-N 3.47Å; F73-L81 HydrophobicContact CE2-CD2 4.46Å
74L96.2Very high95.3Very high33 Ų3341.7 Ų41.717%0.17320%0.2CC..Iπ-helixtrans-63.1-38.4-173.1-65.8179.5000113.1F69 I70 L78 F88F69-L74 HydrophobicContact CD1-CD1 4.21Å; F69-L74 HydrophobicContact CE1-CD1 3.8Å; F69-L74 HydrophobicContact CE1-CG 4.37Å; F69-L74 HydrophobicContact CZ-CD1 4.23Å; F69-L74 HydrophobicContact CZ-CG 4.42Å; F69-L74 WeakPolarHBondContact O-CG 3.38Å; F69-L74 PolarHBondContact O-N 3.29Å; I70-L74 WeakPolarHBondContact O-CB 3.34Å; L74-L78 HydrophobicContact CD2-CD2 4.2Å; L74-F88 CarbonylContact C-O 3.6Å; L74-F88 HydrophobicContact CB-CB 4.24Å; L74-F88 HydrophobicContact CB-CD1 4.25Å; L74-F88 HydrophobicContact CD1-CD1 4.11Å; L74-F88 PolarHBondContact O-N 2.93Å
75G93.4Very high94.9Very high0 Ų048.4 Ų48.40%023%0.231CC..Iπ-helixtrans-77.6-26.2-178.900000115.2I70 D71 F73 F88 R173I70-G75 PolarHBondContact O-N 3.4Å; D71-G75 VanDerWaalsContact O-CA 3.27Å; D71-G75 WeakPolarHBondContact O-CA 3.43Å; D71-G75 PolarHBondContact O-N 2.95Å; F73-G75 VanDerWaalsContact C-N 3.35Å; F73-G75 PolarHBondContact O-N 2.72Å; G75-F88 VanDerWaalsContact CA-O 3.25Å; G75-F88 WeakPolarHBondContact CA-O 3.28Å; G75-F88 PolarHBondContact N-O 3.33Å; G75-R173 PolarHBondContact O-NH2 3.1Å; G75-R173 VanDerWaalsContact O-NH2 3.14Å
76R93.6Very high94.6Very high60 Ų6052 Ų5223%0.22624%0.244CC..Iπ-helixtrans-136.4-48.9-170.9-52.6177.6-171.6126.37.8113.4D71 D72 F73 Y80D71-R76 VanDerWaalsContact CG-CZ 3.41Å; D71-R76 VanDerWaalsContact CG-NH1 3.34Å; D71-R76 PolarHBondContact O-N 3.27Å; D71-R76 IonicContact OD1-CZ 3.73Å; D71-R76 IonicContact OD1-NE 3.81Å; D71-R76 IonicContact OD1-NH1 3.97Å; D71-R76 PolarHBondContact OD1-NH1 3.37Å; D71-R76 IonicContact OD1-NH2 2.66Å; D71-R76 PolarHBondContact OD1-NH2 3.35Å; D71-R76 IonicContact OD2-CZ 3.74Å; D71-R76 IonicContact OD2-NH1 2.7Å; D71-R76 PolarHBondContact OD2-NH1 2.8Å; D71-R76 IonicContact OD2-NH2 3.34Å; D71-R76 PolarHBondContact OD2-NH2 3.1Å; D72-R76 WeakPolarHBondContact O-CB 3.05Å; D72-R76 IonicContact OD1-NH1 3.94Å; D72-R76 PolarHBondContact OD1-NH1 3.19Å; F73-R76 PolarHBondContact O-N 3.21Å; R76-Y80 PolarHBondContact O-N 3.29Å
77G95.3Very high94.3Very high0 Ų054.2 Ų54.20%025%0.251CS..Iπ-helixtrans-64.3-43.8179.700000114A19 D72 F73 Y79 Y80 L81A19-G77 WeakPolarHBondContact CB-O 3.35Å; D72-G77 PolarHBondContact O-N 3.09Å; F73-G77 CarbonylContact O-C 3.59Å; F73-G77 VanDerWaalsContact O-CA 3.3Å; F73-G77 WeakPolarHBondContact O-CA 3.22Å; F73-G77 PolarHBondContact O-N 3.48Å; G77-Y79 VanDerWaalsContact C-N 3.28Å; G77-Y79 PolarHBondContact O-N 2.71Å; G77-Y80 WeakPolarHBondContact O-CB 3.43Å; G77-Y80 PolarHBondContact O-N 3.31Å; G77-Y80 VanDerWaalsContact O-N 3.11Å; G77-L81 WeakPolarHBondContact O-CB 3.43Å; G77-L81 PolarHBondContact O-N 3.18Å
78L95.4Very high94.1Very high39 Ų3958.3 Ų58.320%0.20427%0.268CS..Hα-helixtrans-61.9-38.1179.4-175.963.4000111.8F73 L74 Y80 L81 T82 F86F73-L78 HydrophobicContact CZ-CD1 4.36Å; F73-L78 PolarHBondContact O-N 3.47Å; L74-L78 HydrophobicContact CD2-CD2 4.2Å; L78-Y80 VanDerWaalsContact C-N 3.34Å; L78-Y80 PolarHBondContact O-N 3.37Å; L78-L81 PolarHBondContact O-N 3.02Å; L78-T82 HydrophobicContact CD1-CG2 3.99Å; L78-T82 HydrophobicContact CG-CG2 4.45Å; L78-T82 WeakPolarHBondContact O-CB 3.49Å; L78-T82 VanDerWaalsContact O-CG2 3.32Å; L78-T82 WeakPolarHBondContact O-CG2 3.28Å; L78-T82 PolarHBondContact O-N 3.11Å; L78-T82 PolarHBondContact O-OG1 3.39Å; L78-F86 CarbonylContact C-O 3.6Å; L78-F86 HydrophobicContact CD2-CB 4.45Å; L78-F86 HydrophobicContact CG-CB 4.42Å
79Y94.3Very high93.9Very high48 Ų4859.6 Ų59.619%0.18827%0.274CS..Hα-helixtrans-63.9-39.3174.7-176.4-104.3000112.9G77 H84 F86 Y87 R173G77-Y79 VanDerWaalsContact C-N 3.28Å; G77-Y79 PolarHBondContact O-N 2.71Å; Y79-H84 AromaticContact CD1-ND1 3.24Å; Y79-H84 WeakPolarHBondContact CD1-ND1 3.32Å; Y79-H84 HydrophobicContact CD2-CB 4.31Å; Y79-H84 HydrophobicContact CE1-CB 3.92Å; Y79-H84 AromaticContact CE1-CE1 3.59Å; Y79-H84 AromaticContact CE1-CG 3.56Å; Y79-H84 AromaticContact CE1-ND1 2.84Å; Y79-H84 WeakPolarHBondContact CE1-ND1 3.37Å; Y79-H84 HydrophobicContact CE2-CB 3.59Å; Y79-H84 WeakPolarHBondContact CE2-O 3.24Å; Y79-H84 AromaticContact CZ-CG 3.51Å; Y79-H84 AromaticContact CZ-ND1 3.32Å; Y79-H84 VanDerWaalsContact CZ-ND1 3.32Å; Y79-H84 WeakPolarHBondContact O-CA 3.08Å; Y79-H84 PolarHBondContact O-N 2.85Å; Y79-H84 WeakPolarHBondContact OH-CB 3.01Å; Y79-F86 WeakPolarHBondContact CA-O 3.39Å; Y79-F86 PolarHBondContact N-O 3.33Å; Y79-F86 VanDerWaalsContact N-O 3.15Å; Y79-Y87 AromaticContact CD2-CD1 3.78Å; Y79-Y87 HydrophobicContact CD2-CD1 3.78Å; Y79-Y87 HydrophobicContact CD2-CG 4.29Å; Y79-Y87 HydrophobicContact CE2-CD1 4.09Å; Y79-R173 HydrophobicContact CE1-CG 4.27Å; Y79-R173 HydrophobicContact CE2-CG 4.38Å; Y79-R173 WeakPolarHBondContact OH-CD 3.03Å
80Y93.7Very high93.7Very high80 Ų8057 Ų5731%0.31426%0.263SS..Hα-helixtrans-68.7-47.2175-176.4-87.3000110.6A19 Y20 R76 G77 L78 T82 N83A19-Y80 HydrophobicContact CB-CD1 3.79Å; A19-Y80 HydrophobicContact CB-CG 4.5Å; Y20-Y80 HydrophobicContact CE2-CE1 4.44Å; R76-Y80 PolarHBondContact O-N 3.29Å; G77-Y80 WeakPolarHBondContact O-CB 3.43Å; G77-Y80 PolarHBondContact O-N 3.31Å; G77-Y80 VanDerWaalsContact O-N 3.11Å; L78-Y80 VanDerWaalsContact C-N 3.34Å; L78-Y80 PolarHBondContact O-N 3.37Å; Y80-T82 PolarHBondContact O-N 2.93Å; Y80-N83 PolarHBondContact O-N 3.12Å
81L95Very high93.6Very high70 Ų7056 Ų5637%0.36626%0.258SS..Hα-helixtrans-58.4-35.2-179.6-175.263.8000113A19 Y20 F73 G77 L78A19-L81 HydrophobicContact CB-CB 4.07Å; Y20-L81 HydrophobicContact CD1-CD1 4.03Å; Y20-L81 HydrophobicContact CE1-CD1 3.26Å; F73-L81 HydrophobicContact CE2-CD2 4.46Å; G77-L81 WeakPolarHBondContact O-CB 3.43Å; G77-L81 PolarHBondContact O-N 3.18Å; L78-L81 PolarHBondContact O-N 3.02Å
82T94Very high93.5Very high34 Ų3456 Ų5621%0.20926%0.259CS..THydrogen-bonded Turntrans-98.619.9-174.359.90000113.3L78 Y80 H84 Q85 F86L78-T82 HydrophobicContact CD1-CG2 3.99Å; L78-T82 HydrophobicContact CG-CG2 4.45Å; L78-T82 WeakPolarHBondContact O-CB 3.49Å; L78-T82 VanDerWaalsContact O-CG2 3.32Å; L78-T82 WeakPolarHBondContact O-CG2 3.28Å; L78-T82 PolarHBondContact O-N 3.11Å; L78-T82 PolarHBondContact O-OG1 3.39Å; Y80-T82 PolarHBondContact O-N 2.93Å; T82-H84 PolarHBondContact O-N 2.75Å; T82-Q85 WeakPolarHBondContact O-CB 3.28Å; T82-Q85 WeakPolarHBondContact O-CG 3.33Å; T82-Q85 PolarHBondContact O-N 2.66Å; T82-F86 HydrophobicContact CG2-CB 4.17Å; T82-F86 HydrophobicContact CG2-CD2 3.9Å; T82-F86 PolarHBondContact OG1-N 3.31Å; T82-F86 PolarHBondContact OG1-O 3.37Å
83N92.2Very high93.3Very high133 Ų13360.6 Ų60.671%0.71128%0.282SS*.THydrogen-bonded Turntrans48.848.9-177.8-64.5-36.9000112.1Y80 Q85Y80-N83 PolarHBondContact O-N 3.12Å; N83-Q85 VanDerWaalsContact C-N 3.32Å; N83-Q85 PolarHBondContact O-N 3.01Å
84H88Confident93.2Very high113 Ų11361 Ų6152%0.52329%0.289SS..THydrogen-bonded Turntrans71.815.2175-51-36.1000116.3Y79 T82Y79-H84 AromaticContact CD1-ND1 3.24Å; Y79-H84 WeakPolarHBondContact CD1-ND1 3.32Å; Y79-H84 HydrophobicContact CD2-CB 4.31Å; Y79-H84 HydrophobicContact CE1-CB 3.92Å; Y79-H84 AromaticContact CE1-CE1 3.59Å; Y79-H84 AromaticContact CE1-CG 3.56Å; Y79-H84 AromaticContact CE1-ND1 2.84Å; Y79-H84 WeakPolarHBondContact CE1-ND1 3.37Å; Y79-H84 HydrophobicContact CE2-CB 3.59Å; Y79-H84 WeakPolarHBondContact CE2-O 3.24Å; Y79-H84 AromaticContact CZ-CG 3.51Å; Y79-H84 AromaticContact CZ-ND1 3.32Å; Y79-H84 VanDerWaalsContact CZ-ND1 3.32Å; Y79-H84 WeakPolarHBondContact O-CA 3.08Å; Y79-H84 PolarHBondContact O-N 2.85Å; Y79-H84 WeakPolarHBondContact OH-CB 3.01Å; T82-H84 PolarHBondContact O-N 2.75Å
85Q90Very high93.1Very high141 Ų14165 Ų6566%0.65930%0.304SS*.SBendtrans-87.6-45.2-177.9-61.3-61.2-45.500113.6T82 N83T82-Q85 WeakPolarHBondContact O-CB 3.28Å; T82-Q85 WeakPolarHBondContact O-CG 3.33Å; T82-Q85 PolarHBondContact O-N 2.66Å; N83-Q85 VanDerWaalsContact C-N 3.32Å; N83-Q85 PolarHBondContact O-N 3.01Å
86F91.2Very high93.2Very high139 Ų13971.4 Ų71.461%0.6133%0.333SS*.  trans-122.2135.3-172.5-62.1-77000112.1L78 Y79 T82L78-F86 CarbonylContact C-O 3.6Å; L78-F86 HydrophobicContact CD2-CB 4.45Å; L78-F86 HydrophobicContact CG-CB 4.42Å; Y79-F86 WeakPolarHBondContact CA-O 3.39Å; Y79-F86 PolarHBondContact N-O 3.33Å; Y79-F86 VanDerWaalsContact N-O 3.15Å; T82-F86 HydrophobicContact CG2-CB 4.17Å; T82-F86 HydrophobicContact CG2-CD2 3.9Å; T82-F86 PolarHBondContact OG1-N 3.31Å; T82-F86 PolarHBondContact OG1-O 3.37Å
87Y90Very high93.3Very high99 Ų9973.4 Ų73.439%0.38834%0.34SS..  trans-150.3149.2172.862.3-94.3000110.2Y79 K89 R173 T174Y79-Y87 AromaticContact CD2-CD1 3.78Å; Y79-Y87 HydrophobicContact CD2-CD1 3.78Å; Y79-Y87 HydrophobicContact CD2-CG 4.29Å; Y79-Y87 HydrophobicContact CE2-CD1 4.09Å; Y87-K89 HydrophobicContact CD2-CB 4.32Å; Y87-R173 PolarHBondContact OH-O 3.15Å; Y87-T174 HydrophobicContact CD2-CG2 4.07Å; Y87-T174 HydrophobicContact CE2-CG2 3.29Å
88F93Very high93.3Very high96 Ų9673.4 Ų73.442%0.42134%0.34SS..  trans-13293.1170.6179.3-98.5000109L74 G75 L90 I93L74-F88 CarbonylContact C-O 3.6Å; L74-F88 HydrophobicContact CB-CB 4.24Å; L74-F88 HydrophobicContact CB-CD1 4.25Å; L74-F88 HydrophobicContact CD1-CD1 4.11Å; L74-F88 PolarHBondContact O-N 2.93Å; G75-F88 VanDerWaalsContact CA-O 3.25Å; G75-F88 WeakPolarHBondContact CA-O 3.28Å; G75-F88 PolarHBondContact N-O 3.33Å; F88-L90 HydrophobicContact CE1-CB 4.14Å; F88-L90 HydrophobicContact CE1-CD1 4.29Å; F88-L90 HydrophobicContact CZ-CD1 4.1Å; F88-I93 HydrophobicContact CE2-CD1 3.82Å; F88-I93 HydrophobicContact CZ-CD1 3.97Å
89K93Very high93.3Very high28 Ų2874.1 Ų74.112%0.12234%0.342CS..  trans-104.885.6-171.5-172.2171.8-176.9-144.80110.9Y87 D91 T92Y87-K89 HydrophobicContact CD2-CB 4.32Å; K89-D91 VanDerWaalsContact C-N 3.34Å; K89-D91 WeakPolarHBondContact CE-OD1 3.47Å; K89-D91 WeakPolarHBondContact CE-OD2 3.47Å; K89-D91 WeakPolarHBondContact CG-OD1 3.21Å; K89-D91 IonicContact NZ-OD2 2.71Å; K89-D91 PolarHBondContact NZ-OD2 3.48Å; K89-D91 PolarHBondContact O-N 3.38Å; K89-T92 HydrophobicContact CD-CG2 3.62Å; K89-T92 HydrophobicContact CG-CG2 3.84Å; K89-T92 PolarHBondContact O-N 3.29Å; K89-T92 PolarHBondContact O-OG1 3.38Å
90L93.9Very high93.4Very high18 Ų1873.3 Ų73.39%0.09434%0.343CS..G310 helixtrans-57.3-40.4-169.9-17560.7000113.6I70 F88 T92 I93 W97 V101I70-L90 HydrophobicContact CG2-CB 3.76Å; I70-L90 HydrophobicContact CG2-CD2 3.66Å; I70-L90 HydrophobicContact CG2-CG 4.36Å; F88-L90 HydrophobicContact CE1-CB 4.14Å; F88-L90 HydrophobicContact CE1-CD1 4.29Å; F88-L90 HydrophobicContact CZ-CD1 4.1Å; L90-T92 PolarHBondContact O-N 3.1Å; L90-T92 VanDerWaalsContact O-N 3.08Å; L90-I93 HydrophobicContact CD1-CD1 3.87Å; L90-I93 PolarHBondContact O-N 3.43Å; L90-W97 HydrophobicContact CD1-CB 4.31Å; L90-W97 HydrophobicContact CD1-CD2 3.69Å; L90-W97 HydrophobicContact CD1-CE3 3.97Å; L90-W97 HydrophobicContact CD1-CG 3.84Å; L90-W97 HydrophobicContact CD2-CD2 4.42Å; L90-W97 HydrophobicContact CD2-CE3 3.84Å; L90-W97 HydrophobicContact CD2-CZ3 4.11Å; L90-W97 HydrophobicContact CG-CB 4.26Å; L90-W97 HydrophobicContact CG-CD2 4.08Å; L90-W97 HydrophobicContact CG-CE3 3.96Å; L90-W97 HydrophobicContact CG-CG 4.23Å; L90-W97 WeakPolarHBondContact O-CB 3.46Å; L90-V101 HydrophobicContact CB-CG2 4.47Å; L90-V101 HydrophobicContact CD2-CG2 3.81Å; L90-V101 HydrophobicContact CG-CG2 4.03Å
91D93.2Very high93.4Very high5 Ų569.8 Ų69.83%0.02733%0.33CS..G310 helixtrans-62.2-14.1178.166-51.9000113.6K89 C98 C178K89-D91 VanDerWaalsContact C-N 3.34Å; K89-D91 WeakPolarHBondContact CE-OD1 3.47Å; K89-D91 WeakPolarHBondContact CE-OD2 3.47Å; K89-D91 WeakPolarHBondContact CG-OD1 3.21Å; K89-D91 IonicContact NZ-OD2 2.71Å; K89-D91 PolarHBondContact NZ-OD2 3.48Å; K89-D91 PolarHBondContact O-N 3.38Å; D91-C98 WeakPolarHBondContact O-CA 3.4Å; D91-C98 WeakPolarHBondContact O-CB 3.37Å; D91-C178 HydrophobicContact CB-CB 3.98Å; D91-C178 WeakPolarHBondContact OD2-CB 3.48Å
92T93.7Very high93.4Very high11 Ų1168.4 Ų68.47%0.06732%0.322CS..G310 helixtrans-103-7179.860.40000114.9K89 L90 F176K89-T92 HydrophobicContact CD-CG2 3.62Å; K89-T92 HydrophobicContact CG-CG2 3.84Å; K89-T92 PolarHBondContact O-N 3.29Å; K89-T92 PolarHBondContact O-OG1 3.38Å; L90-T92 PolarHBondContact O-N 3.1Å; L90-T92 VanDerWaalsContact O-N 3.08Å; T92-F176 VanDerWaalsContact CG2-O 3.25Å; T92-F176 WeakPolarHBondContact CG2-O 3.39Å
93I93.2Very high93.5Very high96 Ų9668.8 Ų68.849%0.49232%0.32SS..THydrogen-bonded Turntrans-70.3-41.9-176.6-62.2-175.8000111.3F88 L90F88-I93 HydrophobicContact CE2-CD1 3.82Å; F88-I93 HydrophobicContact CZ-CD1 3.97Å; L90-I93 HydrophobicContact CD1-CD1 3.87Å; L90-I93 PolarHBondContact O-N 3.43Å
94S94.4Very high93.7Very high38 Ų3865 Ų6527%0.26630%0.299SS..  trans-155.3163.6179.878.60000111.7F96 W97 C98S94-F96 PolarHBondContact O-N 2.9Å; S94-F96 PolarHBondContact OG-N 3.44Å; S94-W97 PolarHBondContact O-N 2.87Å; S94-W97 VanDerWaalsContact OG-CD1 3.23Å; S94-W97 PolarHBondContact OG-N 3.42Å; S94-C98 PolarHBondContact O-N 3.47Å
95K94.1Very high94Very high116 Ų11659.8 Ų59.850%0.50428%0.276SS..Hα-helixtrans-59.8-32.8174.1-165.4177.6-173.3174.10112.3K99 T165K95-K99 WeakPolarHBondContact O-CG 3.4Å; K95-K99 PolarHBondContact O-N 3.43Å; K95-T165 WeakPolarHBondContact CE-OG1 3.45Å
96F96Very high94.3Very high135 Ų13553.3 Ų53.359%0.59225%0.245SC*.Hα-helixtrans-64.1-50.2175.2173.6-97.3000111S94 K99 S100S94-F96 PolarHBondContact O-N 2.9Å; S94-F96 PolarHBondContact OG-N 3.44Å; F96-K99 PolarHBondContact O-N 3.21Å; F96-S100 WeakPolarHBondContact O-CB 3.36Å; F96-S100 PolarHBondContact O-N 3.45Å; F96-S100 PolarHBondContact O-OG 2.91Å
97W95.3Very high94.6Very high103 Ų10346.8 Ų46.839%0.3922%0.217SC..Hα-helixtrans-67.3-39.3-179-71.3119.7000113.1L90 S94 K99 S100 V101L90-W97 HydrophobicContact CD1-CB 4.31Å; L90-W97 HydrophobicContact CD1-CD2 3.69Å; L90-W97 HydrophobicContact CD1-CE3 3.97Å; L90-W97 HydrophobicContact CD1-CG 3.84Å; L90-W97 HydrophobicContact CD2-CD2 4.42Å; L90-W97 HydrophobicContact CD2-CE3 3.84Å; L90-W97 HydrophobicContact CD2-CZ3 4.11Å; L90-W97 HydrophobicContact CG-CB 4.26Å; L90-W97 HydrophobicContact CG-CD2 4.08Å; L90-W97 HydrophobicContact CG-CE3 3.96Å; L90-W97 HydrophobicContact CG-CG 4.23Å; L90-W97 WeakPolarHBondContact O-CB 3.46Å; S94-W97 PolarHBondContact O-N 2.87Å; S94-W97 VanDerWaalsContact OG-CD1 3.23Å; S94-W97 PolarHBondContact OG-N 3.42Å; W97-K99 VanDerWaalsContact C-N 3.34Å; W97-K99 PolarHBondContact O-N 2.93Å; W97-S100 PolarHBondContact O-N 3.46Å; W97-V101 WeakPolarHBondContact O-CB 3.4Å; W97-V101 VanDerWaalsContact O-CG2 3.3Å; W97-V101 WeakPolarHBondContact O-CG2 3.22Å; W97-V101 PolarHBondContact O-N 3.31Å
98C95.5Very high95Very high0 Ų042.4 Ų42.40%020%0.2CC..Hα-helixtrans-51.2-52.9171.5169.70000111.5D91 S94 E102 C178D91-C98 WeakPolarHBondContact O-CA 3.4Å; D91-C98 WeakPolarHBondContact O-CB 3.37Å; S94-C98 PolarHBondContact O-N 3.47Å; C98-E102 WeakPolarHBondContact O-CG 3.24Å; C98-E102 PolarHBondContact O-N 3.43Å; C98-C178 VanDerWaalsContact C-SG 3.59Å; C98-C178 WeakPolarHBondContact CA-SG 3.34Å; C98-C178 HydrophobicContact CB-CB 3.84Å; C98-C178 WeakPolarHBondContact CB-SG 3.46Å; C98-C178 PolarHBondContact O-SG 3.42Å; C98-C178 VanDerWaalsContact SG-CA 3.58Å; C98-C178 WeakPolarHBondContact SG-CB 3.48Å; C98-C178 CovalentContact SG-SG 2.04Å; C98-C178 PolarHBondContact SG-SG 3.17Å
99K96Very high95.3Very high53 Ų5338.2 Ų38.223%0.2318%0.182CC..Hα-helixtrans-65.8-47-180-71.1179.5173.4-156.10112.1K95 F96 W97 Y103 L161 Q164K95-K99 WeakPolarHBondContact O-CG 3.4Å; K95-K99 PolarHBondContact O-N 3.43Å; F96-K99 PolarHBondContact O-N 3.21Å; W97-K99 VanDerWaalsContact C-N 3.34Å; W97-K99 PolarHBondContact O-N 2.93Å; K99-Y103 WeakPolarHBondContact O-CB 3.31Å; K99-Y103 PolarHBondContact O-N 3.07Å; K99-L161 HydrophobicContact CB-CD2 4.2Å; K99-L161 VanDerWaalsContact CD-O 3.29Å; K99-L161 WeakPolarHBondContact CD-O 3.26Å; K99-L161 WeakPolarHBondContact CE-O 3.28Å; K99-L161 PolarHBondContact NZ-O 2.81Å; K99-Q164 WeakPolarHBondContact CE-O 3.32Å; K99-Q164 HydrophobicContact CG-CB 4.32Å; K99-Q164 WeakPolarHBondContact CG-O 3.21Å
100S95.1Very high95.5Very high32 Ų3237.3 Ų37.322%0.22418%0.177CC..Hα-helixtrans-66.5-42.4-174-66.10000112.9F96 W97 L104F96-S100 WeakPolarHBondContact O-CB 3.36Å; F96-S100 PolarHBondContact O-N 3.45Å; F96-S100 PolarHBondContact O-OG 2.91Å; W97-S100 PolarHBondContact O-N 3.46Å; S100-L104 WeakPolarHBondContact O-CB 3.43Å; S100-L104 PolarHBondContact O-N 2.96Å
101V94.8Very high95.7Very high6 Ų636.4 Ų36.44%0.03617%0.173CC..Hα-helixtrans-65.6-48.1179.7171.70000110.8L90 W97 S105L90-V101 HydrophobicContact CB-CG2 4.47Å; L90-V101 HydrophobicContact CD2-CG2 3.81Å; L90-V101 HydrophobicContact CG-CG2 4.03Å; W97-V101 WeakPolarHBondContact O-CB 3.4Å; W97-V101 VanDerWaalsContact O-CG2 3.3Å; W97-V101 WeakPolarHBondContact O-CG2 3.22Å; W97-V101 PolarHBondContact O-N 3.31Å; V101-S105 VanDerWaalsContact O-CB 3.24Å; V101-S105 WeakPolarHBondContact O-CB 3.32Å; V101-S105 PolarHBondContact O-N 3.41Å; V101-S105 PolarHBondContact O-OG 2.92Å
102E94.2Very high96Very high41 Ų4136.2 Ų36.219%0.19217%0.172CC..Hα-helixtrans-64.1-46.7178.9-71.3-63.5141.500111.7C98 N106 Q164C98-E102 WeakPolarHBondContact O-CG 3.24Å; C98-E102 PolarHBondContact O-N 3.43Å; E102-N106 WeakPolarHBondContact O-CB 3.07Å; E102-N106 PolarHBondContact O-N 3.2Å; E102-N106 VanDerWaalsContact O-N 3.13Å; E102-N106 PolarHBondContact O-ND2 3.11Å; E102-Q164 HydrophobicContact CB-CG 4.03Å; E102-Q164 HydrophobicContact CG-CG 4.3Å
103Y96.2Very high96.2Very high42 Ų4235.7 Ų35.717%0.16517%0.168CC..Hα-helixtrans-62.9-49.4179.1170-105.7000112.1K99 N106 T107 I154 N157 L161K99-Y103 WeakPolarHBondContact O-CB 3.31Å; K99-Y103 PolarHBondContact O-N 3.07Å; Y103-N106 PolarHBondContact O-N 3.21Å; Y103-T107 VanDerWaalsContact O-CB 3.26Å; Y103-T107 WeakPolarHBondContact O-CB 3.13Å; Y103-T107 PolarHBondContact O-N 3.3Å; Y103-T107 PolarHBondContact O-OG1 2.97Å; Y103-I154 WeakPolarHBondContact OH-CG2 3.15Å; Y103-I154 PolarHBondContact OH-O 2.95Å; Y103-I154 VanDerWaalsContact OH-O 3.05Å; Y103-N157 HydrophobicContact CD2-CB 4.19Å; Y103-N157 WeakPolarHBondContact CD2-O 3.28Å; Y103-N157 HydrophobicContact CE2-CB 4.08Å; Y103-L161 HydrophobicContact CD1-CD1 4.5Å; Y103-L161 HydrophobicContact CD1-CD2 4Å; Y103-L161 HydrophobicContact CD1-CG 4.45Å; Y103-L161 HydrophobicContact CD2-CD1 4.12Å; Y103-L161 HydrophobicContact CD2-CD2 4.06Å; Y103-L161 HydrophobicContact CD2-CG 3.78Å; Y103-L161 HydrophobicContact CE1-CD1 4.48Å; Y103-L161 HydrophobicContact CE2-CD1 4.11Å; Y103-L161 HydrophobicContact CE2-CG 4.27Å; Y103-L161 HydrophobicContact CG-CD1 4.31Å; Y103-L161 HydrophobicContact CG-CD2 3.6Å; Y103-L161 HydrophobicContact CG-CG 3.88Å
104L96.6Very high96.5Very high52 Ų5233 Ų3327%0.27215%0.153SC..Hα-helixtrans-67.4-42.5-176-175.857.3000111.4I62 M66 S100 T107 M108I62-L104 HydrophobicContact CG2-CD1 4.06Å; I62-L104 HydrophobicContact CG2-CD2 4.03Å; I62-L104 HydrophobicContact CG2-CG 3.93Å; M66-L104 HydrophobicContact CE-CD2 3.79Å; M66-L104 HydrophobicContact CG-CD2 3.72Å; M66-L104 HydrophobicContact CG-CG 4.28Å; M66-L104 HydrophobicContact SD-CD2 4.02Å; S100-L104 WeakPolarHBondContact O-CB 3.43Å; S100-L104 PolarHBondContact O-N 2.96Å; L104-T107 PolarHBondContact O-N 2.77Å; L104-M108 HydrophobicContact CD1-CE 4.42Å; L104-M108 HydrophobicContact CD1-CG 4.19Å; L104-M108 VanDerWaalsContact O-CG 3.28Å; L104-M108 WeakPolarHBondContact O-CG 3.34Å; L104-M108 PolarHBondContact O-N 2.83Å
105S95.7Very high96.7Very high5 Ų531.3 Ų31.34%0.03514%0.141CC..Hα-helixtrans-59.4-50176.8-650000111.3V101 M108 Y109V101-S105 VanDerWaalsContact O-CB 3.24Å; V101-S105 WeakPolarHBondContact O-CB 3.32Å; V101-S105 PolarHBondContact O-N 3.41Å; V101-S105 PolarHBondContact O-OG 2.92Å; S105-M108 PolarHBondContact O-N 3.49Å; S105-Y109 VanDerWaalsContact O-CD2 3.22Å; S105-Y109 WeakPolarHBondContact O-CD2 3.44Å; S105-Y109 PolarHBondContact O-N 2.94Å
106N95.8Very high96.9Very high4 Ų426.1 Ų26.12%0.02112%0.118CC..Hα-helixtrans-65.6-40.6179.4-79.1-64.4000113.3E102 Y103 M108 Y109 F110 L160 E194E102-N106 WeakPolarHBondContact O-CB 3.07Å; E102-N106 PolarHBondContact O-N 3.2Å; E102-N106 VanDerWaalsContact O-N 3.13Å; E102-N106 PolarHBondContact O-ND2 3.11Å; Y103-N106 PolarHBondContact O-N 3.21Å; N106-M108 VanDerWaalsContact C-N 3.3Å; N106-M108 PolarHBondContact O-N 3.44Å; N106-Y109 PolarHBondContact O-N 3.39Å; N106-F110 WeakPolarHBondContact O-CB 3.16Å; N106-F110 PolarHBondContact O-N 3.44Å; N106-L160 HydrophobicContact CB-CD1 3.49Å; N106-L160 VanDerWaalsContact CB-CD1 3.49Å; N106-E194 PolarHBondContact OD1-OE1 3.04Å
107T98.1Very high97Very high2 Ų220 Ų201%0.0129%0.092CC..Hα-helixtrans-58.2-43.6174.5-58.90000111Y103 L104 T111 I154 N157Y103-T107 VanDerWaalsContact O-CB 3.26Å; Y103-T107 WeakPolarHBondContact O-CB 3.13Å; Y103-T107 PolarHBondContact O-N 3.3Å; Y103-T107 PolarHBondContact O-OG1 2.97Å; L104-T107 PolarHBondContact O-N 2.77Å; T107-T111 VanDerWaalsContact O-CB 3.29Å; T107-T111 WeakPolarHBondContact O-CB 3.28Å; T107-T111 PolarHBondContact O-N 2.87Å; T107-T111 PolarHBondContact O-OG1 3.42Å; T107-I154 HydrophobicContact CG2-CG1 3.98Å; T107-N157 WeakPolarHBondContact OG1-CB 3.21Å
108M98.3Very high97.1Very high8 Ų816.7 Ų16.74%0.0398%0.081CC..Hα-helixtrans-74.1-35.1179.7-64.5-62.4100.500112.7A59 I62 T63 L104 S105 N106 T111 S112 Y150A59-M108 HydrophobicContact CB-SD 4.31Å; I62-M108 HydrophobicContact CB-CG 3.83Å; I62-M108 HydrophobicContact CB-SD 4Å; I62-M108 HydrophobicContact CD1-SD 3.66Å; I62-M108 HydrophobicContact CG1-SD 4.43Å; I62-M108 HydrophobicContact CG2-CG 3.55Å; I62-M108 HydrophobicContact CG2-SD 4.11Å; T63-M108 WeakPolarHBondContact OG1-CB 3.48Å; L104-M108 HydrophobicContact CD1-CE 4.42Å; L104-M108 HydrophobicContact CD1-CG 4.19Å; L104-M108 VanDerWaalsContact O-CG 3.28Å; L104-M108 WeakPolarHBondContact O-CG 3.34Å; L104-M108 PolarHBondContact O-N 2.83Å; S105-M108 PolarHBondContact O-N 3.49Å; N106-M108 VanDerWaalsContact C-N 3.3Å; N106-M108 PolarHBondContact O-N 3.44Å; M108-T111 PolarHBondContact O-N 3.21Å; M108-S112 WeakPolarHBondContact O-CB 3.2Å; M108-S112 PolarHBondContact O-N 3.45Å; M108-S112 PolarHBondContact O-OG 3.07Å; M108-Y150 HydrophobicContact CE-CD1 4.36Å; M108-Y150 HydrophobicContact CE-CE1 4.05Å; M108-Y150 HydrophobicContact SD-CE1 4.27Å
109Y97.7Very high97.2Very high8 Ų816.7 Ų16.73%0.0318%0.082CC..Hα-helixtrans-59.1-47.6171.7-65.2-36.4000112.4T63 N67 S105 N106 S113 F199 K295 Y299T63-Y109 HydrophobicContact CG2-CD1 3.7Å; T63-Y109 HydrophobicContact CG2-CE1 3.29Å; N67-Y109 WeakPolarHBondContact CB-OH 3.38Å; N67-Y109 PolarHBondContact ND2-OH 3.38Å; N67-Y109 PolarHBondContact OD1-OH 3.24Å; S105-Y109 VanDerWaalsContact O-CD2 3.22Å; S105-Y109 WeakPolarHBondContact O-CD2 3.44Å; S105-Y109 PolarHBondContact O-N 2.94Å; N106-Y109 PolarHBondContact O-N 3.39Å; Y109-S113 WeakPolarHBondContact O-CB 3.16Å; Y109-S113 PolarHBondContact O-N 3Å; Y109-S113 VanDerWaalsContact O-N 3.07Å; Y109-S113 PolarHBondContact O-OG 3.24Å; Y109-F199 HydrophobicContact CD2-CE1 4.39Å; Y109-F199 HydrophobicContact CD2-CZ 4.11Å; Y109-F199 HydrophobicContact CG-CE1 4.41Å; Y109-K295 VanDerWaalsContact CZ-NZ 3.26Å; Y109-K295 PolarHBondContact OH-NZ 3.06Å; Y109-K295 VanDerWaalsContact OH-NZ 3.11Å; Y109-Y299 HydrophobicContact CD1-CE2 4.27Å; Y109-Y299 VanDerWaalsContact CD1-OH 3.25Å; Y109-Y299 WeakPolarHBondContact CD1-OH 3.48Å; Y109-Y299 HydrophobicContact CE1-CE2 4.03Å
110F98.4Very high97.3Very high8 Ų814.2 Ų14.24%0.0357%0.071CC..Hα-helixtrans-57.9-53174.1178.6-80.3000109.8N106 S112 S113 Y114 I152 F193 V197 T198N106-F110 WeakPolarHBondContact O-CB 3.16Å; N106-F110 PolarHBondContact O-N 3.44Å; F110-S112 PolarHBondContact O-N 2.95Å; F110-S113 PolarHBondContact O-N 3.16Å; F110-Y114 AromaticContact CD1-CD2 3.95Å; F110-Y114 HydrophobicContact CD1-CD2 3.95Å; F110-Y114 AromaticContact CD2-CD2 3.8Å; F110-Y114 HydrophobicContact CD2-CD2 3.8Å; F110-Y114 AromaticContact CD2-CE2 3.63Å; F110-Y114 HydrophobicContact CD2-CE2 3.63Å; F110-Y114 AromaticContact CE1-CD2 3.73Å; F110-Y114 HydrophobicContact CE1-CD2 3.73Å; F110-Y114 HydrophobicContact CE1-CE2 4.24Å; F110-Y114 HydrophobicContact CE1-CG 4.15Å; F110-Y114 AromaticContact CE2-CD2 3.59Å; F110-Y114 HydrophobicContact CE2-CD2 3.59Å; F110-Y114 AromaticContact CE2-CE2 3.23Å; F110-Y114 HydrophobicContact CE2-CE2 3.23Å; F110-Y114 AromaticContact CE2-CZ 3.96Å; F110-Y114 AromaticContact CG-CD2 3.97Å; F110-Y114 HydrophobicContact CG-CD2 3.97Å; F110-Y114 HydrophobicContact CG-CE2 4.28Å; F110-Y114 AromaticContact CZ-CD2 3.54Å; F110-Y114 HydrophobicContact CZ-CD2 3.54Å; F110-Y114 AromaticContact CZ-CE2 3.57Å; F110-Y114 HydrophobicContact CZ-CE2 3.57Å; F110-Y114 HydrophobicContact CZ-CG 4.09Å; F110-Y114 WeakPolarHBondContact O-CD2 3.37Å; F110-Y114 PolarHBondContact O-N 3.31Å; F110-I152 HydrophobicContact CE1-CB 4.43Å; F110-I152 HydrophobicContact CE1-CG2 3.88Å; F110-I152 HydrophobicContact CZ-CG2 3.73Å; F110-F193 HydrophobicContact CD2-CE1 4.42Å; F110-F193 HydrophobicContact CD2-CZ 4.45Å; F110-F193 HydrophobicContact CE2-CZ 4.18Å; F110-V197 HydrophobicContact CE2-CG1 3.98Å; F110-T198 HydrophobicContact CB-CG2 4.04Å
111T98.6Very high97.4Very high0 Ų016.1 Ų16.10%08%0.078CC..Hα-helixtrans-59.3-50.5-175.9-59.60000111.4A59 T107 M108 S113 Y114 L115 V149 Y150A59-T111 HydrophobicContact CB-CG2 4.18Å; T107-T111 VanDerWaalsContact O-CB 3.29Å; T107-T111 WeakPolarHBondContact O-CB 3.28Å; T107-T111 PolarHBondContact O-N 2.87Å; T107-T111 PolarHBondContact O-OG1 3.42Å; M108-T111 PolarHBondContact O-N 3.21Å; T111-S113 PolarHBondContact O-N 3.18Å; T111-Y114 PolarHBondContact O-N 3.15Å; T111-L115 HydrophobicContact CG2-CD1 3.9Å; T111-L115 HydrophobicContact CG2-CG 4.27Å; T111-L115 VanDerWaalsContact O-CB 3.28Å; T111-L115 WeakPolarHBondContact O-CB 3.27Å; T111-L115 WeakPolarHBondContact O-CG 3.27Å; T111-L115 PolarHBondContact O-N 3.2Å; T111-V149 HydrophobicContact CG2-CG1 4.22Å; T111-Y150 HydrophobicContact CG2-CD1 3.95Å; T111-Y150 HydrophobicContact CG2-CD2 3.53Å; T111-Y150 HydrophobicContact CG2-CE1 3.91Å; T111-Y150 HydrophobicContact CG2-CE2 3.47Å; T111-Y150 VanDerWaalsContact CG2-CE2 3.47Å; T111-Y150 HydrophobicContact CG2-CG 3.78Å
112S98.4Very high97.4Very high0 Ų016.3 Ų16.30%08%0.078CC..Hα-helixtrans-58.4-45177.4-75.70000112.3A59 N60 M108 F110 L115 I116A59-S112 WeakPolarHBondContact CB-OG 3.33Å; N60-S112 PolarHBondContact OD1-OG 3.29Å; M108-S112 WeakPolarHBondContact O-CB 3.2Å; M108-S112 PolarHBondContact O-N 3.45Å; M108-S112 PolarHBondContact O-OG 3.07Å; F110-S112 PolarHBondContact O-N 2.95Å; S112-L115 PolarHBondContact O-N 3.28Å; S112-I116 WeakPolarHBondContact O-CG1 3.41Å; S112-I116 PolarHBondContact O-N 3Å; S112-I116 VanDerWaalsContact O-N 3.11Å
113S98.4Very high97.4Very high0 Ų014.4 Ų14.40%07%0.07CC..Hα-helixtrans-65.6-45.4-178.2-58.70000111.9Y109 F110 T111 I116 V117 Y256Y109-S113 WeakPolarHBondContact O-CB 3.16Å; Y109-S113 PolarHBondContact O-N 3Å; Y109-S113 VanDerWaalsContact O-N 3.07Å; Y109-S113 PolarHBondContact O-OG 3.24Å; F110-S113 PolarHBondContact O-N 3.16Å; T111-S113 PolarHBondContact O-N 3.18Å; S113-I116 WeakPolarHBondContact O-CB 3.48Å; S113-I116 PolarHBondContact O-N 3.23Å; S113-V117 WeakPolarHBondContact O-CG2 3.39Å; S113-V117 PolarHBondContact O-N 3.1Å; S113-V117 VanDerWaalsContact O-N 3.1Å; S113-Y256 PolarHBondContact OG-OH 3.08Å
114Y98.7Very high97.3Very high41 Ų4114.1 Ų14.116%0.1617%0.071CC..Hα-helixtrans-74.4-27.3178.3-82-87.2000113.2F110 T111 I116 V117 I118 V197 P202F110-Y114 AromaticContact CD1-CD2 3.95Å; F110-Y114 HydrophobicContact CD1-CD2 3.95Å; F110-Y114 AromaticContact CD2-CD2 3.8Å; F110-Y114 HydrophobicContact CD2-CD2 3.8Å; F110-Y114 AromaticContact CD2-CE2 3.63Å; F110-Y114 HydrophobicContact CD2-CE2 3.63Å; F110-Y114 AromaticContact CE1-CD2 3.73Å; F110-Y114 HydrophobicContact CE1-CD2 3.73Å; F110-Y114 HydrophobicContact CE1-CE2 4.24Å; F110-Y114 HydrophobicContact CE1-CG 4.15Å; F110-Y114 AromaticContact CE2-CD2 3.59Å; F110-Y114 HydrophobicContact CE2-CD2 3.59Å; F110-Y114 AromaticContact CE2-CE2 3.23Å; F110-Y114 HydrophobicContact CE2-CE2 3.23Å; F110-Y114 AromaticContact CE2-CZ 3.96Å; F110-Y114 AromaticContact CG-CD2 3.97Å; F110-Y114 HydrophobicContact CG-CD2 3.97Å; F110-Y114 HydrophobicContact CG-CE2 4.28Å; F110-Y114 AromaticContact CZ-CD2 3.54Å; F110-Y114 HydrophobicContact CZ-CD2 3.54Å; F110-Y114 AromaticContact CZ-CE2 3.57Å; F110-Y114 HydrophobicContact CZ-CE2 3.57Å; F110-Y114 HydrophobicContact CZ-CG 4.09Å; F110-Y114 WeakPolarHBondContact O-CD2 3.37Å; F110-Y114 PolarHBondContact O-N 3.31Å; T111-Y114 PolarHBondContact O-N 3.15Å; Y114-I116 VanDerWaalsContact C-N 3.31Å; Y114-V117 WeakPolarHBondContact O-CB 3.31Å; Y114-V117 PolarHBondContact O-N 3.19Å; Y114-I118 PolarHBondContact O-N 3.29Å; Y114-V197 WeakPolarHBondContact CE2-O 3.41Å; Y114-V197 WeakPolarHBondContact OH-CG1 3.25Å; Y114-V197 PolarHBondContact OH-O 2.82Å; Y114-P202 HydrophobicContact CE2-CB 4.46Å; Y114-P202 HydrophobicContact CE2-CG 4.2Å
115L98.7Very high97.1Very high2 Ų214.9 Ų14.91%0.018%0.075CC..Hα-helixtrans-60.4-42.6167.4-77.2174.4000110.6F55 L56 A59 T111 S112 V117 I118 F119 C146 V149 Y150F55-L115 HydrophobicContact CB-CD1 4.15Å; F55-L115 HydrophobicContact CB-CD2 4.32Å; L56-L115 HydrophobicContact CB-CD1 4.36Å; L56-L115 HydrophobicContact CD1-CB 4.12Å; L56-L115 HydrophobicContact CD1-CD1 4.47Å; A59-L115 HydrophobicContact CB-CD1 4.33Å; T111-L115 HydrophobicContact CG2-CD1 3.9Å; T111-L115 HydrophobicContact CG2-CG 4.27Å; T111-L115 VanDerWaalsContact O-CB 3.28Å; T111-L115 WeakPolarHBondContact O-CB 3.27Å; T111-L115 WeakPolarHBondContact O-CG 3.27Å; T111-L115 PolarHBondContact O-N 3.2Å; S112-L115 PolarHBondContact O-N 3.28Å; L115-V117 VanDerWaalsContact C-N 3.34Å; L115-V117 PolarHBondContact O-N 2.78Å; L115-I118 HydrophobicContact CD2-CD1 3.91Å; L115-I118 VanDerWaalsContact O-CG1 3.25Å; L115-I118 WeakPolarHBondContact O-CG1 3.4Å; L115-F119 WeakPolarHBondContact O-CB 3.32Å; L115-F119 PolarHBondContact O-N 3.07Å; L115-C146 HydrophobicContact CD2-CB 4.12Å; L115-V149 HydrophobicContact CD2-CB 4.33Å; L115-V149 HydrophobicContact CD2-CG1 4.32Å; L115-V149 HydrophobicContact CG-CG1 4.11Å; L115-Y150 HydrophobicContact CD1-CE2 4Å
116I98.4Very high96.8Very high6 Ų615.1 Ų15.13%0.0318%0.076CC..Hα-helixtrans-63.7-39.4174.6-63.5168.3000111L56 S112 S113 Y114 F119 S120 V206 L248 F252L56-I116 HydrophobicContact CD1-CD1 4.45Å; L56-I116 HydrophobicContact CD1-CG1 4.02Å; L56-I116 HydrophobicContact CD2-CG1 4.03Å; S112-I116 WeakPolarHBondContact O-CG1 3.41Å; S112-I116 PolarHBondContact O-N 3Å; S112-I116 VanDerWaalsContact O-N 3.11Å; S113-I116 WeakPolarHBondContact O-CB 3.48Å; S113-I116 PolarHBondContact O-N 3.23Å; Y114-I116 VanDerWaalsContact C-N 3.31Å; I116-F119 PolarHBondContact O-N 3.42Å; I116-S120 WeakPolarHBondContact O-CB 3.4Å; I116-S120 PolarHBondContact O-N 2.94Å; I116-S120 PolarHBondContact O-OG 3.07Å; I116-V206 HydrophobicContact CB-CG2 4.46Å; I116-V206 HydrophobicContact CG2-CG1 4.24Å; I116-V206 HydrophobicContact CG2-CG2 3.75Å; I116-L248 HydrophobicContact CD1-CD1 4.27Å; I116-L248 HydrophobicContact CG1-CD1 4.05Å; I116-L248 HydrophobicContact CG2-CD1 4.28Å; I116-F252 HydrophobicContact CD1-CB 4.14Å; I116-F252 HydrophobicContact CD1-CD2 3.59Å; I116-F252 HydrophobicContact CD1-CE2 4.11Å; I116-F252 HydrophobicContact CD1-CG 3.9Å
117V98.7Very high96.5Very high7 Ų715.6 Ų15.64%0.0428%0.078CC..Hα-helixtrans-60-54.8175.9173.60000111.4S113 Y114 L115 F119 S120 I121 P202 L205 V206 L209S113-V117 WeakPolarHBondContact O-CG2 3.39Å; S113-V117 PolarHBondContact O-N 3.1Å; S113-V117 VanDerWaalsContact O-N 3.1Å; Y114-V117 WeakPolarHBondContact O-CB 3.31Å; Y114-V117 PolarHBondContact O-N 3.19Å; L115-V117 VanDerWaalsContact C-N 3.34Å; L115-V117 PolarHBondContact O-N 2.78Å; V117-F119 PolarHBondContact O-N 2.84Å; V117-S120 WeakPolarHBondContact O-CB 3.48Å; V117-S120 PolarHBondContact O-N 3.23Å; V117-S120 VanDerWaalsContact O-N 3.11Å; V117-I121 HydrophobicContact CG1-CD1 4.14Å; V117-I121 WeakPolarHBondContact O-CG1 3.19Å; V117-I121 PolarHBondContact O-N 2.94Å; V117-P202 HydrophobicContact CG2-CB 3.88Å; V117-L205 HydrophobicContact CG1-CB 4.2Å; V117-L205 HydrophobicContact CG1-CD1 4Å; V117-L205 HydrophobicContact CG2-CB 4.05Å; V117-L205 HydrophobicContact CG2-CD1 4.34Å; V117-V206 HydrophobicContact CG2-CG2 3.79Å; V117-L209 HydrophobicContact CG1-CD1 4.16Å
118I98.1Very high96Very high33 Ų3320.5 Ų20.517%0.16910%0.101CC..Hα-helixtrans-64.2-33-179.866.9172.7000111.3Y52 Y114 L115 S120 I121 D122 A145 V149Y52-I118 HydrophobicContact CD1-CD1 4.02Å; Y52-I118 HydrophobicContact CD1-CG1 4.18Å; Y52-I118 HydrophobicContact CE1-CD1 3.61Å; Y52-I118 HydrophobicContact CE1-CG1 3.88Å; Y114-I118 PolarHBondContact O-N 3.29Å; L115-I118 HydrophobicContact CD2-CD1 3.91Å; L115-I118 VanDerWaalsContact O-CG1 3.25Å; L115-I118 WeakPolarHBondContact O-CG1 3.4Å; I118-S120 VanDerWaalsContact C-N 3.33Å; I118-I121 PolarHBondContact O-N 2.72Å; I118-D122 WeakPolarHBondContact O-CB 3.42Å; I118-D122 PolarHBondContact O-N 3.46Å; I118-A145 HydrophobicContact CD1-CB 4.08Å; I118-V149 HydrophobicContact CD1-CG2 3.89Å; I118-V149 HydrophobicContact CG2-CG2 4.09Å
119F97.5Very high95.3Very high1 Ų125.1 Ų25.10%0.00412%0.12CC..Hα-helixtrans-65.6-40.6176.2-158.6177.8000110.8F49 Y52 L115 I116 V117 D122 R123 H245 L248F49-F119 HydrophobicContact CB-CZ 4.47Å; F49-F119 HydrophobicContact CD1-CZ 4.27Å; F49-F119 HydrophobicContact CD2-CE2 4.08Å; F49-F119 AromaticContact CD2-CZ 3.76Å; F49-F119 HydrophobicContact CD2-CZ 3.76Å; F49-F119 HydrophobicContact CE1-CZ 4.37Å; F49-F119 HydrophobicContact CE2-CE2 4.44Å; F49-F119 AromaticContact CE2-CZ 3.82Å; F49-F119 HydrophobicContact CE2-CZ 3.82Å; F49-F119 HydrophobicContact CG-CE2 4.33Å; F49-F119 AromaticContact CG-CZ 3.92Å; F49-F119 HydrophobicContact CG-CZ 3.92Å; F49-F119 HydrophobicContact CZ-CZ 4.12Å; Y52-F119 AromaticContact CD2-CD2 3.47Å; Y52-F119 HydrophobicContact CD2-CD2 3.47Å; Y52-F119 VanDerWaalsContact CD2-CD2 3.47Å; Y52-F119 AromaticContact CD2-CE2 3.56Å; Y52-F119 HydrophobicContact CD2-CE2 3.56Å; Y52-F119 HydrophobicContact CD2-CG 4.22Å; Y52-F119 HydrophobicContact CD2-CZ 4.44Å; Y52-F119 HydrophobicContact CE2-CD2 4.28Å; Y52-F119 HydrophobicContact CG-CB 4.37Å; Y52-F119 AromaticContact CG-CD2 3.71Å; Y52-F119 HydrophobicContact CG-CD2 3.71Å; Y52-F119 AromaticContact CG-CE2 3.92Å; Y52-F119 HydrophobicContact CG-CE2 3.92Å; Y52-F119 HydrophobicContact CG-CG 4Å; Y52-F119 HydrophobicContact CG-CZ 4.47Å; L115-F119 WeakPolarHBondContact O-CB 3.32Å; L115-F119 PolarHBondContact O-N 3.07Å; I116-F119 PolarHBondContact O-N 3.42Å; V117-F119 PolarHBondContact O-N 2.84Å; F119-D122 PolarHBondContact O-N 3.35Å; F119-R123 WeakPolarHBondContact O-CG 3.25Å; F119-R123 PolarHBondContact O-N 3.44Å; F119-H245 AromaticContact CD1-CD2 3.66Å; F119-H245 AromaticContact CD2-CD2 3.94Å; F119-H245 AromaticContact CG-CD2 3.52Å; F119-H245 AromaticContact CG-NE2 3.93Å; F119-L248 HydrophobicContact CE1-CD2 4.35Å
120S97.8Very high94.4Very high0 Ų028 Ų280%014%0.14CC..Hα-helixtrans-64.2-43.9175.4-56.70000111.9I116 V117 I118 D122 R123 L124 H245I116-S120 WeakPolarHBondContact O-CB 3.4Å; I116-S120 PolarHBondContact O-N 2.94Å; I116-S120 PolarHBondContact O-OG 3.07Å; V117-S120 WeakPolarHBondContact O-CB 3.48Å; V117-S120 PolarHBondContact O-N 3.23Å; V117-S120 VanDerWaalsContact O-N 3.11Å; I118-S120 VanDerWaalsContact C-N 3.33Å; S120-D122 VanDerWaalsContact C-N 3.34Å; S120-D122 PolarHBondContact O-N 3.36Å; S120-R123 PolarHBondContact O-N 3.24Å; S120-L124 PolarHBondContact O-N 2.54Å; S120-H245 WeakPolarHBondContact CA-CE1 3.41Å; S120-H245 WeakPolarHBondContact CA-NE2 3.3Å; S120-H245 PolarHBondContact N-NE2 3.41Å; S120-H245 PolarHBondContact OG-CE1 3.11Å; S120-H245 PolarHBondContact OG-NE2 3.46Å
121I96.9Very high93.2Very high73 Ų7334.9 Ų34.937%0.37418%0.176SC..Hα-helixtrans-59.2-47.7174.2-66169.2000110.1V117 I118 R123 L124 L125 L209V117-I121 HydrophobicContact CG1-CD1 4.14Å; V117-I121 WeakPolarHBondContact O-CG1 3.19Å; V117-I121 PolarHBondContact O-N 2.94Å; I118-I121 PolarHBondContact O-N 2.72Å; I121-R123 VanDerWaalsContact C-N 3.29Å; I121-R123 PolarHBondContact O-N 2.89Å; I121-L124 PolarHBondContact O-N 3.46Å; I121-L125 HydrophobicContact CG2-CD1 4.06Å; I121-L125 HydrophobicContact CG2-CG 4.42Å; I121-L125 WeakPolarHBondContact O-CG 3.34Å; I121-L125 PolarHBondContact O-N 3.38Å; I121-L209 HydrophobicContact CD1-CD1 4.5Å; I121-L209 HydrophobicContact CG1-CD1 3.71Å; I121-L209 HydrophobicContact CG1-CD2 3.89Å; I121-L209 HydrophobicContact CG1-CG 4.49Å
122D95.2Very high92Very high9 Ų941.2 Ų41.25%0.04820%0.203CC..Hα-helixtrans-60.4-39.4178.8-173.197.8000112.1R48 Y52 I118 F119 S120 L125 T126R48-D122 IonicContact CZ-OD1 3.69Å; R48-D122 IonicContact CZ-OD2 3.49Å; R48-D122 IonicContact NE-OD1 3.05Å; R48-D122 IonicContact NH1-OD1 2.7Å; R48-D122 PolarHBondContact NH1-OD1 2.94Å; R48-D122 IonicContact NH1-OD2 2.81Å; R48-D122 IonicContact NH2-OD1 3.98Å; R48-D122 IonicContact NH2-OD2 2.9Å; Y52-D122 HydrophobicContact CE2-CB 3.77Å; Y52-D122 PolarHBondContact OH-OD1 3.07Å; I118-D122 WeakPolarHBondContact O-CB 3.42Å; I118-D122 PolarHBondContact O-N 3.46Å; F119-D122 PolarHBondContact O-N 3.35Å; S120-D122 VanDerWaalsContact C-N 3.34Å; S120-D122 PolarHBondContact O-N 3.36Å; D122-L125 PolarHBondContact O-N 3.22Å; D122-T126 WeakPolarHBondContact O-CB 3.3Å; D122-T126 PolarHBondContact O-N 3.29Å; D122-T126 PolarHBondContact O-OG1 2.91Å
123R94.1Very high90.8Very high2 Ų243.2 Ų43.21%0.00821%0.212CC..Hα-helixtrans-64-46.2173.7-71.2-46.888.2125.8-11.8112.6F119 S120 I121 L125 T126 I127 I213 H245F119-R123 WeakPolarHBondContact O-CG 3.25Å; F119-R123 PolarHBondContact O-N 3.44Å; S120-R123 PolarHBondContact O-N 3.24Å; I121-R123 VanDerWaalsContact C-N 3.29Å; I121-R123 PolarHBondContact O-N 2.89Å; R123-L125 VanDerWaalsContact C-N 3.32Å; R123-L125 PolarHBondContact O-N 3.35Å; R123-T126 PolarHBondContact O-N 2.76Å; R123-I127 VanDerWaalsContact O-CG1 3.3Å; R123-I127 WeakPolarHBondContact O-CG1 3.34Å; R123-I127 PolarHBondContact O-N 3.19Å; R123-I213 HydrophobicContact CB-CD1 4.06Å; R123-H245 HydrophobicContact CG-CB 3.83Å; R123-H245 VanDerWaalsContact CG-CG 3.5Å
124L94.1Very high89.7Confident36 Ų3645 Ų4519%0.18822%0.219CC..Hα-helixtrans-58.6-45.7177-178.159.8000111.2S120 I121 T126 I127 H128 L209 F212 I213 E216S120-L124 PolarHBondContact O-N 2.54Å; I121-L124 PolarHBondContact O-N 3.46Å; L124-T126 VanDerWaalsContact C-N 3.34Å; L124-T126 PolarHBondContact O-N 2.89Å; L124-I127 PolarHBondContact O-N 3.3Å; L124-H128 WeakPolarHBondContact O-CB 3.34Å; L124-H128 PolarHBondContact O-N 3.47Å; L124-L209 HydrophobicContact CD2-CD2 4.02Å; L124-F212 HydrophobicContact CD1-CB 3.9Å; L124-F212 HydrophobicContact CD2-CB 3.92Å; L124-I213 HydrophobicContact CB-CG1 4.03Å; L124-I213 HydrophobicContact CD1-CG1 4.13Å; L124-E216 HydrophobicContact CD1-CG 4Å
125L92.1Very high88.7Confident68 Ų6843 Ų4336%0.35621%0.211SC..Hα-helixtrans-62.7-39176.4-68.2174.9000112.8I121 D122 R123 I127 K129 F133I121-L125 HydrophobicContact CG2-CD1 4.06Å; I121-L125 HydrophobicContact CG2-CG 4.42Å; I121-L125 WeakPolarHBondContact O-CG 3.34Å; I121-L125 PolarHBondContact O-N 3.38Å; D122-L125 PolarHBondContact O-N 3.22Å; R123-L125 VanDerWaalsContact C-N 3.32Å; R123-L125 PolarHBondContact O-N 3.35Å; L125-I127 VanDerWaalsContact C-N 3.34Å; L125-K129 PolarHBondContact O-N 2.95Å; L125-F133 HydrophobicContact CB-CD1 4.24Å; L125-F133 HydrophobicContact CB-CD2 4.24Å; L125-F133 HydrophobicContact CB-CE1 4.45Å; L125-F133 HydrophobicContact CB-CE2 4.45Å; L125-F133 HydrophobicContact CB-CG 4.12Å; L125-F133 HydrophobicContact CD1-CE1 4.13Å; L125-F133 HydrophobicContact CD1-CZ 4.33Å
126T90.1Very high87.5Confident10 Ų1045.4 Ų45.46%0.06122%0.223CC..Hα-helixtrans-65.2-36.8177.3-58.90000111.8R48 D122 R123 L124 P130 F133R48-T126 PolarHBondContact NH2-OG1 3.43Å; R48-T126 VanDerWaalsContact NH2-OG1 3.13Å; D122-T126 WeakPolarHBondContact O-CB 3.3Å; D122-T126 PolarHBondContact O-N 3.29Å; D122-T126 PolarHBondContact O-OG1 2.91Å; R123-T126 PolarHBondContact O-N 2.76Å; L124-T126 VanDerWaalsContact C-N 3.34Å; L124-T126 PolarHBondContact O-N 2.89Å; T126-P130 WeakPolarHBondContact O-CA 3.5Å; T126-F133 WeakPolarHBondContact CG2-O 3.46Å; T126-F133 PolarHBondContact OG1-O 3Å
127I88.3Confident86.8Confident13 Ų1351.2 Ų51.27%0.06725%0.246CC..Hα-helixtrans-74.6-44.6177.4-65165.7000110.8R123 L124 L125 I213 E216 L217 L220 V242R123-I127 VanDerWaalsContact O-CG1 3.3Å; R123-I127 WeakPolarHBondContact O-CG1 3.34Å; R123-I127 PolarHBondContact O-N 3.19Å; L124-I127 PolarHBondContact O-N 3.3Å; L125-I127 VanDerWaalsContact C-N 3.34Å; I127-I213 HydrophobicContact CD1-CB 4.41Å; I127-I213 HydrophobicContact CD1-CG1 4.32Å; I127-I213 HydrophobicContact CD1-CG2 3.72Å; I127-E216 HydrophobicContact CG2-CB 3.73Å; I127-L217 HydrophobicContact CD1-CD2 4.2Å; I127-L217 HydrophobicContact CD1-CG 4.2Å; I127-L217 HydrophobicContact CG2-CD2 4.41Å; I127-L220 HydrophobicContact CG2-CD1 3.52Å; I127-V242 HydrophobicContact CD1-CB 4.45Å; I127-V242 HydrophobicContact CD1-CG1 3.56Å; I127-V242 HydrophobicContact CD1-CG2 3.97Å; I127-V242 HydrophobicContact CG1-CG1 4.27Å; I127-V242 HydrophobicContact CG1-CG2 3.82Å
128H87.1Confident86.2Confident105 Ų10555.1 Ų55.149%0.48626%0.264SS..Hα-helixtrans-69.1-37-176.7-171.270.8000112.4L124 E216L124-H128 WeakPolarHBondContact O-CB 3.34Å; L124-H128 PolarHBondContact O-N 3.47Å; H128-E216 IonicContact CE1-OE2 3.92Å; H128-E216 IonicContact CG-OE2 3.96Å; H128-E216 IonicContact ND1-OE2 2.98Å; H128-E216 PolarHBondContact ND1-OE2 3.25Å
129K83.9Confident85.9Confident105 Ų10556.6 Ų56.646%0.45727%0.269SS..SBendtrans-134.472-179.3-71.6-176.8-175.1-175.90111.3L125 I131 K132 F133L125-K129 PolarHBondContact O-N 2.95Å; K129-I131 VanDerWaalsContact C-N 3.31Å; K129-I131 PolarHBondContact O-N 3.1Å; K129-K132 HydrophobicContact CB-CB 4.31Å; K129-K132 PolarHBondContact O-N 2.66Å; K129-F133 HydrophobicContact CB-CD2 3.81Å; K129-F133 HydrophobicContact CB-CE2 4.28Å; K129-F133 HydrophobicContact CD-CE2 4.41Å; K129-F133 PolarHBondContact O-N 2.94Å
130P79.4Confident85.7Confident68 Ų6862.5 Ų62.544%0.44230%0.296SS..THydrogen-bonded Turntrans-63.4-31.5-170.124.6-34.6000114.2T126 Y134T126-P130 WeakPolarHBondContact O-CA 3.5Å; P130-Y134 PolarHBondContact O-N 3.42Å
131I73.7Confident85.5Confident154 Ų15470.5 Ų70.579%0.7933%0.327SS*.THydrogen-bonded Turntrans-72.8-43.2179.4-58.9173.1000110.7K129K129-I131 VanDerWaalsContact C-N 3.31Å; K129-I131 PolarHBondContact O-N 3.1Å
132K72.3Confident85.4Confident132 Ų13267.1 Ų67.157%0.57431%0.309SS*.THydrogen-bonded Turntrans-76.6-40.1-177.3-172.1174-177.5175.40112K129K129-K132 HydrophobicContact CB-CB 4.31Å; K129-K132 PolarHBondContact O-N 2.66Å
133F74.1Confident85.5Confident43 Ų4369.9 Ų69.919%0.18932%0.324CS..THydrogen-bonded Turntrans-106.646.8-177.1-67.3-85.4000111.3R48 L125 T126 K129R48-F133 VanDerWaalsContact NH2-C 3.29Å; R48-F133 PolarHBondContact NH2-O 3.44Å; L125-F133 HydrophobicContact CB-CD1 4.24Å; L125-F133 HydrophobicContact CB-CD2 4.24Å; L125-F133 HydrophobicContact CB-CE1 4.45Å; L125-F133 HydrophobicContact CB-CE2 4.45Å; L125-F133 HydrophobicContact CB-CG 4.12Å; L125-F133 HydrophobicContact CD1-CE1 4.13Å; L125-F133 HydrophobicContact CD1-CZ 4.33Å; T126-F133 WeakPolarHBondContact CG2-O 3.46Å; T126-F133 PolarHBondContact OG1-O 3Å; K129-F133 HydrophobicContact CB-CD2 3.81Å; K129-F133 HydrophobicContact CB-CE2 4.28Å; K129-F133 HydrophobicContact CD-CE2 4.41Å; K129-F133 PolarHBondContact O-N 2.94Å
134Y75.3Confident85.7Confident37 Ų3772.3 Ų72.315%0.14534%0.336CS..  trans-65.2143.5172.5-177-124000110.9P130 I136 Y137 R234 E238P130-Y134 PolarHBondContact O-N 3.42Å; Y134-I136 HydrophobicContact CD1-CB 3.91Å; Y134-I136 HydrophobicContact CD1-CD1 4.47Å; Y134-I136 HydrophobicContact CD1-CG1 4.09Å; Y134-I136 HydrophobicContact CE1-CB 3.8Å; Y134-I136 HydrophobicContact CE1-CD1 3.51Å; Y134-I136 HydrophobicContact CE1-CG1 3.52Å; Y134-I136 PolarHBondContact O-N 2.98Å; Y134-Y137 PolarHBondContact O-N 3.45Å; Y134-R234 HydrophobicContact CE2-CG 3.8Å; Y134-R234 WeakPolarHBondContact OH-CD 3.16Å; Y134-E238 HydrophobicContact CD2-CG 4.41Å; Y134-E238 HydrophobicContact CE2-CG 3.97Å
135S76.4Confident85.9Confident0 Ų072 Ų720%034%0.338CS..THydrogen-bonded Turntrans-63.3-13.5-170.2-172.50000114.8S47 R48 E238S47-S135 WeakPolarHBondContact CA-O 3.35Å; S47-S135 WeakPolarHBondContact CB-OG 3.48Å; R48-S135 PolarHBondContact N-O 3.48Å; S135-E238 WeakPolarHBondContact CB-OE1 3.35Å; S135-E238 VanDerWaalsContact CB-OE2 3.32Å; S135-E238 WeakPolarHBondContact CB-OE2 3.27Å
136I75.2Confident86.2Confident51 Ų5168.7 Ų68.726%0.26232%0.321SS..THydrogen-bonded Turntrans-91.9-20.5176.9-55-177000111.5P45 Y134 K139P45-I136 HydrophobicContact CB-CG2 4.44Å; P45-I136 HydrophobicContact CG-CD1 3.61Å; P45-I136 HydrophobicContact CG-CG1 4.31Å; P45-I136 HydrophobicContact CG-CG2 4.36Å; Y134-I136 HydrophobicContact CD1-CB 3.91Å; Y134-I136 HydrophobicContact CD1-CD1 4.47Å; Y134-I136 HydrophobicContact CD1-CG1 4.09Å; Y134-I136 HydrophobicContact CE1-CB 3.8Å; Y134-I136 HydrophobicContact CE1-CD1 3.51Å; Y134-I136 HydrophobicContact CE1-CG1 3.52Å; Y134-I136 PolarHBondContact O-N 2.98Å; I136-K139 WeakPolarHBondContact O-CE 3.39Å; I136-K139 WeakPolarHBondContact O-CG 3.47Å
137Y82.1Confident86.6Confident129 Ų12972.6 Ų72.651%0.50634%0.341SS..THydrogen-bonded Turntrans-81.8159178.1-60-24.5000111.4R48 Y134 K139R48-Y137 WeakPolarHBondContact CD-O 3.39Å; R48-Y137 WeakPolarHBondContact CG-O 3.24Å; R48-Y137 PolarHBondContact NE-O 2.89Å; R48-Y137 VanDerWaalsContact NE-O 3.11Å; Y134-Y137 PolarHBondContact O-N 3.45Å; Y137-K139 VanDerWaalsContact C-N 3.26Å; Y137-K139 PolarHBondContact O-N 3.46Å; Y137-K139 VanDerWaalsContact O-N 3.12Å
138H86.4Confident87Confident89 Ų8976.3 Ų76.341%0.41236%0.361SS..THydrogen-bonded Turntrans55.231.1172.8-53.4-63.3000115.8H140 W141 A142H138-H140 VanDerWaalsContact C-N 3.25Å; H138-H140 PolarHBondContact O-N 3.24Å; H138-W141 HydrophobicContact CB-CB 4.46Å; H138-W141 AromaticContact ND1-CD1 3.91Å; H138-W141 PolarHBondContact O-N 3.42Å; H138-W141 VanDerWaalsContact O-N 3.14Å; H138-A142 PolarHBondContact O-N 3.04Å
139K91.3Very high87.6Confident63 Ų6371.9 Ų71.927%0.27434%0.341SS..Hα-helixtrans-57.8-37.2178.3-55.6177.8-158.8-172.70113.2L46 R48 I51 I136 Y137 W141 A142 L143L46-K139 WeakPolarHBondContact O-CD 3.14Å; L46-K139 WeakPolarHBondContact O-CE 3.41Å; L46-K139 PolarHBondContact O-NZ 3Å; R48-K139 HydrophobicContact CG-CG 4.49Å; I51-K139 HydrophobicContact CD1-CB 3.85Å; I136-K139 WeakPolarHBondContact O-CE 3.39Å; I136-K139 WeakPolarHBondContact O-CG 3.47Å; Y137-K139 VanDerWaalsContact C-N 3.26Å; Y137-K139 PolarHBondContact O-N 3.46Å; Y137-K139 VanDerWaalsContact O-N 3.12Å; K139-W141 VanDerWaalsContact C-N 3.3Å; K139-W141 PolarHBondContact O-N 3.34Å; K139-A142 PolarHBondContact O-N 2.81Å; K139-L143 PolarHBondContact O-N 3.01Å
140H93.2Very high88.3Confident126 Ų12668.5 Ų68.558%0.58333%0.326SS*.Hα-helixtrans-60.2-41177.9-17662.3000111.8H138 L143 I144H138-H140 VanDerWaalsContact C-N 3.25Å; H138-H140 PolarHBondContact O-N 3.24Å; H140-L143 WeakPolarHBondContact O-CB 3.28Å; H140-L143 PolarHBondContact O-N 3.37Å; H140-I144 WeakPolarHBondContact NE2-CD1 3.46Å; H140-I144 WeakPolarHBondContact O-CG1 3.23Å; H140-I144 PolarHBondContact O-N 2.93Å
141W94.2Very high89.2Confident168 Ų16871.1 Ų71.164%0.63633%0.331SS*.Hα-helixtrans-67.3-37.7175.9-66.3106.3000112.7H138 K139 L143 I144 A145H138-W141 HydrophobicContact CB-CB 4.46Å; H138-W141 AromaticContact ND1-CD1 3.91Å; H138-W141 PolarHBondContact O-N 3.42Å; H138-W141 VanDerWaalsContact O-N 3.14Å; K139-W141 VanDerWaalsContact C-N 3.3Å; K139-W141 PolarHBondContact O-N 3.34Å; W141-L143 VanDerWaalsContact C-N 3.33Å; W141-I144 HydrophobicContact CE3-CD1 4.31Å; W141-I144 PolarHBondContact O-N 3.46Å; W141-A145 WeakPolarHBondContact O-CB 3.29Å; W141-A145 PolarHBondContact O-N 2.81Å
142A95.3Very high90.4Very high1 Ų168 Ų681%0.00831%0.314CS..Hα-helixtrans-63.3-40.3173.700000111.8R48 I51 Y52 H138 K139 A145 C146R48-A142 HydrophobicContact CB-CB 4.17Å; R48-A142 HydrophobicContact CG-CB 3.87Å; I51-A142 HydrophobicContact CD1-CB 4.47Å; Y52-A142 HydrophobicContact CE1-CB 4.3Å; Y52-A142 HydrophobicContact CE2-CB 3.96Å; H138-A142 PolarHBondContact O-N 3.04Å; K139-A142 PolarHBondContact O-N 2.81Å; A142-A145 PolarHBondContact O-N 3.17Å; A142-C146 PolarHBondContact O-N 2.87Å; A142-C146 PolarHBondContact O-SG 3.36Å
143L97.2Very high91.6Very high68 Ų6861.7 Ų61.736%0.35629%0.287SS..Hα-helixtrans-62.5-49.3174.7-17969.1000111.4F55 K139 H140 W141 A145 C146 L147F55-L143 HydrophobicContact CE2-CD1 3.55Å; F55-L143 HydrophobicContact CZ-CD1 3.55Å; K139-L143 PolarHBondContact O-N 3.01Å; H140-L143 WeakPolarHBondContact O-CB 3.28Å; H140-L143 PolarHBondContact O-N 3.37Å; W141-L143 VanDerWaalsContact C-N 3.33Å; L143-A145 VanDerWaalsContact C-N 3.32Å; L143-A145 PolarHBondContact O-N 3.37Å; L143-C146 PolarHBondContact O-N 3.22Å; L143-L147 HydrophobicContact CD1-CD1 4.5Å; L143-L147 HydrophobicContact CG-CD1 4.15Å; L143-L147 WeakPolarHBondContact O-CG 3.37Å; L143-L147 PolarHBondContact O-N 3.48Å
144I97.9Very high92.7Very high53 Ų5363.4 Ų63.427%0.27230%0.297SS..Hα-helixtrans-57.5-46.6176.9-70168.3000110.5H140 W141 C146 L147 L148H140-I144 WeakPolarHBondContact NE2-CD1 3.46Å; H140-I144 WeakPolarHBondContact O-CG1 3.23Å; H140-I144 PolarHBondContact O-N 2.93Å; W141-I144 HydrophobicContact CE3-CD1 4.31Å; W141-I144 PolarHBondContact O-N 3.46Å; I144-C146 VanDerWaalsContact C-N 3.32Å; I144-C146 PolarHBondContact O-N 3.48Å; I144-L147 PolarHBondContact O-N 3.32Å; I144-L148 HydrophobicContact CG2-CD1 3.8Å; I144-L148 HydrophobicContact CG2-CG 4.14Å; I144-L148 WeakPolarHBondContact O-CB 3.33Å; I144-L148 VanDerWaalsContact O-CG 3.32Å; I144-L148 WeakPolarHBondContact O-CG 3.33Å; I144-L148 PolarHBondContact O-N 3.02Å
145A97.8Very high93.8Very high28 Ų2865.8 Ų65.823%0.23131%0.312CS..Hα-helixtrans-59.3-42.5179.200000112.2I118 W141 A142 L143 L148 V149I118-A145 HydrophobicContact CD1-CB 4.08Å; W141-A145 WeakPolarHBondContact O-CB 3.29Å; W141-A145 PolarHBondContact O-N 2.81Å; A142-A145 PolarHBondContact O-N 3.17Å; L143-A145 VanDerWaalsContact C-N 3.32Å; L143-A145 PolarHBondContact O-N 3.37Å; A145-L148 PolarHBondContact O-N 3.42Å; A145-V149 WeakPolarHBondContact O-CG2 3.46Å; A145-V149 PolarHBondContact O-N 3.43Å
146C98.5Very high94.7Very high0 Ų067 Ų670%032%0.32CS..Hα-helixtrans-62.8-46.9175.6-64.70000111.9Y52 F55 L115 A142 L143 I144 L148 V149 Y150Y52-C146 WeakPolarHBondContact CD1-SG 3.34Å; F55-C146 HydrophobicContact CB-CB 4.09Å; F55-C146 HydrophobicContact CD1-CB 3.61Å; F55-C146 HydrophobicContact CD2-CB 3.91Å; F55-C146 HydrophobicContact CE1-CB 3.95Å; F55-C146 HydrophobicContact CE2-CB 4.23Å; F55-C146 HydrophobicContact CG-CB 3.59Å; F55-C146 HydrophobicContact CZ-CB 4.25Å; L115-C146 HydrophobicContact CD2-CB 4.12Å; A142-C146 PolarHBondContact O-N 2.87Å; A142-C146 PolarHBondContact O-SG 3.36Å; L143-C146 PolarHBondContact O-N 3.22Å; I144-C146 VanDerWaalsContact C-N 3.32Å; I144-C146 PolarHBondContact O-N 3.48Å; C146-L148 VanDerWaalsContact C-N 3.32Å; C146-L148 PolarHBondContact O-N 2.92Å; C146-V149 PolarHBondContact O-N 2.9Å; C146-Y150 WeakPolarHBondContact O-CD2 3.22Å; C146-Y150 PolarHBondContact O-N 3.29Å; C146-Y150 VanDerWaalsContact O-N 3.1Å
147L98.4Very high95.7Very high91 Ų9164.8 Ų64.848%0.47631%0.309SS..Hα-helixtrans-62.6-39178.9-68.7172.5000112F55 L143 I144 Y150 F151F55-L147 HydrophobicContact CE1-CD2 3.84Å; F55-L147 HydrophobicContact CE1-CG 4.35Å; F55-L147 HydrophobicContact CZ-CD2 4.08Å; F55-L147 HydrophobicContact CZ-CG 4.39Å; L143-L147 HydrophobicContact CD1-CD1 4.5Å; L143-L147 HydrophobicContact CG-CD1 4.15Å; L143-L147 WeakPolarHBondContact O-CG 3.37Å; L143-L147 PolarHBondContact O-N 3.48Å; I144-L147 PolarHBondContact O-N 3.32Å; L147-Y150 PolarHBondContact O-N 3.45Å; L147-F151 WeakPolarHBondContact O-CB 3.33Å; L147-F151 PolarHBondContact O-N 2.83Å
148L98.4Very high96.3Very high92 Ų9260.6 Ų60.648%0.48230%0.298SS..Hα-helixtrans-63.5-41.8175-73.3175.3000111.9I144 A145 C146 Y150 F151 I152I144-L148 HydrophobicContact CG2-CD1 3.8Å; I144-L148 HydrophobicContact CG2-CG 4.14Å; I144-L148 WeakPolarHBondContact O-CB 3.33Å; I144-L148 VanDerWaalsContact O-CG 3.32Å; I144-L148 WeakPolarHBondContact O-CG 3.33Å; I144-L148 PolarHBondContact O-N 3.02Å; A145-L148 PolarHBondContact O-N 3.42Å; C146-L148 VanDerWaalsContact C-N 3.32Å; C146-L148 PolarHBondContact O-N 2.92Å; L148-Y150 VanDerWaalsContact C-N 3.35Å; L148-Y150 PolarHBondContact O-N 2.93Å; L148-F151 PolarHBondContact O-N 3.4Å; L148-I152 WeakPolarHBondContact O-CB 3.47Å; L148-I152 WeakPolarHBondContact O-CG1 3.39Å; L148-I152 PolarHBondContact O-N 3.48Å
149V98.5Very high96.7Very high12 Ų1257.6 Ų57.67%0.07329%0.287CS..Hα-helixtrans-62-43.2175.7170.90000111.3T111 L115 I118 A145 C146 I152 G153T111-V149 HydrophobicContact CG2-CG1 4.22Å; L115-V149 HydrophobicContact CD2-CB 4.33Å; L115-V149 HydrophobicContact CD2-CG1 4.32Å; L115-V149 HydrophobicContact CG-CG1 4.11Å; I118-V149 HydrophobicContact CD1-CG2 3.89Å; I118-V149 HydrophobicContact CG2-CG2 4.09Å; A145-V149 WeakPolarHBondContact O-CG2 3.46Å; A145-V149 PolarHBondContact O-N 3.43Å; C146-V149 PolarHBondContact O-N 2.9Å; V149-I152 PolarHBondContact O-N 3.25Å; V149-G153 PolarHBondContact O-N 3.01Å
150Y98.5Very high96.8Very high34 Ų3454.8 Ų54.813%0.13328%0.275CS..Hα-helixtrans-59.8-47.2174-94.6-93.3000112F55 A59 M108 T111 L115 C146 L147 L148 G153 I154F55-Y150 HydrophobicContact CB-CE2 4.28Å; F55-Y150 AromaticContact CD1-CD2 3.89Å; F55-Y150 HydrophobicContact CD1-CD2 3.89Å; F55-Y150 AromaticContact CD1-CE2 3.59Å; F55-Y150 HydrophobicContact CD1-CE2 3.59Å; F55-Y150 HydrophobicContact CE1-CD2 4.48Å; F55-Y150 HydrophobicContact CE1-CE2 4.48Å; F55-Y150 HydrophobicContact CG-CE2 4.43Å; F55-Y150 PolarHBondContact O-OH 2.94Å; A59-Y150 WeakPolarHBondContact CB-OH 3.34Å; A59-Y150 PolarHBondContact N-OH 3.05Å; A59-Y150 VanDerWaalsContact N-OH 3.17Å; M108-Y150 HydrophobicContact CE-CD1 4.36Å; M108-Y150 HydrophobicContact CE-CE1 4.05Å; M108-Y150 HydrophobicContact SD-CE1 4.27Å; T111-Y150 HydrophobicContact CG2-CD1 3.95Å; T111-Y150 HydrophobicContact CG2-CD2 3.53Å; T111-Y150 HydrophobicContact CG2-CE1 3.91Å; T111-Y150 HydrophobicContact CG2-CE2 3.47Å; T111-Y150 VanDerWaalsContact CG2-CE2 3.47Å; T111-Y150 HydrophobicContact CG2-CG 3.78Å; L115-Y150 HydrophobicContact CD1-CE2 4Å; C146-Y150 WeakPolarHBondContact O-CD2 3.22Å; C146-Y150 PolarHBondContact O-N 3.29Å; C146-Y150 VanDerWaalsContact O-N 3.1Å; L147-Y150 PolarHBondContact O-N 3.45Å; L148-Y150 VanDerWaalsContact C-N 3.35Å; L148-Y150 PolarHBondContact O-N 2.93Å; Y150-G153 PolarHBondContact O-N 3.28Å; Y150-I154 VanDerWaalsContact O-CG1 3.28Å; Y150-I154 WeakPolarHBondContact O-CG1 3.2Å; Y150-I154 PolarHBondContact O-N 3.15Å
151F98.4Very high96.8Very high123 Ų12351.3 Ų51.354%0.53926%0.26SS..Hα-helixtrans-62.2-45.7179.6-178.8-107000112.2L147 L148 G153 I154 I155L147-F151 WeakPolarHBondContact O-CB 3.33Å; L147-F151 PolarHBondContact O-N 2.83Å; L148-F151 PolarHBondContact O-N 3.4Å; F151-G153 VanDerWaalsContact C-N 3.33Å; F151-G153 PolarHBondContact O-N 2.91Å; F151-I154 PolarHBondContact O-N 2.68Å; F151-I155 HydrophobicContact CD1-CD1 3.8Å; F151-I155 HydrophobicContact CD2-CD1 4.16Å; F151-I155 HydrophobicContact CE1-CD1 3.27Å; F151-I155 HydrophobicContact CE2-CD1 3.67Å; F151-I155 HydrophobicContact CE2-CG1 4.49Å; F151-I155 HydrophobicContact CG-CD1 4.23Å; F151-I155 HydrophobicContact CZ-CD1 3.21Å; F151-I155 HydrophobicContact CZ-CG1 4.43Å; F151-I155 WeakPolarHBondContact O-CG1 3.47Å; F151-I155 PolarHBondContact O-N 3.48Å
152I98.3Very high96.7Very high88 Ų8850 Ų5045%0.45126%0.259SS..Hα-helixtrans-62.4-42.1175-67165.7000110.2F110 L148 V149 I154 I155 S156F110-I152 HydrophobicContact CE1-CB 4.43Å; F110-I152 HydrophobicContact CE1-CG2 3.88Å; F110-I152 HydrophobicContact CZ-CG2 3.73Å; L148-I152 WeakPolarHBondContact O-CB 3.47Å; L148-I152 WeakPolarHBondContact O-CG1 3.39Å; L148-I152 PolarHBondContact O-N 3.48Å; V149-I152 PolarHBondContact O-N 3.25Å; I152-I154 PolarHBondContact O-N 2.86Å; I152-I155 PolarHBondContact O-N 2.84Å; I152-S156 WeakPolarHBondContact O-CB 3.37Å; I152-S156 PolarHBondContact O-N 3.48Å; I152-S156 PolarHBondContact O-OG 3.34Å
153G98.1Very high96.6Very high0 Ų050 Ų500%026%0.259CS..Hα-helixtrans-57.4-48.8176.200000112.2V149 Y150 F151 S156 N157V149-G153 PolarHBondContact O-N 3.01Å; Y150-G153 PolarHBondContact O-N 3.28Å; F151-G153 VanDerWaalsContact C-N 3.33Å; F151-G153 PolarHBondContact O-N 2.91Å; G153-S156 PolarHBondContact O-OG 3.44Å; G153-N157 WeakPolarHBondContact O-CB 3.22Å; G153-N157 PolarHBondContact O-N 3.35Å; G153-N157 VanDerWaalsContact O-N 3.17Å; G153-N157 PolarHBondContact O-ND2 2.76Å
154I97.7Very high96.4Very high78 Ų7847 Ų4740%0.424%0.243SC..Hα-helixtrans-59.2-49.8178.5-72.7167.2000110.7Y103 T107 Y150 F151 I152 S158Y103-I154 WeakPolarHBondContact OH-CG2 3.15Å; Y103-I154 PolarHBondContact OH-O 2.95Å; Y103-I154 VanDerWaalsContact OH-O 3.05Å; T107-I154 HydrophobicContact CG2-CG1 3.98Å; Y150-I154 VanDerWaalsContact O-CG1 3.28Å; Y150-I154 WeakPolarHBondContact O-CG1 3.2Å; Y150-I154 PolarHBondContact O-N 3.15Å; F151-I154 PolarHBondContact O-N 2.68Å; I152-I154 PolarHBondContact O-N 2.86Å; I154-S158 PolarHBondContact O-N 3.35Å
155I97.4Very high96.3Very high88 Ų8845.5 Ų45.545%0.45124%0.236SC..Hα-helixtrans-68.7-48.4-177.4-70.8172.5000111.2F151 I152 N157 S158F151-I155 HydrophobicContact CD1-CD1 3.8Å; F151-I155 HydrophobicContact CD2-CD1 4.16Å; F151-I155 HydrophobicContact CE1-CD1 3.27Å; F151-I155 HydrophobicContact CE2-CD1 3.67Å; F151-I155 HydrophobicContact CE2-CG1 4.49Å; F151-I155 HydrophobicContact CG-CD1 4.23Å; F151-I155 HydrophobicContact CZ-CD1 3.21Å; F151-I155 HydrophobicContact CZ-CG1 4.43Å; F151-I155 WeakPolarHBondContact O-CG1 3.47Å; F151-I155 PolarHBondContact O-N 3.48Å; I152-I155 PolarHBondContact O-N 2.84Å; I155-N157 VanDerWaalsContact C-N 3.3Å; I155-N157 PolarHBondContact O-N 3.48Å; I155-S158 VanDerWaalsContact O-CB 3.25Å; I155-S158 WeakPolarHBondContact O-CB 3.48Å; I155-S158 PolarHBondContact O-N 3.48Å; I155-S158 VanDerWaalsContact O-N 3.12Å; I155-S158 PolarHBondContact O-OG 2.69Å
156S96Very high96.1Very high25 Ų2546 Ų4618%0.17524%0.235CC..Hα-helixtrans-67.4-29.5-172.162.70000113.4I152 G153 P159I152-S156 WeakPolarHBondContact O-CB 3.37Å; I152-S156 PolarHBondContact O-N 3.48Å; I152-S156 PolarHBondContact O-OG 3.34Å; G153-S156 PolarHBondContact O-OG 3.44Å; S156-P159 VanDerWaalsContact O-CD 3.23Å; S156-P159 WeakPolarHBondContact O-CD 3.43Å
157N96.1Very high95.8Very high5 Ų548.9 Ų48.93%0.02725%0.249CC..Hα-helixtrans-88.3-5176.3-72.8-83.6000113.5Y103 T107 G153 I155 P159 L160Y103-N157 HydrophobicContact CD2-CB 4.19Å; Y103-N157 WeakPolarHBondContact CD2-O 3.28Å; Y103-N157 HydrophobicContact CE2-CB 4.08Å; T107-N157 WeakPolarHBondContact OG1-CB 3.21Å; G153-N157 WeakPolarHBondContact O-CB 3.22Å; G153-N157 PolarHBondContact O-N 3.35Å; G153-N157 VanDerWaalsContact O-N 3.17Å; G153-N157 PolarHBondContact O-ND2 2.76Å; I155-N157 VanDerWaalsContact C-N 3.3Å; I155-N157 PolarHBondContact O-N 3.48Å; N157-P159 VanDerWaalsContact C-N 3.29Å; N157-L160 HydrophobicContact CB-CD1 4.24Å; N157-L160 WeakPolarHBondContact O-CB 3.32Å; N157-L160 PolarHBondContact O-N 3.02Å; N157-L160 VanDerWaalsContact O-N 3.09Å
158S95.1Very high95.4Very high40 Ų4051 Ų5128%0.2826%0.259SS..THydrogen-bonded Turntrans-55.1-30178.8690000115.5I154 I155 L160 L161 F162I154-S158 PolarHBondContact O-N 3.35Å; I155-S158 VanDerWaalsContact O-CB 3.25Å; I155-S158 WeakPolarHBondContact O-CB 3.48Å; I155-S158 PolarHBondContact O-N 3.48Å; I155-S158 VanDerWaalsContact O-N 3.12Å; I155-S158 PolarHBondContact O-OG 2.69Å; S158-L160 PolarHBondContact O-N 3.28Å; S158-L160 VanDerWaalsContact O-N 3.11Å; S158-L161 WeakPolarHBondContact O-CB 3.25Å; S158-L161 PolarHBondContact O-N 3.3Å; S158-F162 WeakPolarHBondContact O-CD2 3.41Å
159P94.5Very high94.9Very high27 Ų2747.7 Ų47.718%0.17524%0.242CC..THydrogen-bonded Turntrans-54.5-30174.2-29.339000114.2S156 N157 L161 F162 V163 I186 F189S156-P159 VanDerWaalsContact O-CD 3.23Å; S156-P159 WeakPolarHBondContact O-CD 3.43Å; N157-P159 VanDerWaalsContact C-N 3.29Å; P159-L161 PolarHBondContact O-N 3.1Å; P159-F162 PolarHBondContact O-N 2.97Å; P159-V163 WeakPolarHBondContact O-CG2 3.38Å; P159-V163 PolarHBondContact O-N 2.88Å; P159-I186 HydrophobicContact CB-CG2 3.78Å; P159-F189 HydrophobicContact CG-CE1 4.38Å
160L93.5Very high94.2Very high3 Ų354.1 Ų54.12%0.01628%0.275CS..Hα-helixtrans-57-35.6175.2-76.3161.7000112.2N106 N157 S158 F162 V163 Q164 M180 T190N106-L160 HydrophobicContact CB-CD1 3.49Å; N106-L160 VanDerWaalsContact CB-CD1 3.49Å; N157-L160 HydrophobicContact CB-CD1 4.24Å; N157-L160 WeakPolarHBondContact O-CB 3.32Å; N157-L160 PolarHBondContact O-N 3.02Å; N157-L160 VanDerWaalsContact O-N 3.09Å; S158-L160 PolarHBondContact O-N 3.28Å; S158-L160 VanDerWaalsContact O-N 3.11Å; L160-F162 PolarHBondContact O-N 3.47Å; L160-V163 PolarHBondContact O-N 2.99Å; L160-Q164 HydrophobicContact CB-CG 4.37Å; L160-Q164 HydrophobicContact CD2-CG 3.9Å; L160-Q164 VanDerWaalsContact O-CB 3.22Å; L160-Q164 WeakPolarHBondContact O-CB 3.49Å; L160-Q164 VanDerWaalsContact O-CG 3.3Å; L160-Q164 WeakPolarHBondContact O-CG 3.31Å; L160-Q164 PolarHBondContact O-N 3.43Å; L160-M180 HydrophobicContact CD2-CE 3.71Å; L160-T190 HydrophobicContact CD2-CG2 3.41Å; L160-T190 VanDerWaalsContact CD2-CG2 3.41Å; L160-T190 HydrophobicContact CG-CG2 3.69Å
161L93.5Very high93.4Very high54 Ų5457.7 Ų57.728%0.28331%0.305SS..Hα-helixtrans-65.6-21.7179.7-62.7173.7000112.8K99 Y103 S158 P159K99-L161 HydrophobicContact CB-CD2 4.2Å; K99-L161 VanDerWaalsContact CD-O 3.29Å; K99-L161 WeakPolarHBondContact CD-O 3.26Å; K99-L161 WeakPolarHBondContact CE-O 3.28Å; K99-L161 PolarHBondContact NZ-O 2.81Å; Y103-L161 HydrophobicContact CD1-CD1 4.5Å; Y103-L161 HydrophobicContact CD1-CD2 4Å; Y103-L161 HydrophobicContact CD1-CG 4.45Å; Y103-L161 HydrophobicContact CD2-CD1 4.12Å; Y103-L161 HydrophobicContact CD2-CD2 4.06Å; Y103-L161 HydrophobicContact CD2-CG 3.78Å; Y103-L161 HydrophobicContact CE1-CD1 4.48Å; Y103-L161 HydrophobicContact CE2-CD1 4.11Å; Y103-L161 HydrophobicContact CE2-CG 4.27Å; Y103-L161 HydrophobicContact CG-CD1 4.31Å; Y103-L161 HydrophobicContact CG-CD2 3.6Å; Y103-L161 HydrophobicContact CG-CG 3.88Å; S158-L161 WeakPolarHBondContact O-CB 3.25Å; S158-L161 PolarHBondContact O-N 3.3Å; P159-L161 PolarHBondContact O-N 3.1Å
162F91.9Very high92.7Very high140 Ų14052.7 Ų52.761%0.61429%0.285SS*.Hα-helixtrans-95-37.8179.4-59-76.6000112.3S158 P159 L160S158-F162 WeakPolarHBondContact O-CD2 3.41Å; P159-F162 PolarHBondContact O-N 2.97Å; L160-F162 PolarHBondContact O-N 3.47Å
163V93.3Very high91.8Very high0 Ų052.9 Ų52.90%028%0.28CS..Hα-helixtrans-90.9-26.1-174.6-59.10000114.5P159 L160 M180 I181 H184 I186 T190P159-V163 WeakPolarHBondContact O-CG2 3.38Å; P159-V163 PolarHBondContact O-N 2.88Å; L160-V163 PolarHBondContact O-N 2.99Å; V163-M180 HydrophobicContact CG2-CG 4.17Å; V163-M180 HydrophobicContact CG2-SD 4.28Å; V163-M180 WeakPolarHBondContact O-CA 3.31Å; V163-I181 PolarHBondContact O-N 3.44Å; V163-H184 HydrophobicContact CG1-CB 4.5Å; V163-I186 HydrophobicContact CG1-CB 3.61Å; V163-I186 HydrophobicContact CG1-CG2 3.55Å; V163-T190 HydrophobicContact CG2-CG2 4.36Å
164Q93.5Very high91Very high7 Ų754 Ų543%0.03329%0.287CS..EExtended strand (participates in β ladder)trans-76.4129.6178-68-72.113.600110.5K99 E102 L160 R179 M180K99-Q164 WeakPolarHBondContact CE-O 3.32Å; K99-Q164 HydrophobicContact CG-CB 4.32Å; K99-Q164 WeakPolarHBondContact CG-O 3.21Å; E102-Q164 HydrophobicContact CB-CG 4.03Å; E102-Q164 HydrophobicContact CG-CG 4.3Å; L160-Q164 HydrophobicContact CB-CG 4.37Å; L160-Q164 HydrophobicContact CD2-CG 3.9Å; L160-Q164 VanDerWaalsContact O-CB 3.22Å; L160-Q164 WeakPolarHBondContact O-CB 3.49Å; L160-Q164 VanDerWaalsContact O-CG 3.3Å; L160-Q164 WeakPolarHBondContact O-CG 3.31Å; L160-Q164 PolarHBondContact O-N 3.43Å; Q164-R179 PolarHBondContact OE1-O 2.8Å; Q164-M180 HydrophobicContact CG-CG 4.41Å
165T93.9Very high90.4Very high20 Ų2054.6 Ų54.612%0.12329%0.291CS..EExtended strand (participates in β ladder)trans-145.2155.7176.2-166.70000111.7K95 M167 R179 I181K95-T165 WeakPolarHBondContact CE-OG1 3.45Å; T165-M167 HydrophobicContact CG2-CE 3.66Å; T165-M167 HydrophobicContact CG2-CG 3.88Å; T165-R179 PolarHBondContact N-O 3.15Å; T165-R179 PolarHBondContact O-N 3.28Å; T165-R179 VanDerWaalsContact O-O 3.05Å; T165-I181 HydrophobicContact CG2-CD1 4.18Å; T165-I181 HydrophobicContact CG2-CG1 3.63Å
166L94.2Very high90.1Very high40 Ų4054.3 Ų54.321%0.20929%0.287CS..EExtended strand (participates in β ladder)trans-77.3124.2169.5-165.868.1000108.5F176L166-F176 HydrophobicContact CD1-CB 3.78Å; L166-F176 HydrophobicContact CD2-CB 4.36Å; L166-F176 HydrophobicContact CD2-CD1 4.08Å; L166-F176 HydrophobicContact CD2-CG 4.24Å; L166-F176 HydrophobicContact CG-CB 4.03Å; L166-F176 HydrophobicContact CG-CD1 4.06Å; L166-F176 HydrophobicContact CG-CG 4.29Å
167M92.2Very high89.9Confident60 Ų6053.7 Ų53.730%0.29628%0.282SS..EExtended strand (participates in β ladder)trans-117.3145.3178.3-63.2-172.5177.600110.4T165 D169 F176 T177 R179 I181T165-M167 HydrophobicContact CG2-CE 3.66Å; T165-M167 HydrophobicContact CG2-CG 3.88Å; M167-D169 PolarHBondContact O-N 2.82Å; M167-F176 CarbonylContact O-C 3.57Å; M167-F176 VanDerWaalsContact O-CA 3.25Å; M167-F176 WeakPolarHBondContact O-CA 3.22Å; M167-T177 PolarHBondContact N-O 2.93Å; M167-T177 PolarHBondContact O-N 3.42Å; M167-R179 HydrophobicContact CE-CB 4.49Å; M167-R179 HydrophobicContact SD-CB 4.03Å; M167-I181 HydrophobicContact CE-CB 4.45Å; M167-I181 HydrophobicContact CE-CG1 4.09Å
168I91.1Very high89.7Confident134 Ų13454.3 Ų54.369%0.68729%0.287SS*.EExtended strand (participates in β ladder)trans-71.8127172.6-58.8171.3000108.2I170 N175 F176I168-I170 HydrophobicContact CG2-CG1 4.39Å; I168-N175 WeakPolarHBondContact CA-O 3.42Å; I168-F176 HydrophobicContact CG1-CD1 4.13Å; I168-F176 HydrophobicContact CG1-CE1 3.76Å
169D87.5Confident89.5Confident23 Ų2358.3 Ų58.312%0.12330%0.295CS..  trans-141.598.1174.9-174.8-10.8000108.4M167 S171 S172 N175 T177 R179M167-D169 PolarHBondContact O-N 2.82Å; D169-S171 PolarHBondContact O-N 3.49Å; D169-S171 WeakPolarHBondContact OD1-CB 3.49Å; D169-S171 PolarHBondContact OD1-N 3.48Å; D169-S171 VanDerWaalsContact OD1-N 3.1Å; D169-S171 PolarHBondContact OD1-OG 3Å; D169-S172 VanDerWaalsContact O-CB 3.27Å; D169-S172 WeakPolarHBondContact O-CB 2.94Å; D169-S172 PolarHBondContact O-N 2.79Å; D169-S172 PolarHBondContact O-OG 3.32Å; D169-N175 CarbonylContact C-O 3.46Å; D169-N175 PolarHBondContact N-O 3.38Å; D169-N175 CarbonylContact O-C 3.6Å; D169-N175 VanDerWaalsContact O-C 3.27Å; D169-N175 VanDerWaalsContact O-CA 3.29Å; D169-N175 WeakPolarHBondContact O-CA 3.36Å; D169-T177 HydrophobicContact CB-CG2 3.88Å; D169-R179 IonicContact OD2-CZ 3.69Å; D169-R179 VanDerWaalsContact OD2-CZ 3.3Å; D169-R179 IonicContact OD2-NH1 2.91Å; D169-R179 PolarHBondContact OD2-NH1 2.9Å; D169-R179 IonicContact OD2-NH2 3.08Å; D169-R179 PolarHBondContact OD2-NH2 3.15Å
170I83.8Confident89.3Confident147 Ų14758.7 Ų58.775%0.75430%0.295SS*.THydrogen-bonded Turntrans-63.8-24.7-176.7-54.1171000111.1I168 S172I168-I170 HydrophobicContact CG2-CG1 4.39Å; I170-S172 PolarHBondContact O-N 3.17Å
171S82.3Confident89.1Confident109 Ų10961.4 Ų61.476%0.76231%0.309SS*.THydrogen-bonded Turntrans-76.4-11.9175.475.20000113D169D169-S171 PolarHBondContact O-N 3.49Å; D169-S171 WeakPolarHBondContact OD1-CB 3.49Å; D169-S171 PolarHBondContact OD1-N 3.48Å; D169-S171 VanDerWaalsContact OD1-N 3.1Å; D169-S171 PolarHBondContact OD1-OG 3Å
172S82.1Confident88.5Confident19 Ų1963.6 Ų63.613%0.13333%0.329CS..SBendtrans-87.8148.4179.7800000112.1D169 I170 T174 N175 F176D169-S172 VanDerWaalsContact O-CB 3.27Å; D169-S172 WeakPolarHBondContact O-CB 2.94Å; D169-S172 PolarHBondContact O-N 2.79Å; D169-S172 PolarHBondContact O-OG 3.32Å; I170-S172 PolarHBondContact O-N 3.17Å; S172-T174 PolarHBondContact O-N 2.94Å; S172-N175 PolarHBondContact O-N 3.46Å; S172-N175 WeakPolarHBondContact OG-CA 3.32Å; S172-N175 PolarHBondContact OG-N 2.95Å; S172-F176 PolarHBondContact OG-N 3.42Å; S172-F176 PolarHBondContact OG-O 3.2Å
173R79.4Confident88Confident91 Ų9165.5 Ų65.534%0.34334%0.34SS..THydrogen-bonded Turntrans-56.6-27-177.6-58.6170.4-67.9165.57.2114.4G75 Y79 Y87G75-R173 PolarHBondContact O-NH2 3.1Å; G75-R173 VanDerWaalsContact O-NH2 3.14Å; Y79-R173 HydrophobicContact CE1-CG 4.27Å; Y79-R173 HydrophobicContact CE2-CG 4.38Å; Y79-R173 WeakPolarHBondContact OH-CD 3.03Å; Y87-R173 PolarHBondContact OH-O 3.15Å
174T82.5Confident87.5Confident24 Ų2468.5 Ų68.515%0.14735%0.354CS..THydrogen-bonded Turntrans-104.73.2-17842.50000112.8Y87 S172 F176Y87-T174 HydrophobicContact CD2-CG2 4.07Å; Y87-T174 HydrophobicContact CE2-CG2 3.29Å; S172-T174 PolarHBondContact O-N 2.94Å; T174-F176 WeakPolarHBondContact O-CD2 3.29Å; T174-F176 PolarHBondContact O-N 3.38Å; T174-F176 PolarHBondContact OG1-O 3.41Å
175N85.7Confident86.9Confident91 Ų9173.1 Ų73.149%0.48738%0.384SS..SBendtrans58.81.4-165.1-57.4-48.1000114.9I168 D169 S172I168-N175 WeakPolarHBondContact CA-O 3.42Å; D169-N175 CarbonylContact C-O 3.46Å; D169-N175 PolarHBondContact N-O 3.38Å; D169-N175 CarbonylContact O-C 3.6Å; D169-N175 VanDerWaalsContact O-C 3.27Å; D169-N175 VanDerWaalsContact O-CA 3.29Å; D169-N175 WeakPolarHBondContact O-CA 3.36Å; S172-N175 PolarHBondContact O-N 3.46Å; S172-N175 WeakPolarHBondContact OG-CA 3.32Å; S172-N175 PolarHBondContact OG-N 2.95Å
176F91Very high86.7Confident82 Ų8275.1 Ų75.136%0.3639%0.394SS..EExtended strand (participates in β ladder)trans-137142.8-177.7-62.7-78.8000111.6T92 L166 M167 I168 S172 T174T92-F176 VanDerWaalsContact CG2-O 3.25Å; T92-F176 WeakPolarHBondContact CG2-O 3.39Å; L166-F176 HydrophobicContact CD1-CB 3.78Å; L166-F176 HydrophobicContact CD2-CB 4.36Å; L166-F176 HydrophobicContact CD2-CD1 4.08Å; L166-F176 HydrophobicContact CD2-CG 4.24Å; L166-F176 HydrophobicContact CG-CB 4.03Å; L166-F176 HydrophobicContact CG-CD1 4.06Å; L166-F176 HydrophobicContact CG-CG 4.29Å; M167-F176 CarbonylContact O-C 3.57Å; M167-F176 VanDerWaalsContact O-CA 3.25Å; M167-F176 WeakPolarHBondContact O-CA 3.22Å; I168-F176 HydrophobicContact CG1-CD1 4.13Å; I168-F176 HydrophobicContact CG1-CE1 3.76Å; S172-F176 PolarHBondContact OG-N 3.42Å; S172-F176 PolarHBondContact OG-O 3.2Å; T174-F176 WeakPolarHBondContact O-CD2 3.29Å; T174-F176 PolarHBondContact O-N 3.38Å; T174-F176 PolarHBondContact OG1-O 3.41Å
177T89.9Confident86.5Confident12 Ų1273.3 Ų73.37%0.07439%0.385CS..EExtended strand (participates in β ladder)trans-130.6138.4171.855.50000111M167 D169 R179M167-T177 PolarHBondContact N-O 2.93Å; M167-T177 PolarHBondContact O-N 3.42Å; D169-T177 HydrophobicContact CB-CG2 3.88Å; T177-R179 PolarHBondContact OG1-NE 3.35Å
178C92.9Very high86.3Confident18 Ų1877.4 Ų77.412%0.12240%0.401CS..EExtended strand (participates in β ladder)trans-80117.6168.7-172.90000108.4D91 C98D91-C178 HydrophobicContact CB-CB 3.98Å; D91-C178 WeakPolarHBondContact OD2-CB 3.48Å; C98-C178 VanDerWaalsContact C-SG 3.59Å; C98-C178 WeakPolarHBondContact CA-SG 3.34Å; C98-C178 HydrophobicContact CB-CB 3.84Å; C98-C178 WeakPolarHBondContact CB-SG 3.46Å; C98-C178 PolarHBondContact O-SG 3.42Å; C98-C178 VanDerWaalsContact SG-CA 3.58Å; C98-C178 WeakPolarHBondContact SG-CB 3.48Å; C98-C178 CovalentContact SG-SG 2.04Å; C98-C178 PolarHBondContact SG-SG 3.17Å
179R91.1Very high86.3Confident123 Ų12376.7 Ų76.746%0.46439%0.393SS..EExtended strand (participates in β ladder)trans-144.9155.1-177.7-67.3-175.8178.2154.58.9110.7Q164 T165 M167 D169 T177Q164-R179 PolarHBondContact OE1-O 2.8Å; T165-R179 PolarHBondContact N-O 3.15Å; T165-R179 PolarHBondContact O-N 3.28Å; T165-R179 VanDerWaalsContact O-O 3.05Å; M167-R179 HydrophobicContact CE-CB 4.49Å; M167-R179 HydrophobicContact SD-CB 4.03Å; D169-R179 IonicContact OD2-CZ 3.69Å; D169-R179 VanDerWaalsContact OD2-CZ 3.3Å; D169-R179 IonicContact OD2-NH1 2.91Å; D169-R179 PolarHBondContact OD2-NH1 2.9Å; D169-R179 IonicContact OD2-NH2 3.08Å; D169-R179 PolarHBondContact OD2-NH2 3.15Å; T177-R179 PolarHBondContact OG1-NE 3.35Å
180M90.1Very high86.5Confident35 Ų3575.9 Ų75.917%0.17239%0.389CS..EExtended strand (participates in β ladder)trans-72.8142.1169.2-60.8-175-166.400110.5L160 V163 Q164 S182 A187 T190 I191L160-M180 HydrophobicContact CD2-CE 3.71Å; V163-M180 HydrophobicContact CG2-CG 4.17Å; V163-M180 HydrophobicContact CG2-SD 4.28Å; V163-M180 WeakPolarHBondContact O-CA 3.31Å; Q164-M180 HydrophobicContact CG-CG 4.41Å; M180-S182 PolarHBondContact O-N 2.97Å; M180-A187 HydrophobicContact CB-CB 4.18Å; M180-T190 HydrophobicContact CE-CG2 3.76Å; M180-T190 HydrophobicContact SD-CG2 4.15Å; M180-I191 HydrophobicContact CE-CG1 4.2Å; M180-I191 HydrophobicContact SD-CD1 4.21Å; M180-I191 HydrophobicContact SD-CG1 3.73Å
181I89.2Confident86.9Confident61 Ų6171.6 Ų71.631%0.31337%0.367SS..  trans-65.5105.1171.4-58165.4000108.6V163 T165 M167 E183 H184 A187V163-I181 PolarHBondContact O-N 3.44Å; T165-I181 HydrophobicContact CG2-CD1 4.18Å; T165-I181 HydrophobicContact CG2-CG1 3.63Å; M167-I181 HydrophobicContact CE-CB 4.45Å; M167-I181 HydrophobicContact CE-CG1 4.09Å; I181-E183 VanDerWaalsContact C-N 3.26Å; I181-E183 PolarHBondContact O-N 3.02Å; I181-H184 HydrophobicContact CB-CB 4.03Å; I181-H184 HydrophobicContact CG2-CB 4.03Å; I181-H184 WeakPolarHBondContact O-CB 2.92Å; I181-H184 PolarHBondContact O-N 2.77Å; I181-A187 VanDerWaalsContact O-CB 3.23Å; I181-A187 WeakPolarHBondContact O-CB 3.41Å
182S80.3Confident87.4Confident99 Ų9967.8 Ų67.869%0.69234%0.342SS*.THydrogen-bonded Turntrans-61.1-31.6-171.949.10000114.2M180 H184M180-S182 PolarHBondContact O-N 2.97Å; S182-H184 VanDerWaalsContact C-N 3.29Å
183E81.5Confident88Confident180 Ų18068.6 Ų68.684%0.84134%0.343SS*.THydrogen-bonded Turntrans-78.5-15.9-179.9-61.5-175.6-174.500112.8I181I181-E183 VanDerWaalsContact C-N 3.26Å; I181-E183 PolarHBondContact O-N 3.02Å
184H83.5Confident88.6Confident63 Ų6366.5 Ų66.529%0.29234%0.337SS..  trans-73.5126.2-177.4-158.8-63.7000109.8V163 I181 S182 I186 A187V163-H184 HydrophobicContact CG1-CB 4.5Å; I181-H184 HydrophobicContact CB-CB 4.03Å; I181-H184 HydrophobicContact CG2-CB 4.03Å; I181-H184 WeakPolarHBondContact O-CB 2.92Å; I181-H184 PolarHBondContact O-N 2.77Å; S182-H184 VanDerWaalsContact C-N 3.29Å; H184-I186 WeakPolarHBondContact CE1-CD1 3.47Å; H184-I186 WeakPolarHBondContact CE1-CG1 3.49Å; H184-I186 VanDerWaalsContact ND1-CB 3.33Å; H184-I186 WeakPolarHBondContact ND1-CB 3.49Å; H184-I186 PolarHBondContact ND1-N 3.44Å; H184-I186 PolarHBondContact O-N 3.37Å; H184-A187 HydrophobicContact CB-CB 4.44Å; H184-A187 VanDerWaalsContact O-CB 3.26Å; H184-A187 WeakPolarHBondContact O-CB 3.32Å; H184-A187 PolarHBondContact O-N 2.83Å
185P81.8Confident89.2Confident104 Ų10465.7 Ų65.768%0.67533%0.332SS*.Hα-helixtrans-58.6-36.7-178.720.9-32.6000112.3A187 K188 F189P185-A187 PolarHBondContact O-N 3.44Å; P185-K188 PolarHBondContact O-N 2.65Å; P185-F189 PolarHBondContact O-N 3.36Å
186I89.4Confident89.7Confident62 Ų6264.8 Ų64.832%0.31833%0.327SS..Hα-helixtrans-59.3-27.8173.9-55.8178.6000112.4P159 V163 H184 K188 F189 T190P159-I186 HydrophobicContact CB-CG2 3.78Å; V163-I186 HydrophobicContact CG1-CB 3.61Å; V163-I186 HydrophobicContact CG1-CG2 3.55Å; H184-I186 WeakPolarHBondContact CE1-CD1 3.47Å; H184-I186 WeakPolarHBondContact CE1-CG1 3.49Å; H184-I186 VanDerWaalsContact ND1-CB 3.33Å; H184-I186 WeakPolarHBondContact ND1-CB 3.49Å; H184-I186 PolarHBondContact ND1-N 3.44Å; H184-I186 PolarHBondContact O-N 3.37Å; I186-K188 PolarHBondContact O-N 3.31Å; I186-F189 CarbonylContact O-C 3.18Å; I186-F189 WeakPolarHBondContact O-CB 3.46Å; I186-F189 PolarHBondContact O-N 3.01Å; I186-T190 WeakPolarHBondContact O-CB 3.31Å; I186-T190 PolarHBondContact O-N 3.44Å; I186-T190 PolarHBondContact O-OG1 2.96Å
187A88.9Confident90.1Very high3 Ų362.5 Ų62.53%0.02532%0.319CS..Hα-helixtrans-63.4-42.1179.700000112.1M180 I181 H184 P185 F189 T190 I191M180-A187 HydrophobicContact CB-CB 4.18Å; I181-A187 VanDerWaalsContact O-CB 3.23Å; I181-A187 WeakPolarHBondContact O-CB 3.41Å; H184-A187 HydrophobicContact CB-CB 4.44Å; H184-A187 VanDerWaalsContact O-CB 3.26Å; H184-A187 WeakPolarHBondContact O-CB 3.32Å; H184-A187 PolarHBondContact O-N 2.83Å; P185-A187 PolarHBondContact O-N 3.44Å; A187-F189 VanDerWaalsContact C-N 3.34Å; A187-T190 PolarHBondContact O-N 3.2Å; A187-I191 VanDerWaalsContact O-CG1 3.3Å; A187-I191 WeakPolarHBondContact O-CG1 3.3Å; A187-I191 PolarHBondContact O-N 3.23Å
188K88.3Confident90.4Very high146 Ų14662 Ų6264%0.63532%0.316SS*.Hα-helixtrans-62.8-42.8174.3-69.6-176.9-179.9179.60111.4P185 I186 A192P185-K188 PolarHBondContact O-N 2.65Å; I186-K188 PolarHBondContact O-N 3.31Å; K188-A192 WeakPolarHBondContact O-CB 3.13Å; K188-A192 PolarHBondContact O-N 2.93Å
189F90.2Very high90.6Very high118 Ų11861.2 Ų61.252%0.51831%0.311SS..Hα-helixtrans-60.2-47.1174.9171.8-96.3000111.5P159 P185 I186 A187 I191 A192 F193P159-F189 HydrophobicContact CG-CE1 4.38Å; P185-F189 PolarHBondContact O-N 3.36Å; I186-F189 CarbonylContact O-C 3.18Å; I186-F189 WeakPolarHBondContact O-CB 3.46Å; I186-F189 PolarHBondContact O-N 3.01Å; A187-F189 VanDerWaalsContact C-N 3.34Å; F189-I191 PolarHBondContact O-N 3.46Å; F189-A192 PolarHBondContact O-N 3.04Å; F189-F193 HydrophobicContact CE1-CB 4.4Å; F189-F193 HydrophobicContact CZ-CB 4.48Å; F189-F193 HydrophobicContact CZ-CD2 4.12Å; F189-F193 VanDerWaalsContact O-CB 3.23Å; F189-F193 WeakPolarHBondContact O-CB 3.27Å; F189-F193 PolarHBondContact O-N 2.92Å
190T92.3Very high90.9Very high7 Ų756.4 Ų56.44%0.04330%0.295CS..Hα-helixtrans-61.6-44.7-179.9-59.70000111.8L160 V163 M180 I186 A187 F193 E194L160-T190 HydrophobicContact CD2-CG2 3.41Å; L160-T190 VanDerWaalsContact CD2-CG2 3.41Å; L160-T190 HydrophobicContact CG-CG2 3.69Å; V163-T190 HydrophobicContact CG2-CG2 4.36Å; M180-T190 HydrophobicContact CE-CG2 3.76Å; M180-T190 HydrophobicContact SD-CG2 4.15Å; I186-T190 WeakPolarHBondContact O-CB 3.31Å; I186-T190 PolarHBondContact O-N 3.44Å; I186-T190 PolarHBondContact O-OG1 2.96Å; A187-T190 PolarHBondContact O-N 3.2Å; T190-F193 PolarHBondContact O-N 3.5Å; T190-E194 WeakPolarHBondContact O-CB 3.37Å; T190-E194 PolarHBondContact O-N 3.27Å
191I91.7Very high91.3Very high56 Ų5657.9 Ų57.929%0.28730%0.303SS..Hα-helixtrans-63-44.1176.9-66.1165.8000110.9M180 A187 F189 T195 L267M180-I191 HydrophobicContact CE-CG1 4.2Å; M180-I191 HydrophobicContact SD-CD1 4.21Å; M180-I191 HydrophobicContact SD-CG1 3.73Å; A187-I191 VanDerWaalsContact O-CG1 3.3Å; A187-I191 WeakPolarHBondContact O-CG1 3.3Å; A187-I191 PolarHBondContact O-N 3.23Å; F189-I191 PolarHBondContact O-N 3.46Å; I191-T195 WeakPolarHBondContact O-CB 3.49Å; I191-T195 PolarHBondContact O-N 2.88Å; I191-T195 PolarHBondContact O-OG1 3.36Å; I191-L267 HydrophobicContact CG2-CD1 4.23Å
192A92.6Very high91.7Very high29 Ų2955 Ų5524%0.2429%0.288CS..Hα-helixtrans-66.1-41177.700000111.6K188 F189 T195 I196K188-A192 WeakPolarHBondContact O-CB 3.13Å; K188-A192 PolarHBondContact O-N 2.93Å; F189-A192 PolarHBondContact O-N 3.04Å; A192-T195 PolarHBondContact O-N 3Å; A192-I196 VanDerWaalsContact O-CB 3.24Å; A192-I196 WeakPolarHBondContact O-CB 3.33Å; A192-I196 WeakPolarHBondContact O-CG1 3.4Å; A192-I196 PolarHBondContact O-N 3.19Å
193F94.6Very high92.6Very high37 Ų3751.3 Ų51.316%0.16226%0.26CS..Hα-helixtrans-62.5-48.7177-177.6-87.7000111.1F110 F189 T190 T195 V197 T198F110-F193 HydrophobicContact CD2-CE1 4.42Å; F110-F193 HydrophobicContact CD2-CZ 4.45Å; F110-F193 HydrophobicContact CE2-CZ 4.18Å; F189-F193 HydrophobicContact CE1-CB 4.4Å; F189-F193 HydrophobicContact CZ-CB 4.48Å; F189-F193 HydrophobicContact CZ-CD2 4.12Å; F189-F193 VanDerWaalsContact O-CB 3.23Å; F189-F193 WeakPolarHBondContact O-CB 3.27Å; F189-F193 PolarHBondContact O-N 2.92Å; T190-F193 PolarHBondContact O-N 3.5Å; F193-T195 PolarHBondContact O-N 3.16Å; F193-V197 HydrophobicContact CD1-CB 4.45Å; F193-V197 HydrophobicContact CD2-CB 3.93Å; F193-V197 HydrophobicContact CD2-CG1 4.38Å; F193-V197 HydrophobicContact CD2-CG2 3.65Å; F193-V197 HydrophobicContact CE1-CB 4.3Å; F193-V197 HydrophobicContact CE1-CG1 4.42Å; F193-V197 HydrophobicContact CE2-CB 3.76Å; F193-V197 HydrophobicContact CE2-CG1 3.71Å; F193-V197 HydrophobicContact CE2-CG2 3.77Å; F193-V197 HydrophobicContact CG-CB 4.25Å; F193-V197 HydrophobicContact CG-CG2 4.25Å; F193-V197 HydrophobicContact CZ-CB 3.93Å; F193-V197 HydrophobicContact CZ-CG1 3.71Å; F193-V197 HydrophobicContact CZ-CG2 4.45Å; F193-V197 VanDerWaalsContact O-CA 3.31Å; F193-V197 WeakPolarHBondContact O-CA 3.33Å; F193-V197 WeakPolarHBondContact O-CB 3.23Å; F193-V197 PolarHBondContact O-N 3.05Å; F193-T198 PolarHBondContact O-N 3Å; F193-T198 VanDerWaalsContact O-N 3.1Å
194E93.6Very high93.4Very high47 Ų4745 Ų4522%0.2224%0.235CC..Iπ-helixtrans-58.8-48.8175.9-173.6-171.8162.500111N106 T190 T198 F199N106-E194 PolarHBondContact OD1-OE1 3.04Å; T190-E194 WeakPolarHBondContact O-CB 3.37Å; T190-E194 PolarHBondContact O-N 3.27Å; E194-T198 WeakPolarHBondContact O-CB 3.34Å; E194-T198 PolarHBondContact O-N 2.83Å; E194-F199 HydrophobicContact CG-CD2 4.23Å; E194-F199 HydrophobicContact CG-CE2 3.64Å; E194-F199 HydrophobicContact CG-CZ 4.44Å; E194-F199 WeakPolarHBondContact O-CD2 3.3Å; E194-F199 PolarHBondContact O-N 3.14Å
195T95Very high94.1Very high6 Ų645.3 Ų45.34%0.03724%0.239CC..Iπ-helixtrans-63.9-51-179.2-58.70000112.5I191 A192 F193 T200 V263 L264 L267I191-T195 WeakPolarHBondContact O-CB 3.49Å; I191-T195 PolarHBondContact O-N 2.88Å; I191-T195 PolarHBondContact O-OG1 3.36Å; A192-T195 PolarHBondContact O-N 3Å; F193-T195 PolarHBondContact O-N 3.16Å; T195-T200 WeakPolarHBondContact O-CB 3.37Å; T195-T200 PolarHBondContact O-N 2.86Å; T195-T200 VanDerWaalsContact O-N 3.07Å; T195-T200 PolarHBondContact O-OG1 3Å; T195-V263 HydrophobicContact CG2-CB 4.44Å; T195-V263 HydrophobicContact CG2-CG1 3.55Å; T195-V263 VanDerWaalsContact OG1-CG1 3.31Å; T195-V263 WeakPolarHBondContact OG1-CG1 3.27Å; T195-L264 HydrophobicContact CG2-CD2 3.89Å; T195-L264 HydrophobicContact CG2-CG 4.46Å; T195-L267 HydrophobicContact CG2-CB 4.05Å; T195-L267 HydrophobicContact CG2-CD2 3.67Å; T195-L267 HydrophobicContact CG2-CG 4.46Å
196I96.5Very high94.9Very high73 Ų7340.4 Ų40.437%0.37421%0.206SC..Iπ-helixtrans-85.5-52.3-169.9-60.9173.8000110.2A192 T200 I201 L267A192-I196 VanDerWaalsContact O-CB 3.24Å; A192-I196 WeakPolarHBondContact O-CB 3.33Å; A192-I196 WeakPolarHBondContact O-CG1 3.4Å; A192-I196 PolarHBondContact O-N 3.19Å; I196-T200 WeakPolarHBondContact O-CB 3.5Å; I196-T200 PolarHBondContact O-N 3.09Å; I196-I201 HydrophobicContact CG2-CD1 3.97Å; I196-I201 HydrophobicContact CG2-CG1 4.23Å; I196-I201 WeakPolarHBondContact O-CB 3.45Å; I196-I201 WeakPolarHBondContact O-CG1 3.32Å; I196-I201 PolarHBondContact O-N 3.19Å; I196-L267 HydrophobicContact CD1-CD2 4.28Å; I196-L267 HydrophobicContact CG1-CD2 4.22Å
197V97.5Very high95.3Very high34 Ų3440.7 Ų40.721%0.20621%0.208CC..Iπ-helixtrans-83-44.7-172.4-1710000111.5F110 Y114 F193 I201 P202F110-V197 HydrophobicContact CE2-CG1 3.98Å; Y114-V197 WeakPolarHBondContact CE2-O 3.41Å; Y114-V197 WeakPolarHBondContact OH-CG1 3.25Å; Y114-V197 PolarHBondContact OH-O 2.82Å; F193-V197 HydrophobicContact CD1-CB 4.45Å; F193-V197 HydrophobicContact CD2-CB 3.93Å; F193-V197 HydrophobicContact CD2-CG1 4.38Å; F193-V197 HydrophobicContact CD2-CG2 3.65Å; F193-V197 HydrophobicContact CE1-CB 4.3Å; F193-V197 HydrophobicContact CE1-CG1 4.42Å; F193-V197 HydrophobicContact CE2-CB 3.76Å; F193-V197 HydrophobicContact CE2-CG1 3.71Å; F193-V197 HydrophobicContact CE2-CG2 3.77Å; F193-V197 HydrophobicContact CG-CB 4.25Å; F193-V197 HydrophobicContact CG-CG2 4.25Å; F193-V197 HydrophobicContact CZ-CB 3.93Å; F193-V197 HydrophobicContact CZ-CG1 3.71Å; F193-V197 HydrophobicContact CZ-CG2 4.45Å; F193-V197 VanDerWaalsContact O-CA 3.31Å; F193-V197 WeakPolarHBondContact O-CA 3.33Å; F193-V197 WeakPolarHBondContact O-CB 3.23Å; F193-V197 PolarHBondContact O-N 3.05Å; V197-I201 HydrophobicContact CG2-CD1 4.31Å; V197-P202 WeakPolarHBondContact O-CD 3.26Å
198T96.8Very high95.8Very high0 Ų046.2 Ų46.20%023%0.232CC..Iπ-helixtrans-76.6-36.4-177.1-59.60000112.9F110 F193 E194 P202F110-T198 HydrophobicContact CB-CG2 4.04Å; F193-T198 PolarHBondContact O-N 3Å; F193-T198 VanDerWaalsContact O-N 3.1Å; E194-T198 WeakPolarHBondContact O-CB 3.34Å; E194-T198 PolarHBondContact O-N 2.83Å; T198-P202 WeakPolarHBondContact O-CG 3.45Å
199F96.6Very high96.2Very high2 Ų240.3 Ų40.31%0.00921%0.207CC..Iπ-helixtrans-108.8-51.4-176-60.7-55.7000114.3Y109 E194 F203 Y256 M259 V260Y109-F199 HydrophobicContact CD2-CE1 4.39Å; Y109-F199 HydrophobicContact CD2-CZ 4.11Å; Y109-F199 HydrophobicContact CG-CE1 4.41Å; E194-F199 HydrophobicContact CG-CD2 4.23Å; E194-F199 HydrophobicContact CG-CE2 3.64Å; E194-F199 HydrophobicContact CG-CZ 4.44Å; E194-F199 WeakPolarHBondContact O-CD2 3.3Å; E194-F199 PolarHBondContact O-N 3.14Å; F199-F203 WeakPolarHBondContact O-CB 3.3Å; F199-F203 PolarHBondContact O-N 3.41Å; F199-Y256 AromaticContact CD1-CE1 3.94Å; F199-Y256 HydrophobicContact CD1-CE1 3.94Å; F199-M259 HydrophobicContact CE2-CE 4.36Å; F199-M259 HydrophobicContact CZ-CE 4.42Å; F199-V260 HydrophobicContact CB-CG2 4.36Å
200T97.9Very high96.6Very high23 Ų2335.1 Ų35.114%0.14119%0.185CC..Iπ-helixtrans-75.2-50-168.3-53.80000113.2T195 I196 F203 C204 V260 L264T195-T200 WeakPolarHBondContact O-CB 3.37Å; T195-T200 PolarHBondContact O-N 2.86Å; T195-T200 VanDerWaalsContact O-N 3.07Å; T195-T200 PolarHBondContact O-OG1 3Å; I196-T200 WeakPolarHBondContact O-CB 3.5Å; I196-T200 PolarHBondContact O-N 3.09Å; T200-F203 WeakPolarHBondContact O-CB 3.36Å; T200-F203 PolarHBondContact O-N 3.11Å; T200-C204 PolarHBondContact O-N 2.79Å; T200-C204 PolarHBondContact O-SG 3Å; T200-C204 VanDerWaalsContact O-SG 3.37Å; T200-V260 HydrophobicContact CG2-CG1 4.18Å; T200-L264 HydrophobicContact CG2-CD1 4.18Å; T200-L264 HydrophobicContact CG2-CD2 4.45Å
201I98.2Very high96.9Very high65 Ų6538.6 Ų38.633%0.33320%0.202SC..Hα-helixtrans-59-52.8-179.5-74.8171.8000112I196 V197 F203 C204 L205I196-I201 HydrophobicContact CG2-CD1 3.97Å; I196-I201 HydrophobicContact CG2-CG1 4.23Å; I196-I201 WeakPolarHBondContact O-CB 3.45Å; I196-I201 WeakPolarHBondContact O-CG1 3.32Å; I196-I201 PolarHBondContact O-N 3.19Å; V197-I201 HydrophobicContact CG2-CD1 4.31Å; I201-F203 VanDerWaalsContact C-N 3.28Å; I201-F203 PolarHBondContact O-N 3.14Å; I201-C204 PolarHBondContact O-N 3.02Å; I201-L205 HydrophobicContact CG2-CD1 3.67Å; I201-L205 HydrophobicContact CG2-CG 4.15Å; I201-L205 WeakPolarHBondContact O-CB 3.37Å; I201-L205 WeakPolarHBondContact O-CG 3.22Å; I201-L205 PolarHBondContact O-N 3.37Å
202P98.3Very high97.2Very high0 Ų041 Ų410%021%0.211CC..Hα-helixtrans-63.8-34.418021.2-31.3000112.2Y114 V117 V197 T198 L205 V206Y114-P202 HydrophobicContact CE2-CB 4.46Å; Y114-P202 HydrophobicContact CE2-CG 4.2Å; V117-P202 HydrophobicContact CG2-CB 3.88Å; V197-P202 WeakPolarHBondContact O-CD 3.26Å; T198-P202 WeakPolarHBondContact O-CG 3.45Å; P202-L205 PolarHBondContact O-N 3.4Å; P202-V206 WeakPolarHBondContact O-CB 3.39Å; P202-V206 WeakPolarHBondContact O-CG2 3.42Å; P202-V206 PolarHBondContact O-N 3.46Å
203F98.5Very high97.3Very high22 Ų2239.7 Ų39.710%0.09620%0.2CC..Hα-helixtrans-57.5-52.3171.4172.9-91.9000111.7F199 T200 I201 L205 V206 L207 L253 L257 V260F199-F203 WeakPolarHBondContact O-CB 3.3Å; F199-F203 PolarHBondContact O-N 3.41Å; T200-F203 WeakPolarHBondContact O-CB 3.36Å; T200-F203 PolarHBondContact O-N 3.11Å; I201-F203 VanDerWaalsContact C-N 3.28Å; I201-F203 PolarHBondContact O-N 3.14Å; F203-L205 PolarHBondContact O-N 2.66Å; F203-V206 PolarHBondContact O-N 3.08Å; F203-L207 HydrophobicContact CE1-CD2 4.47Å; F203-L207 WeakPolarHBondContact O-CB 3.28Å; F203-L207 PolarHBondContact O-N 3.35Å; F203-L253 HydrophobicContact CD2-CD2 3.57Å; F203-L253 HydrophobicContact CE2-CB 4.19Å; F203-L253 HydrophobicContact CE2-CD2 3.55Å; F203-L253 HydrophobicContact CE2-CG 4.49Å; F203-L253 WeakPolarHBondContact CE2-O 3.3Å; F203-L253 HydrophobicContact CG-CD2 4.26Å; F203-L253 HydrophobicContact CZ-CD2 4.21Å; F203-L253 WeakPolarHBondContact O-CD2 3.36Å; F203-L257 HydrophobicContact CE1-CD1 4.37Å; F203-L257 HydrophobicContact CE2-CB 3.93Å; F203-L257 HydrophobicContact CE2-CD1 4.34Å; F203-L257 HydrophobicContact CZ-CB 4.15Å; F203-L257 HydrophobicContact CZ-CD1 3.71Å; F203-V260 HydrophobicContact CB-CG2 3.98Å; F203-V260 HydrophobicContact CD2-CG2 4.41Å; F203-V260 HydrophobicContact CG-CG2 4.09Å
204C98.5Very high97.4Very high49 Ų4940.8 Ų40.833%0.33121%0.212SC..Hα-helixtrans-61.7-45.1178.6-66.90000112T200 I201 L207 F208T200-C204 PolarHBondContact O-N 2.79Å; T200-C204 PolarHBondContact O-SG 3Å; T200-C204 VanDerWaalsContact O-SG 3.37Å; I201-C204 PolarHBondContact O-N 3.02Å; C204-L207 WeakPolarHBondContact O-CB 3.22Å; C204-L207 PolarHBondContact O-N 3.34Å; C204-F208 WeakPolarHBondContact O-CD2 3.41Å; C204-F208 PolarHBondContact O-N 3.44Å
205L98.6Very high97.5Very high69 Ų6942 Ų4236%0.36122%0.218SC..Hα-helixtrans-60.6-47.6179-70.8175.3000111.5V117 I201 P202 F203 L207 F208 L209V117-L205 HydrophobicContact CG1-CB 4.2Å; V117-L205 HydrophobicContact CG1-CD1 4Å; V117-L205 HydrophobicContact CG2-CB 4.05Å; V117-L205 HydrophobicContact CG2-CD1 4.34Å; I201-L205 HydrophobicContact CG2-CD1 3.67Å; I201-L205 HydrophobicContact CG2-CG 4.15Å; I201-L205 WeakPolarHBondContact O-CB 3.37Å; I201-L205 WeakPolarHBondContact O-CG 3.22Å; I201-L205 PolarHBondContact O-N 3.37Å; P202-L205 PolarHBondContact O-N 3.4Å; F203-L205 PolarHBondContact O-N 2.66Å; L205-L207 VanDerWaalsContact C-N 3.3Å; L205-L207 PolarHBondContact O-N 2.92Å; L205-F208 PolarHBondContact O-N 2.92Å; L205-L209 VanDerWaalsContact O-CB 3.29Å; L205-L209 WeakPolarHBondContact O-CB 3.37Å; L205-L209 WeakPolarHBondContact O-CD1 3.43Å; L205-L209 WeakPolarHBondContact O-CG 3.46Å; L205-L209 PolarHBondContact O-N 3.43Å
206V98.6Very high97.4Very high0 Ų043.3 Ų43.30%022%0.224CC..Hα-helixtrans-63-38.7177.5174.50000111I116 V117 P202 F203 L209 N210 F252 L253I116-V206 HydrophobicContact CB-CG2 4.46Å; I116-V206 HydrophobicContact CG2-CG1 4.24Å; I116-V206 HydrophobicContact CG2-CG2 3.75Å; V117-V206 HydrophobicContact CG2-CG2 3.79Å; P202-V206 WeakPolarHBondContact O-CB 3.39Å; P202-V206 WeakPolarHBondContact O-CG2 3.42Å; P202-V206 PolarHBondContact O-N 3.46Å; F203-V206 PolarHBondContact O-N 3.08Å; V206-L209 PolarHBondContact O-N 3.28Å; V206-N210 VanDerWaalsContact O-CB 3.25Å; V206-N210 WeakPolarHBondContact O-CB 3.19Å; V206-N210 VanDerWaalsContact O-CG 3.31Å; V206-N210 PolarHBondContact O-N 3.38Å; V206-F252 HydrophobicContact CB-CD1 4.31Å; V206-F252 HydrophobicContact CB-CE1 4.13Å; V206-F252 HydrophobicContact CG1-CD1 4.07Å; V206-F252 HydrophobicContact CG1-CE1 4.39Å; V206-F252 HydrophobicContact CG2-CD1 4.36Å; V206-F252 HydrophobicContact CG2-CE1 4Å; V206-L253 HydrophobicContact CB-CD2 4.15Å; V206-L253 HydrophobicContact CG1-CD1 4.17Å; V206-L253 HydrophobicContact CG1-CD2 4.03Å; V206-L253 HydrophobicContact CG1-CG 3.96Å
207L98.5Very high97.2Very high68 Ų6841 Ų4136%0.35621%0.213SC..Hα-helixtrans-59.7-53176.1-179.565.8000111.5F203 C204 L205 N210 I211 L253F203-L207 HydrophobicContact CE1-CD2 4.47Å; F203-L207 WeakPolarHBondContact O-CB 3.28Å; F203-L207 PolarHBondContact O-N 3.35Å; C204-L207 WeakPolarHBondContact O-CB 3.22Å; C204-L207 PolarHBondContact O-N 3.34Å; L205-L207 VanDerWaalsContact C-N 3.3Å; L205-L207 PolarHBondContact O-N 2.92Å; L207-N210 PolarHBondContact O-N 3.33Å; L207-I211 HydrophobicContact CD1-CD1 4.46Å; L207-I211 HydrophobicContact CG-CD1 4.24Å; L207-I211 WeakPolarHBondContact O-CG1 3.25Å; L207-I211 PolarHBondContact O-N 3.44Å; L207-L253 HydrophobicContact CB-CD1 4.39Å; L207-L253 HydrophobicContact CB-CD2 3.97Å; L207-L253 HydrophobicContact CD1-CD1 4.08Å
208F98.3Very high96.9Very high120 Ų12047.5 Ų47.553%0.52623%0.234SC..Hα-helixtrans-63.9-42.9179-73.9-65.7000112.2C204 L205 N210 I211 F212C204-F208 WeakPolarHBondContact O-CD2 3.41Å; C204-F208 PolarHBondContact O-N 3.44Å; L205-F208 PolarHBondContact O-N 2.92Å; F208-N210 VanDerWaalsContact C-N 3.32Å; F208-N210 PolarHBondContact O-N 2.91Å; F208-I211 WeakPolarHBondContact O-CB 3.43Å; F208-I211 PolarHBondContact O-N 3.45Å; F208-F212 HydrophobicContact CB-CE2 4.33Å; F208-F212 WeakPolarHBondContact O-CD2 3.46Å; F208-F212 PolarHBondContact O-N 3.2Å
209L98.3Very high96.6Very high22 Ų2251.9 Ų51.912%0.11525%0.253CS..Hα-helixtrans-62.1-40.3177.6-70.4166.6000111.6V117 I121 L124 L205 V206 F212 I213V117-L209 HydrophobicContact CG1-CD1 4.16Å; I121-L209 HydrophobicContact CD1-CD1 4.5Å; I121-L209 HydrophobicContact CG1-CD1 3.71Å; I121-L209 HydrophobicContact CG1-CD2 3.89Å; I121-L209 HydrophobicContact CG1-CG 4.49Å; L124-L209 HydrophobicContact CD2-CD2 4.02Å; L205-L209 VanDerWaalsContact O-CB 3.29Å; L205-L209 WeakPolarHBondContact O-CB 3.37Å; L205-L209 WeakPolarHBondContact O-CD1 3.43Å; L205-L209 WeakPolarHBondContact O-CG 3.46Å; L205-L209 PolarHBondContact O-N 3.43Å; V206-L209 PolarHBondContact O-N 3.28Å; L209-F212 PolarHBondContact O-N 3.06Å; L209-I213 WeakPolarHBondContact O-CB 3.37Å; L209-I213 VanDerWaalsContact O-CG1 3.23Å; L209-I213 WeakPolarHBondContact O-CG1 3.3Å; L209-I213 PolarHBondContact O-N 2.89Å
210N98.1Very high96.1Very high9 Ų954.3 Ų54.35%0.04827%0.265CS..Hα-helixtrans-66.1-38.7175.3-80.8-4.4000112.5V206 L207 F208 I213 C214 L246 S249V206-N210 VanDerWaalsContact O-CB 3.25Å; V206-N210 WeakPolarHBondContact O-CB 3.19Å; V206-N210 VanDerWaalsContact O-CG 3.31Å; V206-N210 PolarHBondContact O-N 3.38Å; L207-N210 PolarHBondContact O-N 3.33Å; F208-N210 VanDerWaalsContact C-N 3.32Å; F208-N210 PolarHBondContact O-N 2.91Å; N210-I213 PolarHBondContact O-N 2.9Å; N210-C214 WeakPolarHBondContact O-CB 3.38Å; N210-C214 PolarHBondContact O-N 3.26Å; N210-C214 PolarHBondContact O-SG 3.4Å; N210-L246 HydrophobicContact CB-CD1 4.05Å; N210-S249 VanDerWaalsContact ND2-CB 3.34Å; N210-S249 WeakPolarHBondContact ND2-CB 3.35Å; N210-S249 PolarHBondContact ND2-OG 2.92Å; N210-S249 PolarHBondContact OD1-OG 3.11Å
211I98Very high95.5Very high79 Ų7960.9 Ų60.941%0.40529%0.292SS..Hα-helixtrans-59.7-48.2172.7-68.5164.8000110.1L207 F208 I213 C214 I215L207-I211 HydrophobicContact CD1-CD1 4.46Å; L207-I211 HydrophobicContact CG-CD1 4.24Å; L207-I211 WeakPolarHBondContact O-CG1 3.25Å; L207-I211 PolarHBondContact O-N 3.44Å; F208-I211 WeakPolarHBondContact O-CB 3.43Å; F208-I211 PolarHBondContact O-N 3.45Å; I211-I213 PolarHBondContact O-N 2.83Å; I211-C214 WeakPolarHBondContact O-CB 3.34Å; I211-C214 PolarHBondContact O-N 3.45Å; I211-I215 HydrophobicContact CG2-CD1 3.84Å; I211-I215 HydrophobicContact CG2-CG1 4.49Å; I211-I215 WeakPolarHBondContact O-CG1 3.44Å; I211-I215 PolarHBondContact O-N 3Å
212F97.5Very high95Very high108 Ų10861.4 Ų61.447%0.47430%0.298SS..Hα-helixtrans-63-41.2177.5-68.8-53.7000112.6L124 F208 L209 C214 I215 E216L124-F212 HydrophobicContact CD1-CB 3.9Å; L124-F212 HydrophobicContact CD2-CB 3.92Å; F208-F212 HydrophobicContact CB-CE2 4.33Å; F208-F212 WeakPolarHBondContact O-CD2 3.46Å; F208-F212 PolarHBondContact O-N 3.2Å; L209-F212 PolarHBondContact O-N 3.06Å; F212-C214 VanDerWaalsContact C-N 3.32Å; F212-C214 PolarHBondContact O-N 3.23Å; F212-I215 HydrophobicContact CD1-CD1 4.45Å; F212-I215 PolarHBondContact O-N 3.05Å; F212-E216 WeakPolarHBondContact O-CG 3.28Å; F212-E216 PolarHBondContact O-N 2.82Å
213I96Very high94.2Very high1 Ų168 Ų681%0.00533%0.328CS..Hα-helixtrans-57.2-46.8173.5-73.8166000110.2R123 L124 I127 L209 N210 I211 E216 L217 V242 L246R123-I213 HydrophobicContact CB-CD1 4.06Å; L124-I213 HydrophobicContact CB-CG1 4.03Å; L124-I213 HydrophobicContact CD1-CG1 4.13Å; I127-I213 HydrophobicContact CD1-CB 4.41Å; I127-I213 HydrophobicContact CD1-CG1 4.32Å; I127-I213 HydrophobicContact CD1-CG2 3.72Å; L209-I213 WeakPolarHBondContact O-CB 3.37Å; L209-I213 VanDerWaalsContact O-CG1 3.23Å; L209-I213 WeakPolarHBondContact O-CG1 3.3Å; L209-I213 PolarHBondContact O-N 2.89Å; N210-I213 PolarHBondContact O-N 2.9Å; I211-I213 PolarHBondContact O-N 2.83Å; I213-E216 PolarHBondContact O-N 2.81Å; I213-L217 HydrophobicContact CG2-CD1 3.92Å; I213-L217 HydrophobicContact CG2-CG 4.4Å; I213-L217 WeakPolarHBondContact O-CB 3.39Å; I213-L217 VanDerWaalsContact O-CG 3.26Å; I213-L217 WeakPolarHBondContact O-CG 3.37Å; I213-L217 PolarHBondContact O-N 2.83Å; I213-V242 HydrophobicContact CG2-CG1 4.37Å; I213-L246 HydrophobicContact CG2-CD1 4.39Å
214C96.6Very high93Very high60 Ų6072.2 Ų72.241%0.40534%0.344SS..Hα-helixtrans-62.7-42.6178.2-72.60000112.7N210 I211 F212 L217 W218N210-C214 WeakPolarHBondContact O-CB 3.38Å; N210-C214 PolarHBondContact O-N 3.26Å; N210-C214 PolarHBondContact O-SG 3.4Å; I211-C214 WeakPolarHBondContact O-CB 3.34Å; I211-C214 PolarHBondContact O-N 3.45Å; F212-C214 VanDerWaalsContact C-N 3.32Å; F212-C214 PolarHBondContact O-N 3.23Å; C214-L217 PolarHBondContact O-N 3.45Å; C214-W218 WeakPolarHBondContact O-CB 3.23Å; C214-W218 PolarHBondContact O-N 2.92Å
215I95.4Very high91Very high71 Ų7176 Ų7636%0.36437%0.365SS..Hα-helixtrans-61.4-47.7176.5-69.3166.8000110.7I211 F212 W218 K219I211-I215 HydrophobicContact CG2-CD1 3.84Å; I211-I215 HydrophobicContact CG2-CG1 4.49Å; I211-I215 WeakPolarHBondContact O-CG1 3.44Å; I211-I215 PolarHBondContact O-N 3Å; F212-I215 HydrophobicContact CD1-CD1 4.45Å; F212-I215 PolarHBondContact O-N 3.05Å; I215-W218 WeakPolarHBondContact O-CB 3.39Å; I215-W218 PolarHBondContact O-N 3.23Å; I215-K219 HydrophobicContact CG2-CD 4.45Å; I215-K219 WeakPolarHBondContact O-CG 3.34Å; I215-K219 PolarHBondContact O-N 2.68Å
216E91.8Very high88.7Confident34 Ų3476.5 Ų76.516%0.15938%0.38CS..Hα-helixtrans-67.2-37.6-179.8-67.4-63.8111.800111.7L124 I127 H128 F212 I213 W218 K219 L220L124-E216 HydrophobicContact CD1-CG 4Å; I127-E216 HydrophobicContact CG2-CB 3.73Å; H128-E216 IonicContact CE1-OE2 3.92Å; H128-E216 IonicContact CG-OE2 3.96Å; H128-E216 IonicContact ND1-OE2 2.98Å; H128-E216 PolarHBondContact ND1-OE2 3.25Å; F212-E216 WeakPolarHBondContact O-CG 3.28Å; F212-E216 PolarHBondContact O-N 2.82Å; I213-E216 PolarHBondContact O-N 2.81Å; E216-W218 VanDerWaalsContact C-N 3.32Å; E216-W218 PolarHBondContact O-N 3.19Å; E216-K219 PolarHBondContact O-N 3.12Å; E216-K219 WeakPolarHBondContact OE1-CD 3.37Å; E216-K219 IonicContact OE1-NZ 2.75Å; E216-K219 PolarHBondContact OE1-NZ 3.34Å; E216-L220 WeakPolarHBondContact O-CB 3.4Å; E216-L220 WeakPolarHBondContact O-CG 3.49Å; E216-L220 PolarHBondContact O-N 3.05Å
217L92.4Very high86.4Confident25 Ų2582.7 Ų82.713%0.13141%0.412CS..Hα-helixtrans-62-39.5171.8-75.5175.3000112.2I127 I213 C214 L220 K221 M239 V242I127-L217 HydrophobicContact CD1-CD2 4.2Å; I127-L217 HydrophobicContact CD1-CG 4.2Å; I127-L217 HydrophobicContact CG2-CD2 4.41Å; I213-L217 HydrophobicContact CG2-CD1 3.92Å; I213-L217 HydrophobicContact CG2-CG 4.4Å; I213-L217 WeakPolarHBondContact O-CB 3.39Å; I213-L217 VanDerWaalsContact O-CG 3.26Å; I213-L217 WeakPolarHBondContact O-CG 3.37Å; I213-L217 PolarHBondContact O-N 2.83Å; C214-L217 PolarHBondContact O-N 3.45Å; L217-L220 PolarHBondContact O-N 3.5Å; L217-K221 WeakPolarHBondContact O-CB 3.37Å; L217-K221 PolarHBondContact O-N 3.32Å; L217-M239 HydrophobicContact CD2-CE 4.08Å; L217-M239 HydrophobicContact CD2-SD 3.91Å; L217-V242 HydrophobicContact CD1-CG1 3.95Å; L217-V242 HydrophobicContact CD2-CG1 4.17Å; L217-V242 HydrophobicContact CG-CG1 4.48Å
218W91.4Very high84.2Confident171 Ų17186.4 Ų86.465%0.64843%0.432SS*.Hα-helixtrans-65.6-46176.4-178.279.3000111.5C214 I215 E216 L220 K221 V222C214-W218 WeakPolarHBondContact O-CB 3.23Å; C214-W218 PolarHBondContact O-N 2.92Å; I215-W218 WeakPolarHBondContact O-CB 3.39Å; I215-W218 PolarHBondContact O-N 3.23Å; E216-W218 VanDerWaalsContact C-N 3.32Å; E216-W218 PolarHBondContact O-N 3.19Å; W218-L220 VanDerWaalsContact C-N 3.34Å; W218-L220 PolarHBondContact O-N 3.21Å; W218-K221 WeakPolarHBondContact O-CB 3.26Å; W218-K221 PolarHBondContact O-N 3.43Å; W218-K221 VanDerWaalsContact O-N 3.13Å; W218-V222 HydrophobicContact CD2-CG2 4.24Å; W218-V222 HydrophobicContact CZ2-CG2 4.09Å; W218-V222 WeakPolarHBondContact O-CG2 3.41Å; W218-V222 PolarHBondContact O-N 2.86Å
219K90.5Very high82.2Confident92 Ų9286 Ų8640%0.444%0.441SS..Hα-helixtrans-56.6-47.3173.7-70.3176.4-173.8168.20111.6I215 E216 K221 V222 H223I215-K219 HydrophobicContact CG2-CD 4.45Å; I215-K219 WeakPolarHBondContact O-CG 3.34Å; I215-K219 PolarHBondContact O-N 2.68Å; E216-K219 PolarHBondContact O-N 3.12Å; E216-K219 WeakPolarHBondContact OE1-CD 3.37Å; E216-K219 IonicContact OE1-NZ 2.75Å; E216-K219 PolarHBondContact OE1-NZ 3.34Å; K219-K221 VanDerWaalsContact C-N 3.32Å; K219-K221 PolarHBondContact O-N 3.25Å; K219-V222 PolarHBondContact O-N 3.42Å; K219-H223 PolarHBondContact O-N 2.79Å; K219-H223 PolarHBondContact O-ND1 2.93Å
220L86.1Confident80.1Confident52 Ų5289.1 Ų89.127%0.27247%0.47SS..Hα-helixtrans-60.6-40.4176.5-75.3178.3000112.2I127 E216 L217 W218 H223 R224I127-L220 HydrophobicContact CG2-CD1 3.52Å; E216-L220 WeakPolarHBondContact O-CB 3.4Å; E216-L220 WeakPolarHBondContact O-CG 3.49Å; E216-L220 PolarHBondContact O-N 3.05Å; L217-L220 PolarHBondContact O-N 3.5Å; W218-L220 VanDerWaalsContact C-N 3.34Å; W218-L220 PolarHBondContact O-N 3.21Å; L220-H223 PolarHBondContact O-N 3.33Å; L220-R224 WeakPolarHBondContact O-CB 3.26Å; L220-R224 VanDerWaalsContact O-CG 3.29Å; L220-R224 WeakPolarHBondContact O-CG 3.45Å; L220-R224 PolarHBondContact O-N 3.17Å
221K86.1Confident78.7Confident161 Ų16192 Ų9270%0.749%0.485SS*.Hα-helixtrans-62.2-44.9176.5-174.9-178.1-176.9-173.70111.2L217 W218 K219 T225L217-K221 WeakPolarHBondContact O-CB 3.37Å; L217-K221 PolarHBondContact O-N 3.32Å; W218-K221 WeakPolarHBondContact O-CB 3.26Å; W218-K221 PolarHBondContact O-N 3.43Å; W218-K221 VanDerWaalsContact O-N 3.13Å; K219-K221 VanDerWaalsContact C-N 3.32Å; K219-K221 PolarHBondContact O-N 3.25Å; K221-T225 PolarHBondContact O-OG1 2.67Å
222V86.8Confident77.5Confident76 Ų7691.5 Ų91.546%0.46149%0.488SS..Hα-helixtrans-63.2-44.9178.6173.50000111W218 K219 T225W218-V222 HydrophobicContact CD2-CG2 4.24Å; W218-V222 HydrophobicContact CZ2-CG2 4.09Å; W218-V222 WeakPolarHBondContact O-CG2 3.41Å; W218-V222 PolarHBondContact O-N 2.86Å; K219-V222 PolarHBondContact O-N 3.42Å; V222-T225 PolarHBondContact O-OG1 2.95Å
223H82.5Confident76.6Confident138 Ų13890.9 Ų90.964%0.63950%0.497SS*.Hα-helixtrans-81-31.2-174.8-67.649000113.4K219 L220 T225 A226K219-H223 PolarHBondContact O-N 2.79Å; K219-H223 PolarHBondContact O-ND1 2.93Å; L220-H223 PolarHBondContact O-N 3.33Å; H223-T225 VanDerWaalsContact C-N 3.25Å; H223-T225 PolarHBondContact O-N 3.09Å; H223-A226 PolarHBondContact O-N 3.01Å
224R72.3Confident75.7Confident112 Ų11295.4 Ų95.442%0.42351%0.514SS..Hα-helixtrans-70.2-17.3179.3-82.4-171169.7-177.6-1.9114L220 A226 L227L220-R224 WeakPolarHBondContact O-CB 3.26Å; L220-R224 VanDerWaalsContact O-CG 3.29Å; L220-R224 WeakPolarHBondContact O-CG 3.45Å; L220-R224 PolarHBondContact O-N 3.17Å; R224-A226 PolarHBondContact O-N 3.37Å; R224-L227 PolarHBondContact O-N 2.82Å
225T56.1Low74.9Confident127 Ų12795.2 Ų95.278%0.77951%0.509SS*.THydrogen-bonded Turntrans-56.2-16.3170.3-28.50000111.9K221 V222 H223K221-T225 PolarHBondContact O-OG1 2.67Å; V222-T225 PolarHBondContact O-OG1 2.95Å; H223-T225 VanDerWaalsContact C-N 3.25Å; H223-T225 PolarHBondContact O-N 3.09Å
226A52Low74.4Confident80 Ų8099.9 Ų99.966%0.66152%0.522SS*.THydrogen-bonded Turntrans-99.8-22.9-17900000116.7H223 R224H223-A226 PolarHBondContact O-N 3.01Å; R224-A226 PolarHBondContact O-N 3.37Å
227L50.3Low74.1Confident131 Ų131101.5 Ų101.569%0.68653%0.53SS*.SBendtrans-147.7112.9-163.7-72.7165.3000116.1R224R224-L227 PolarHBondContact O-N 2.82Å
228L52Low73.9Confident146 Ų146101.3 Ų101.376%0.76453%0.529SS*.  trans85.9128.6140.8-75.2153.7000123.2
229P54.9Low73.8Confident111 Ų11195.6 Ų95.672%0.72151%0.51SS*.  trans-94.5-2.6178.81.319.5000117.6D231P229-D231 VanDerWaalsContact C-N 3.27Å; P229-D231 PolarHBondContact O-N 2.9Å
230A55.1Low73.9Confident87 Ų8792 Ų9272%0.71950%0.499SS*.THydrogen-bonded Turntrans-65.3-14.8-158.500000117.1
231D67.7Low74.3Confident69 Ų6989.9 Ų89.937%0.36949%0.488SS..THydrogen-bonded Turntrans-136.344.9-179.2-84.4-49.7000113.5P229 S233 R234 N235P229-D231 VanDerWaalsContact C-N 3.27Å; P229-D231 PolarHBondContact O-N 2.9Å; D231-S233 VanDerWaalsContact C-N 3.35Å; D231-S233 PolarHBondContact O-N 3.43Å; D231-R234 HydrophobicContact CB-CB 4.43Å; D231-R234 PolarHBondContact O-N 3.31Å; D231-R234 IonicContact OD1-NE 2.73Å; D231-R234 IonicContact OD2-CZ 3.65Å; D231-R234 IonicContact OD2-NE 3.06Å; D231-R234 IonicContact OD2-NH2 2.65Å; D231-R234 PolarHBondContact OD2-NH2 3.13Å; D231-N235 VanDerWaalsContact O-CB 3.31Å; D231-N235 WeakPolarHBondContact O-CB 3.44Å; D231-N235 PolarHBondContact O-N 3.38Å
232C74.7Confident74.6Confident70 Ų7082.6 Ų82.647%0.47346%0.456SS..Hα-helixtrans-55.9-42.9-174.1-169.30000113.8R236C232-R236 VanDerWaalsContact O-CB 3.25Å; C232-R236 WeakPolarHBondContact O-CB 3.33Å; C232-R236 PolarHBondContact O-N 2.93Å; C232-R236 PolarHBondContact SG-NH2 3.44Å
233S78Confident75Confident95 Ų9583.4 Ų83.466%0.66445%0.454SS*.Hα-helixtrans-67.4-46.1-177.4620000112.3D231 R236 M237D231-S233 VanDerWaalsContact C-N 3.35Å; D231-S233 PolarHBondContact O-N 3.43Å; S233-R236 PolarHBondContact O-N 3.27Å; S233-M237 PolarHBondContact O-N 3.1Å; S233-M237 VanDerWaalsContact O-N 3.09Å
234R75.9Confident75.7Confident95 Ų9576.9 Ų76.936%0.35842%0.424SS..Hα-helixtrans-63.6-48.5177.1-178.4170.969.9156.10.3111.3Y134 D231 R236 M237 E238Y134-R234 HydrophobicContact CE2-CG 3.8Å; Y134-R234 WeakPolarHBondContact OH-CD 3.16Å; D231-R234 HydrophobicContact CB-CB 4.43Å; D231-R234 PolarHBondContact O-N 3.31Å; D231-R234 IonicContact OD1-NE 2.73Å; D231-R234 IonicContact OD2-CZ 3.65Å; D231-R234 IonicContact OD2-NE 3.06Å; D231-R234 IonicContact OD2-NH2 2.65Å; D231-R234 PolarHBondContact OD2-NH2 3.13Å; R234-R236 VanDerWaalsContact C-N 3.26Å; R234-R236 PolarHBondContact O-N 2.99Å; R234-M237 PolarHBondContact O-N 3.26Å; R234-M237 VanDerWaalsContact O-N 3.16Å; R234-E238 PolarHBondContact O-N 3.49Å
235N80.1Confident76.9Confident56 Ų5671.6 Ų71.630%0.29940%0.404SS..Hα-helixtrans-59.7-38176.8-78.6-20000112D231 M239D231-N235 VanDerWaalsContact O-CB 3.31Å; D231-N235 WeakPolarHBondContact O-CB 3.44Å; D231-N235 PolarHBondContact O-N 3.38Å; N235-M239 WeakPolarHBondContact O-CB 3.34Å; N235-M239 PolarHBondContact O-N 2.85Å
236R85.2Confident78.8Confident169 Ų16966.9 Ų66.964%0.63837%0.374SS*.Hα-helixtrans-66.9-37.9177.1-169.4-179.1-57.5-93.1-0.7112.5C232 S233 R234 G240C232-R236 VanDerWaalsContact O-CB 3.25Å; C232-R236 WeakPolarHBondContact O-CB 3.33Å; C232-R236 PolarHBondContact O-N 2.93Å; C232-R236 PolarHBondContact SG-NH2 3.44Å; S233-R236 PolarHBondContact O-N 3.27Å; R234-R236 VanDerWaalsContact C-N 3.26Å; R234-R236 PolarHBondContact O-N 2.99Å; R236-G240 PolarHBondContact O-N 3.17Å
237M85.9Confident81Confident68 Ų6864 Ų6434%0.33535%0.35SS..Hα-helixtrans-66.9-47.8177-171.5-171.3-47.100111.7S233 R234 M239 G240 R241 N312S233-M237 PolarHBondContact O-N 3.1Å; S233-M237 VanDerWaalsContact O-N 3.09Å; R234-M237 PolarHBondContact O-N 3.26Å; R234-M237 VanDerWaalsContact O-N 3.16Å; M237-M239 VanDerWaalsContact C-N 3.31Å; M237-M239 PolarHBondContact O-N 2.9Å; M237-G240 PolarHBondContact O-N 3.33Å; M237-R241 PolarHBondContact O-N 3.41Å; M237-N312 PolarHBondContact SD-ND2 3.43Å
238E87.3Confident83.3Confident21 Ų2157.8 Ų57.810%0.09832%0.318CS..Hα-helixtrans-63.6-38.8176-68-55.9127.500111.4Y134 S135 R234 R241 V242Y134-E238 HydrophobicContact CD2-CG 4.41Å; Y134-E238 HydrophobicContact CE2-CG 3.97Å; S135-E238 WeakPolarHBondContact CB-OE1 3.35Å; S135-E238 VanDerWaalsContact CB-OE2 3.32Å; S135-E238 WeakPolarHBondContact CB-OE2 3.27Å; R234-E238 PolarHBondContact O-N 3.49Å; E238-R241 WeakPolarHBondContact O-CB 3.5Å; E238-R241 PolarHBondContact O-N 2.86Å; E238-R241 IonicContact OE1-CZ 3.14Å; E238-R241 IonicContact OE1-NH1 3.91Å; E238-R241 PolarHBondContact OE1-NH1 3.39Å; E238-V242 WeakPolarHBondContact O-CG2 3.37Å; E238-V242 PolarHBondContact O-N 3.22Å
239M90Very high85.5Confident51 Ų5150.9 Ų50.925%0.25128%0.281SS..Hα-helixtrans-65.3-40.6175.8-168.858.567.400112.1L217 N235 M237 R241 V242 F243L217-M239 HydrophobicContact CD2-CE 4.08Å; L217-M239 HydrophobicContact CD2-SD 3.91Å; N235-M239 WeakPolarHBondContact O-CB 3.34Å; N235-M239 PolarHBondContact O-N 2.85Å; M237-M239 VanDerWaalsContact C-N 3.31Å; M237-M239 PolarHBondContact O-N 2.9Å; M239-R241 VanDerWaalsContact C-N 3.29Å; M239-R241 PolarHBondContact O-N 3.11Å; M239-V242 PolarHBondContact O-N 3.23Å; M239-F243 HydrophobicContact CG-CD2 3.63Å; M239-F243 HydrophobicContact CG-CE2 3.35Å; M239-F243 HydrophobicContact CG-CZ 4.46Å; M239-F243 WeakPolarHBondContact O-CD2 3.38Å; M239-F243 PolarHBondContact O-N 2.88Å; M239-F243 HydrophobicContact SD-CD2 3.94Å; M239-F243 HydrophobicContact SD-CE2 3.46Å; M239-F243 WeakPolarHBondContact SD-CE2 3.43Å; M239-F243 HydrophobicContact SD-CZ 4.09Å
240G92.4Very high87.5Confident16 Ų1648.2 Ų48.217%0.16526%0.263CS..Hα-helixtrans-61.8-3617300000112.9R236 M237 G244R236-G240 PolarHBondContact O-N 3.17Å; M237-G240 PolarHBondContact O-N 3.33Å; G240-G244 PolarHBondContact O-N 2.73Å
241R94Very high89.6Confident9 Ų945 Ų453%0.03424%0.237CC..Hα-helixtrans-65.1-42.7172.5-79.1176.9175.81561.3112.4E43 S47 F49 M237 E238 M239 H245 L310E43-R241 IonicContact OE1-CZ 3.44Å; E43-R241 IonicContact OE1-NH2 3.71Å; E43-R241 PolarHBondContact OE1-NH2 2.96Å; S47-R241 PolarHBondContact OG-NH2 3.5Å; F49-R241 HydrophobicContact CB-CG 4.26Å; F49-R241 HydrophobicContact CD2-CB 3.52Å; F49-R241 HydrophobicContact CD2-CG 3.5Å; F49-R241 VanDerWaalsContact CD2-CG 3.5Å; F49-R241 HydrophobicContact CE2-CB 3.95Å; F49-R241 HydrophobicContact CE2-CG 4.07Å; F49-R241 WeakPolarHBondContact CE2-O 3.38Å; F49-R241 HydrophobicContact CG-CB 4.34Å; F49-R241 HydrophobicContact CG-CG 3.84Å; M237-R241 PolarHBondContact O-N 3.41Å; E238-R241 WeakPolarHBondContact O-CB 3.5Å; E238-R241 PolarHBondContact O-N 2.86Å; E238-R241 IonicContact OE1-CZ 3.14Å; E238-R241 IonicContact OE1-NH1 3.91Å; E238-R241 PolarHBondContact OE1-NH1 3.39Å; M239-R241 VanDerWaalsContact C-N 3.29Å; M239-R241 PolarHBondContact O-N 3.11Å; R241-H245 WeakPolarHBondContact O-CB 3.39Å; R241-H245 PolarHBondContact O-N 3.31Å; R241-L310 HydrophobicContact CB-CD2 4.26Å; R241-L310 HydrophobicContact CG-CD2 3.55Å
242V93.7Very high91Very high8 Ų841.8 Ų41.85%0.04822%0.219CC..Hα-helixtrans-63.8-49.7175.1170.30000111I127 I213 L217 E238 M239 G244 H245 L246I127-V242 HydrophobicContact CD1-CB 4.45Å; I127-V242 HydrophobicContact CD1-CG1 3.56Å; I127-V242 HydrophobicContact CD1-CG2 3.97Å; I127-V242 HydrophobicContact CG1-CG1 4.27Å; I127-V242 HydrophobicContact CG1-CG2 3.82Å; I213-V242 HydrophobicContact CG2-CG1 4.37Å; L217-V242 HydrophobicContact CD1-CG1 3.95Å; L217-V242 HydrophobicContact CD2-CG1 4.17Å; L217-V242 HydrophobicContact CG-CG1 4.48Å; E238-V242 WeakPolarHBondContact O-CG2 3.37Å; E238-V242 PolarHBondContact O-N 3.22Å; M239-V242 PolarHBondContact O-N 3.23Å; V242-G244 PolarHBondContact O-N 3.42Å; V242-H245 PolarHBondContact O-N 2.9Å; V242-L246 WeakPolarHBondContact O-CB 3.42Å; V242-L246 PolarHBondContact O-N 3.23Å
243F95.6Very high92.2Very high93 Ų9339.3 Ų39.341%0.40820%0.201SC..Hα-helixtrans-64.6-39.2178.5-76.8-61.2000112.9M239 H245 L246 A247 F309M239-F243 HydrophobicContact CG-CD2 3.63Å; M239-F243 HydrophobicContact CG-CE2 3.35Å; M239-F243 HydrophobicContact CG-CZ 4.46Å; M239-F243 WeakPolarHBondContact O-CD2 3.38Å; M239-F243 PolarHBondContact O-N 2.88Å; M239-F243 HydrophobicContact SD-CD2 3.94Å; M239-F243 HydrophobicContact SD-CE2 3.46Å; M239-F243 WeakPolarHBondContact SD-CE2 3.43Å; M239-F243 HydrophobicContact SD-CZ 4.09Å; F243-H245 VanDerWaalsContact C-N 3.34Å; F243-H245 PolarHBondContact O-N 3.26Å; F243-L246 PolarHBondContact O-N 3.44Å; F243-A247 WeakPolarHBondContact O-CB 3.39Å; F243-A247 PolarHBondContact O-N 2.79Å; F243-F309 HydrophobicContact CB-CD1 3.88Å; F243-F309 HydrophobicContact CB-CE1 4.38Å
244G96.3Very high93.1Very high0 Ų040.6 Ų40.60%020%0.2CC..Hα-helixtrans-62.7-40.6175.200000112.5G240 V242 A247 L248G240-G244 PolarHBondContact O-N 2.73Å; V242-G244 PolarHBondContact O-N 3.42Å; G244-A247 PolarHBondContact O-N 2.64Å; G244-L248 PolarHBondContact O-N 2.87Å; G244-L248 VanDerWaalsContact O-N 3.07Å
245H96.8Very high94.2Very high1 Ų137.6 Ų37.61%0.00519%0.191CC..Hα-helixtrans-66.5-42.7172174.2-82.1000112.3F119 S120 R123 R241 V242 F243 A247 L248 S249F119-H245 AromaticContact CD1-CD2 3.66Å; F119-H245 AromaticContact CD2-CD2 3.94Å; F119-H245 AromaticContact CG-CD2 3.52Å; F119-H245 AromaticContact CG-NE2 3.93Å; S120-H245 WeakPolarHBondContact CA-CE1 3.41Å; S120-H245 WeakPolarHBondContact CA-NE2 3.3Å; S120-H245 PolarHBondContact N-NE2 3.41Å; S120-H245 PolarHBondContact OG-CE1 3.11Å; S120-H245 PolarHBondContact OG-NE2 3.46Å; R123-H245 HydrophobicContact CG-CB 3.83Å; R123-H245 VanDerWaalsContact CG-CG 3.5Å; R241-H245 WeakPolarHBondContact O-CB 3.39Å; R241-H245 PolarHBondContact O-N 3.31Å; V242-H245 PolarHBondContact O-N 2.9Å; F243-H245 VanDerWaalsContact C-N 3.34Å; F243-H245 PolarHBondContact O-N 3.26Å; H245-A247 VanDerWaalsContact C-N 3.26Å; H245-A247 PolarHBondContact O-N 3.41Å; H245-L248 HydrophobicContact CB-CD2 4.46Å; H245-L248 WeakPolarHBondContact O-CG 3.35Å; H245-L248 PolarHBondContact O-N 2.99Å; H245-S249 WeakPolarHBondContact O-CB 3.49Å; H245-S249 PolarHBondContact O-N 3.38Å; H245-S249 PolarHBondContact O-OG 2.84Å
246L97.6Very high95Very high28 Ų2835 Ų3515%0.14718%0.177CC..Hα-helixtrans-62.5-38.2177.9-172.162.9000110.9N210 I213 V242 F243 S249 T250N210-L246 HydrophobicContact CB-CD1 4.05Å; I213-L246 HydrophobicContact CG2-CD1 4.39Å; V242-L246 WeakPolarHBondContact O-CB 3.42Å; V242-L246 PolarHBondContact O-N 3.23Å; F243-L246 PolarHBondContact O-N 3.44Å; L246-S249 WeakPolarHBondContact CA-OG 3.26Å; L246-S249 PolarHBondContact O-OG 3.43Å; L246-S249 VanDerWaalsContact O-OG 3.09Å; L246-T250 WeakPolarHBondContact O-CB 3.23Å; L246-T250 PolarHBondContact O-N 2.66Å; L246-T250 PolarHBondContact O-OG1 2.84Å
247A98.1Very high95.6Very high20 Ų2030.9 Ų30.917%0.16517%0.167CC..Hα-helixtrans-65.5-45.5175.900000112.4F243 G244 H245 T250 A251 L305 F309F243-A247 WeakPolarHBondContact O-CB 3.39Å; F243-A247 PolarHBondContact O-N 2.79Å; G244-A247 PolarHBondContact O-N 2.64Å; H245-A247 VanDerWaalsContact C-N 3.26Å; H245-A247 PolarHBondContact O-N 3.41Å; A247-T250 PolarHBondContact O-N 3.06Å; A247-A251 WeakPolarHBondContact O-CB 3.46Å; A247-A251 PolarHBondContact O-N 3.32Å; A247-L305 HydrophobicContact CB-CD2 4.22Å; A247-F309 HydrophobicContact CB-CD2 3.69Å; A247-F309 HydrophobicContact CB-CE2 3.23Å; A247-F309 HydrophobicContact CB-CZ 3.76Å
248L97.6Very high96.1Very high1 Ų129.2 Ų29.21%0.00516%0.161CC..Hα-helixtrans-65.8-4317985.486.7000111.8L56 I116 F119 G244 H245 A251 F252 L305 Y306L56-L248 HydrophobicContact CD2-CD1 4.29Å; I116-L248 HydrophobicContact CD1-CD1 4.27Å; I116-L248 HydrophobicContact CG1-CD1 4.05Å; I116-L248 HydrophobicContact CG2-CD1 4.28Å; F119-L248 HydrophobicContact CE1-CD2 4.35Å; G244-L248 PolarHBondContact O-N 2.87Å; G244-L248 VanDerWaalsContact O-N 3.07Å; H245-L248 HydrophobicContact CB-CD2 4.46Å; H245-L248 WeakPolarHBondContact O-CG 3.35Å; H245-L248 PolarHBondContact O-N 2.99Å; L248-A251 PolarHBondContact O-N 3.07Å; L248-F252 PolarHBondContact O-N 3.46Å; L248-L305 HydrophobicContact CB-CD1 3.97Å; L248-Y306 HydrophobicContact CD2-CE1 3.91Å
249S98Very high96.5Very high0 Ų028.6 Ų28.60%016%0.159CC..Hα-helixtrans-70.7-32.7179.255.20000111.7N210 H245 L246 F252 L253N210-S249 VanDerWaalsContact ND2-CB 3.34Å; N210-S249 WeakPolarHBondContact ND2-CB 3.35Å; N210-S249 PolarHBondContact ND2-OG 2.92Å; N210-S249 PolarHBondContact OD1-OG 3.11Å; H245-S249 WeakPolarHBondContact O-CB 3.49Å; H245-S249 PolarHBondContact O-N 3.38Å; H245-S249 PolarHBondContact O-OG 2.84Å; L246-S249 WeakPolarHBondContact CA-OG 3.26Å; L246-S249 PolarHBondContact O-OG 3.43Å; L246-S249 VanDerWaalsContact O-OG 3.09Å; S249-F252 WeakPolarHBondContact O-CB 3.32Å; S249-F252 PolarHBondContact O-N 3.18Å; S249-L253 VanDerWaalsContact O-CG 3.28Å; S249-L253 WeakPolarHBondContact O-CG 3.08Å; S249-L253 PolarHBondContact O-N 3.2Å
250T98.3Very high96.9Very high56 Ų5626.5 Ų26.534%0.34415%0.149SC..Hα-helixtrans-67.1-42.7170.8-58.60000111.4L246 A247 F252 L253 L254L246-T250 WeakPolarHBondContact O-CB 3.23Å; L246-T250 PolarHBondContact O-N 2.66Å; L246-T250 PolarHBondContact O-OG1 2.84Å; A247-T250 PolarHBondContact O-N 3.06Å; T250-F252 VanDerWaalsContact C-N 3.31Å; T250-F252 PolarHBondContact O-N 3.02Å; T250-L253 PolarHBondContact O-N 3.07Å; T250-L254 HydrophobicContact CG2-CD1 4.08Å; T250-L254 HydrophobicContact CG2-CG 4.31Å; T250-L254 WeakPolarHBondContact O-CG 3.34Å; T250-L254 PolarHBondContact O-N 3.27Å
251A98.3Very high97.1Very high20 Ų2028.6 Ų28.617%0.16516%0.16CC..Hα-helixtrans-60.6-42.9174.300000111.4A247 L248 L254 L255 V301 L305A247-A251 WeakPolarHBondContact O-CB 3.46Å; A247-A251 PolarHBondContact O-N 3.32Å; L248-A251 PolarHBondContact O-N 3.07Å; A251-L254 PolarHBondContact O-N 3.09Å; A251-L255 WeakPolarHBondContact O-CB 3.5Å; A251-L255 WeakPolarHBondContact O-CG 3.22Å; A251-L255 PolarHBondContact O-N 3.33Å; A251-V301 HydrophobicContact CB-CG2 4.24Å; A251-L305 HydrophobicContact CB-CD1 4.23Å
252F98.3Very high97.2Very high1 Ų130 Ų300%0.00417%0.166CC..Hα-helixtrans-54.7-52.9171.3168.9-93.7000111.1I116 V206 L248 S249 T250 L254 L255 Y256 T298I116-F252 HydrophobicContact CD1-CB 4.14Å; I116-F252 HydrophobicContact CD1-CD2 3.59Å; I116-F252 HydrophobicContact CD1-CE2 4.11Å; I116-F252 HydrophobicContact CD1-CG 3.9Å; V206-F252 HydrophobicContact CB-CD1 4.31Å; V206-F252 HydrophobicContact CB-CE1 4.13Å; V206-F252 HydrophobicContact CG1-CD1 4.07Å; V206-F252 HydrophobicContact CG1-CE1 4.39Å; V206-F252 HydrophobicContact CG2-CD1 4.36Å; V206-F252 HydrophobicContact CG2-CE1 4Å; L248-F252 PolarHBondContact O-N 3.46Å; S249-F252 WeakPolarHBondContact O-CB 3.32Å; S249-F252 PolarHBondContact O-N 3.18Å; T250-F252 VanDerWaalsContact C-N 3.31Å; T250-F252 PolarHBondContact O-N 3.02Å; F252-L254 PolarHBondContact O-N 2.93Å; F252-L255 PolarHBondContact O-N 3.37Å; F252-Y256 HydrophobicContact CD2-CD1 4.36Å; F252-Y256 AromaticContact CD2-CD2 3.63Å; F252-Y256 HydrophobicContact CD2-CD2 3.63Å; F252-Y256 HydrophobicContact CD2-CE1 4.29Å; F252-Y256 AromaticContact CD2-CE2 3.57Å; F252-Y256 HydrophobicContact CD2-CE2 3.57Å; F252-Y256 HydrophobicContact CD2-CG 4.05Å; F252-Y256 AromaticContact CD2-CZ 3.92Å; F252-Y256 HydrophobicContact CE1-CD1 4.4Å; F252-Y256 HydrophobicContact CE1-CG 4.46Å; F252-Y256 AromaticContact CE2-CD1 3.6Å; F252-Y256 HydrophobicContact CE2-CD1 3.6Å; F252-Y256 AromaticContact CE2-CD2 3.67Å; F252-Y256 HydrophobicContact CE2-CD2 3.67Å; F252-Y256 AromaticContact CE2-CE1 3.35Å; F252-Y256 HydrophobicContact CE2-CE1 3.35Å; F252-Y256 AromaticContact CE2-CE2 3.46Å; F252-Y256 HydrophobicContact CE2-CE2 3.46Å; F252-Y256 VanDerWaalsContact CE2-CE2 3.46Å; F252-Y256 AromaticContact CE2-CG 3.75Å; F252-Y256 HydrophobicContact CE2-CG 3.75Å; F252-Y256 AromaticContact CE2-CZ 3.28Å; F252-Y256 HydrophobicContact CG-CD2 4.3Å; F252-Y256 AromaticContact CZ-CD1 3.6Å; F252-Y256 HydrophobicContact CZ-CD1 3.6Å; F252-Y256 HydrophobicContact CZ-CD2 4.34Å; F252-Y256 AromaticContact CZ-CE1 3.66Å; F252-Y256 HydrophobicContact CZ-CE1 3.66Å; F252-Y256 HydrophobicContact CZ-CE2 4.42Å; F252-Y256 AromaticContact CZ-CG 3.95Å; F252-Y256 HydrophobicContact CZ-CG 3.95Å; F252-Y256 WeakPolarHBondContact O-CB 3.12Å; F252-Y256 PolarHBondContact O-N 2.89Å; F252-T298 WeakPolarHBondContact CA-OG1 3.12Å
253L98.5Very high97.2Very high18 Ų1830.2 Ų30.29%0.09417%0.168CC..Hα-helixtrans-59.2-47.1179.5-70.1171.6000112.4F203 V206 L207 S249 T250 L255 Y256 L257F203-L253 HydrophobicContact CD2-CD2 3.57Å; F203-L253 HydrophobicContact CE2-CB 4.19Å; F203-L253 HydrophobicContact CE2-CD2 3.55Å; F203-L253 HydrophobicContact CE2-CG 4.49Å; F203-L253 WeakPolarHBondContact CE2-O 3.3Å; F203-L253 HydrophobicContact CG-CD2 4.26Å; F203-L253 HydrophobicContact CZ-CD2 4.21Å; F203-L253 WeakPolarHBondContact O-CD2 3.36Å; V206-L253 HydrophobicContact CB-CD2 4.15Å; V206-L253 HydrophobicContact CG1-CD1 4.17Å; V206-L253 HydrophobicContact CG1-CD2 4.03Å; V206-L253 HydrophobicContact CG1-CG 3.96Å; L207-L253 HydrophobicContact CB-CD1 4.39Å; L207-L253 HydrophobicContact CB-CD2 3.97Å; L207-L253 HydrophobicContact CD1-CD1 4.08Å; S249-L253 VanDerWaalsContact O-CG 3.28Å; S249-L253 WeakPolarHBondContact O-CG 3.08Å; S249-L253 PolarHBondContact O-N 3.2Å; T250-L253 PolarHBondContact O-N 3.07Å; L253-L255 VanDerWaalsContact C-N 3.34Å; L253-L255 PolarHBondContact O-N 3.48Å; L253-Y256 PolarHBondContact O-N 3.29Å; L253-L257 WeakPolarHBondContact O-CB 3.38Å; L253-L257 PolarHBondContact O-N 3.43Å
254L98.2Very high97.2Very high121 Ų12129 Ų2963%0.63417%0.165SC*.Hα-helixtrans-63.1-40.6-178.6-69.8174.4000112.2T250 A251 F252 P258T250-L254 HydrophobicContact CG2-CD1 4.08Å; T250-L254 HydrophobicContact CG2-CG 4.31Å; T250-L254 WeakPolarHBondContact O-CG 3.34Å; T250-L254 PolarHBondContact O-N 3.27Å; A251-L254 PolarHBondContact O-N 3.09Å; F252-L254 PolarHBondContact O-N 2.93Å; L254-P258 VanDerWaalsContact O-CD 3.28Å; L254-P258 WeakPolarHBondContact O-CD 3.24Å
255L97.6Very high97.1Very high33 Ų3332.3 Ų32.317%0.17318%0.182CC..Hα-helixtrans-80.5-31-178.6-69.4168.2000112.7A251 F252 L253 V294 I297A251-L255 WeakPolarHBondContact O-CB 3.5Å; A251-L255 WeakPolarHBondContact O-CG 3.22Å; A251-L255 PolarHBondContact O-N 3.33Å; F252-L255 PolarHBondContact O-N 3.37Å; L253-L255 VanDerWaalsContact C-N 3.34Å; L253-L255 PolarHBondContact O-N 3.48Å; L255-V294 HydrophobicContact CD2-CG1 4.2Å; L255-I297 HydrophobicContact CD1-CB 3.92Å; L255-I297 HydrophobicContact CD1-CG2 3.89Å; L255-I297 HydrophobicContact CD2-CB 4.28Å; L255-I297 HydrophobicContact CD2-CG2 4.49Å
256Y97.5Very high96.8Very high0 Ų036.8 Ų36.80%020%0.199CC..Hα-helixtrans-80.3-31.3176.5-91.6-124.8000113.1S113 F199 F252 L253 M259 V260 K295 T298 Y299S113-Y256 PolarHBondContact OG-OH 3.08Å; F199-Y256 AromaticContact CD1-CE1 3.94Å; F199-Y256 HydrophobicContact CD1-CE1 3.94Å; F252-Y256 HydrophobicContact CD2-CD1 4.36Å; F252-Y256 AromaticContact CD2-CD2 3.63Å; F252-Y256 HydrophobicContact CD2-CD2 3.63Å; F252-Y256 HydrophobicContact CD2-CE1 4.29Å; F252-Y256 AromaticContact CD2-CE2 3.57Å; F252-Y256 HydrophobicContact CD2-CE2 3.57Å; F252-Y256 HydrophobicContact CD2-CG 4.05Å; F252-Y256 AromaticContact CD2-CZ 3.92Å; F252-Y256 HydrophobicContact CE1-CD1 4.4Å; F252-Y256 HydrophobicContact CE1-CG 4.46Å; F252-Y256 AromaticContact CE2-CD1 3.6Å; F252-Y256 HydrophobicContact CE2-CD1 3.6Å; F252-Y256 AromaticContact CE2-CD2 3.67Å; F252-Y256 HydrophobicContact CE2-CD2 3.67Å; F252-Y256 AromaticContact CE2-CE1 3.35Å; F252-Y256 HydrophobicContact CE2-CE1 3.35Å; F252-Y256 AromaticContact CE2-CE2 3.46Å; F252-Y256 HydrophobicContact CE2-CE2 3.46Å; F252-Y256 VanDerWaalsContact CE2-CE2 3.46Å; F252-Y256 AromaticContact CE2-CG 3.75Å; F252-Y256 HydrophobicContact CE2-CG 3.75Å; F252-Y256 AromaticContact CE2-CZ 3.28Å; F252-Y256 HydrophobicContact CG-CD2 4.3Å; F252-Y256 AromaticContact CZ-CD1 3.6Å; F252-Y256 HydrophobicContact CZ-CD1 3.6Å; F252-Y256 HydrophobicContact CZ-CD2 4.34Å; F252-Y256 AromaticContact CZ-CE1 3.66Å; F252-Y256 HydrophobicContact CZ-CE1 3.66Å; F252-Y256 HydrophobicContact CZ-CE2 4.42Å; F252-Y256 AromaticContact CZ-CG 3.95Å; F252-Y256 HydrophobicContact CZ-CG 3.95Å; F252-Y256 WeakPolarHBondContact O-CB 3.12Å; F252-Y256 PolarHBondContact O-N 2.89Å; L253-Y256 PolarHBondContact O-N 3.29Å; Y256-M259 CarbonylContact O-C 3.27Å; Y256-M259 WeakPolarHBondContact O-CA 3.31Å; Y256-M259 WeakPolarHBondContact O-CB 3.28Å; Y256-M259 PolarHBondContact O-N 3.42Å; Y256-V260 WeakPolarHBondContact O-CG2 3.42Å; Y256-V260 PolarHBondContact O-N 3.47Å; Y256-K295 HydrophobicContact CD2-CB 4.21Å; Y256-K295 HydrophobicContact CE2-CB 4.24Å; Y256-K295 HydrophobicContact CE2-CD 4.27Å; Y256-T298 HydrophobicContact CD2-CG2 4.32Å; Y256-T298 HydrophobicContact CE2-CG2 3.75Å; Y256-Y299 PolarHBondContact OH-OH 2.83Å
257L97.8Very high96.5Very high84 Ų8436.5 Ų36.544%0.4420%0.197SC..Hα-helixtrans-48.5-55.3-177.2174.264.1000113.2F203 L253 M259 V260 C261F203-L257 HydrophobicContact CE1-CD1 4.37Å; F203-L257 HydrophobicContact CE2-CB 3.93Å; F203-L257 HydrophobicContact CE2-CD1 4.34Å; F203-L257 HydrophobicContact CZ-CB 4.15Å; F203-L257 HydrophobicContact CZ-CD1 3.71Å; L253-L257 WeakPolarHBondContact O-CB 3.38Å; L253-L257 PolarHBondContact O-N 3.43Å; L257-M259 VanDerWaalsContact C-N 3.33Å; L257-M259 PolarHBondContact O-N 2.93Å; L257-V260 PolarHBondContact O-N 2.89Å; L257-C261 PolarHBondContact O-N 3.17Å; L257-C261 VanDerWaalsContact O-N 3.1Å; L257-C261 PolarHBondContact O-SG 3.49Å
258P97.1Very high96.2Very high32 Ų3238.2 Ų38.221%0.20821%0.208CC..Hα-helixtrans-63.8-40.1178.925.8-34.5000111.7L254 V260 C261 F262 F291L254-P258 VanDerWaalsContact O-CD 3.28Å; L254-P258 WeakPolarHBondContact O-CD 3.24Å; P258-V260 PolarHBondContact O-N 3.17Å; P258-C261 PolarHBondContact O-N 3.01Å; P258-F262 VanDerWaalsContact O-CD2 3.24Å; P258-F262 WeakPolarHBondContact O-CD2 3.31Å; P258-F262 PolarHBondContact O-N 2.88Å; P258-F291 HydrophobicContact CB-CB 4.45Å; P258-F291 HydrophobicContact CB-CD1 3.54Å; P258-F291 HydrophobicContact CB-CD2 4.12Å; P258-F291 HydrophobicContact CB-CE1 3.69Å; P258-F291 HydrophobicContact CB-CE2 4.26Å; P258-F291 HydrophobicContact CB-CG 3.78Å; P258-F291 HydrophobicContact CB-CZ 4.05Å; P258-F291 HydrophobicContact CG-CD1 3.62Å; P258-F291 HydrophobicContact CG-CE1 3.94Å; P258-F291 HydrophobicContact CG-CG 4.21Å
259M95.9Very high95.8Very high9 Ų939.3 Ų39.34%0.04421%0.214CC..Hα-helixtrans-58.1-49.6176.8177.363.2170.100111.8F199 Y256 L257 C261 F262 V263 F291 S292 K295F199-M259 HydrophobicContact CE2-CE 4.36Å; F199-M259 HydrophobicContact CZ-CE 4.42Å; Y256-M259 CarbonylContact O-C 3.27Å; Y256-M259 WeakPolarHBondContact O-CA 3.31Å; Y256-M259 WeakPolarHBondContact O-CB 3.28Å; Y256-M259 PolarHBondContact O-N 3.42Å; L257-M259 VanDerWaalsContact C-N 3.33Å; L257-M259 PolarHBondContact O-N 2.93Å; M259-C261 VanDerWaalsContact C-N 3.34Å; M259-C261 PolarHBondContact O-N 3.45Å; M259-F262 PolarHBondContact O-N 2.84Å; M259-V263 HydrophobicContact CE-CG2 3.38Å; M259-V263 HydrophobicContact CG-CG2 4.18Å; M259-V263 VanDerWaalsContact O-CG2 3.3Å; M259-V263 WeakPolarHBondContact O-CG2 3.39Å; M259-V263 PolarHBondContact O-N 2.9Å; M259-V263 HydrophobicContact SD-CG2 3.59Å; M259-V263 VanDerWaalsContact SD-CG2 3.59Å; M259-F291 HydrophobicContact CB-CB 4.32Å; M259-S292 VanDerWaalsContact SD-CA 3.55Å; M259-S292 PolarHBondContact SD-N 3Å; M259-K295 HydrophobicContact CG-CD 4.07Å
260V96.9Very high95.2Very high7 Ų743 Ų434%0.04224%0.236CC..Hα-helixtrans-59.1-46.1179.8171.50000110.5F199 T200 F203 Y256 L257 P258 F262 V263 L264F199-V260 HydrophobicContact CB-CG2 4.36Å; T200-V260 HydrophobicContact CG2-CG1 4.18Å; F203-V260 HydrophobicContact CB-CG2 3.98Å; F203-V260 HydrophobicContact CD2-CG2 4.41Å; F203-V260 HydrophobicContact CG-CG2 4.09Å; Y256-V260 WeakPolarHBondContact O-CG2 3.42Å; Y256-V260 PolarHBondContact O-N 3.47Å; L257-V260 PolarHBondContact O-N 2.89Å; P258-V260 PolarHBondContact O-N 3.17Å; V260-F262 PolarHBondContact O-N 3.34Å; V260-V263 PolarHBondContact O-N 3.38Å; V260-L264 HydrophobicContact CG1-CD1 3.81Å; V260-L264 HydrophobicContact CG1-CG 4.4Å; V260-L264 WeakPolarHBondContact O-CB 3.46Å; V260-L264 VanDerWaalsContact O-CG 3.27Å; V260-L264 WeakPolarHBondContact O-CG 3.48Å; V260-L264 PolarHBondContact O-N 3.44Å
261C97.2Very high94.6Very high59 Ų5946 Ų4640%0.39925%0.25SC..Hα-helixtrans-56.9-50.5175.9-67.80000111.9L257 P258 M259 L264 I265L257-C261 PolarHBondContact O-N 3.17Å; L257-C261 VanDerWaalsContact O-N 3.1Å; L257-C261 PolarHBondContact O-SG 3.49Å; P258-C261 PolarHBondContact O-N 3.01Å; M259-C261 VanDerWaalsContact C-N 3.34Å; M259-C261 PolarHBondContact O-N 3.45Å; C261-L264 PolarHBondContact O-N 3.26Å; C261-I265 VanDerWaalsContact O-CG1 3.25Å; C261-I265 WeakPolarHBondContact O-CG1 3.36Å; C261-I265 PolarHBondContact O-N 2.8Å
262F95.8Very high94.2Very high38 Ų3849.2 Ų49.217%0.16727%0.27CS..Hα-helixtrans-69.3-36.1-177.4-83.1-78.8000113.2P258 M259 V260 I265 R266 I284 L287 F291P258-F262 VanDerWaalsContact O-CD2 3.24Å; P258-F262 WeakPolarHBondContact O-CD2 3.31Å; P258-F262 PolarHBondContact O-N 2.88Å; M259-F262 PolarHBondContact O-N 2.84Å; V260-F262 PolarHBondContact O-N 3.34Å; F262-I265 PolarHBondContact O-N 3.4Å; F262-R266 WeakPolarHBondContact O-CB 3.45Å; F262-R266 WeakPolarHBondContact O-CG 3.49Å; F262-R266 PolarHBondContact O-N 3.33Å; F262-I284 HydrophobicContact CD1-CD1 4.09Å; F262-I284 HydrophobicContact CD1-CG2 4.34Å; F262-I284 HydrophobicContact CE1-CD1 3.71Å; F262-L287 HydrophobicContact CD1-CB 3.85Å; F262-L287 HydrophobicContact CE1-CB 3.46Å; F262-L287 VanDerWaalsContact CE1-CB 3.46Å; F262-L287 HydrophobicContact CE1-CD1 3.64Å; F262-L287 HydrophobicContact CE1-CG 4.2Å; F262-L287 HydrophobicContact CE2-CB 4.36Å; F262-L287 HydrophobicContact CG-CB 4.46Å; F262-L287 HydrophobicContact CZ-CB 3.77Å; F262-L287 HydrophobicContact CZ-CD1 3.69Å; F262-L287 HydrophobicContact CZ-CG 4.28Å; F262-F291 AromaticContact CD2-CD2 3.4Å; F262-F291 HydrophobicContact CD2-CD2 3.4Å; F262-F291 AromaticContact CD2-CE2 3.72Å; F262-F291 HydrophobicContact CD2-CE2 3.72Å; F262-F291 HydrophobicContact CD2-CG 4.4Å; F262-F291 AromaticContact CE2-CD2 3.54Å; F262-F291 HydrophobicContact CE2-CD2 3.54Å; F262-F291 AromaticContact CE2-CE2 3.31Å; F262-F291 HydrophobicContact CE2-CE2 3.31Å; F262-F291 HydrophobicContact CE2-CZ 4.38Å; F262-F291 HydrophobicContact CG-CD2 4.27Å; F262-F291 HydrophobicContact CZ-CD2 4.46Å; F262-F291 HydrophobicContact CZ-CE2 4.09Å
263V93.7Very high93.5Very high13 Ų1356.6 Ų56.68%0.07931%0.305CS..Hα-helixtrans-69.7-38.3176.4-179.30000111T195 M259 V260 R266 L267T195-V263 HydrophobicContact CG2-CB 4.44Å; T195-V263 HydrophobicContact CG2-CG1 3.55Å; T195-V263 VanDerWaalsContact OG1-CG1 3.31Å; T195-V263 WeakPolarHBondContact OG1-CG1 3.27Å; M259-V263 HydrophobicContact CE-CG2 3.38Å; M259-V263 HydrophobicContact CG-CG2 4.18Å; M259-V263 VanDerWaalsContact O-CG2 3.3Å; M259-V263 WeakPolarHBondContact O-CG2 3.39Å; M259-V263 PolarHBondContact O-N 2.9Å; M259-V263 HydrophobicContact SD-CG2 3.59Å; M259-V263 VanDerWaalsContact SD-CG2 3.59Å; V260-V263 PolarHBondContact O-N 3.38Å; V263-R266 PolarHBondContact O-N 2.95Å; V263-L267 WeakPolarHBondContact O-CB 3.43Å; V263-L267 PolarHBondContact O-N 3.37Å
264L95.8Very high92.7Very high69 Ų6957.4 Ų57.436%0.36131%0.311SS..Hα-helixtrans-63.5-42.1173.1-73.5171.4000112.1T195 T200 V260 C261 R266 L267 S268T195-L264 HydrophobicContact CG2-CD2 3.89Å; T195-L264 HydrophobicContact CG2-CG 4.46Å; T200-L264 HydrophobicContact CG2-CD1 4.18Å; T200-L264 HydrophobicContact CG2-CD2 4.45Å; V260-L264 HydrophobicContact CG1-CD1 3.81Å; V260-L264 HydrophobicContact CG1-CG 4.4Å; V260-L264 WeakPolarHBondContact O-CB 3.46Å; V260-L264 VanDerWaalsContact O-CG 3.27Å; V260-L264 WeakPolarHBondContact O-CG 3.48Å; V260-L264 PolarHBondContact O-N 3.44Å; C261-L264 PolarHBondContact O-N 3.26Å; L264-R266 VanDerWaalsContact C-N 3.33Å; L264-R266 PolarHBondContact O-N 2.88Å; L264-L267 PolarHBondContact O-N 3.27Å; L264-S268 PolarHBondContact O-N 2.99Å
265I94.6Very high91.9Very high68 Ų6855.5 Ų55.535%0.34930%0.301SS..Hα-helixtrans-60.5-45.1173.3-66.4165000109.8C261 F262 L267 S268 Q269 I284C261-I265 VanDerWaalsContact O-CG1 3.25Å; C261-I265 WeakPolarHBondContact O-CG1 3.36Å; C261-I265 PolarHBondContact O-N 2.8Å; F262-I265 PolarHBondContact O-N 3.4Å; I265-L267 VanDerWaalsContact C-N 3.35Å; I265-L267 PolarHBondContact O-N 3.34Å; I265-S268 PolarHBondContact O-N 3.36Å; I265-S268 PolarHBondContact O-OG 2.76Å; I265-Q269 WeakPolarHBondContact O-CG 3.24Å; I265-Q269 PolarHBondContact O-N 3.06Å; I265-I284 HydrophobicContact CB-CG2 4.49Å; I265-I284 HydrophobicContact CG2-CD1 4.29Å; I265-I284 HydrophobicContact CG2-CG1 4.33Å; I265-I284 HydrophobicContact CG2-CG2 3.84Å
266R91.1Very high91.1Very high96 Ų9662.5 Ų62.536%0.36233%0.325SS..Hα-helixtrans-62.7-38.9177-77.7-170.563.9-144.2-8.5113.3F262 V263 L264 Q269 T270 I284 S288F262-R266 WeakPolarHBondContact O-CB 3.45Å; F262-R266 WeakPolarHBondContact O-CG 3.49Å; F262-R266 PolarHBondContact O-N 3.33Å; V263-R266 PolarHBondContact O-N 2.95Å; L264-R266 VanDerWaalsContact C-N 3.33Å; L264-R266 PolarHBondContact O-N 2.88Å; R266-Q269 PolarHBondContact O-N 2.94Å; R266-T270 WeakPolarHBondContact O-CB 3.46Å; R266-T270 PolarHBondContact O-N 3.13Å; R266-T270 PolarHBondContact O-OG1 3.22Å; R266-I284 HydrophobicContact CG-CG2 3.7Å; R266-S288 VanDerWaalsContact CD-CB 3.41Å; R266-S288 WeakPolarHBondContact CD-OG 3.35Å; R266-S288 PolarHBondContact NH1-OG 2.96Å
267L90.9Very high90.4Very high21 Ų2169.1 Ų69.111%0.1136%0.356CS..Hα-helixtrans-62.2-47.1173.6179.562.5000110.1I191 T195 I196 V263 L264 I265 Q269 T270 L271I191-L267 HydrophobicContact CG2-CD1 4.23Å; T195-L267 HydrophobicContact CG2-CB 4.05Å; T195-L267 HydrophobicContact CG2-CD2 3.67Å; T195-L267 HydrophobicContact CG2-CG 4.46Å; I196-L267 HydrophobicContact CD1-CD2 4.28Å; I196-L267 HydrophobicContact CG1-CD2 4.22Å; V263-L267 WeakPolarHBondContact O-CB 3.43Å; V263-L267 PolarHBondContact O-N 3.37Å; L264-L267 PolarHBondContact O-N 3.27Å; I265-L267 VanDerWaalsContact C-N 3.35Å; I265-L267 PolarHBondContact O-N 3.34Å; L267-Q269 VanDerWaalsContact C-N 3.33Å; L267-Q269 PolarHBondContact O-N 3.09Å; L267-T270 WeakPolarHBondContact O-CB 3.36Å; L267-T270 PolarHBondContact O-N 2.95Å; L267-T270 VanDerWaalsContact O-N 3.15Å; L267-L271 HydrophobicContact CD1-CD1 4.19Å; L267-L271 HydrophobicContact CD1-CG 4.21Å; L267-L271 HydrophobicContact CG-CD1 4.03Å; L267-L271 HydrophobicContact CG-CG 4.44Å; L267-L271 WeakPolarHBondContact O-CG 3.28Å; L267-L271 PolarHBondContact O-N 3.06Å
268S91.7Very high89.9Confident57 Ų5769.8 Ų69.840%0.39936%0.355SS..Hα-helixtrans-59.6-40.7177.978.50000112.8L264 I265 L271 S272L264-S268 PolarHBondContact O-N 2.99Å; I265-S268 PolarHBondContact O-N 3.36Å; I265-S268 PolarHBondContact O-OG 2.76Å; S268-L271 PolarHBondContact O-N 2.96Å; S268-S272 VanDerWaalsContact O-CB 3.27Å; S268-S272 WeakPolarHBondContact O-CB 3.42Å; S268-S272 PolarHBondContact O-N 3.13Å; S268-S272 PolarHBondContact O-OG 3.06Å
269Q89Confident89.4Confident24 Ų2471.9 Ų71.911%0.11237%0.368CS..Hα-helixtrans-65.3-41.5175.6-73.9178.8-17.800111.9I265 R266 L267 S272 H273 V274I265-Q269 WeakPolarHBondContact O-CG 3.24Å; I265-Q269 PolarHBondContact O-N 3.06Å; R266-Q269 PolarHBondContact O-N 2.94Å; L267-Q269 VanDerWaalsContact C-N 3.33Å; L267-Q269 PolarHBondContact O-N 3.09Å; Q269-S272 CarbonylContact O-C 3.37Å; Q269-S272 PolarHBondContact O-N 2.96Å; Q269-H273 PolarHBondContact O-N 3.23Å; Q269-V274 HydrophobicContact CB-CB 4.07Å; Q269-V274 HydrophobicContact CB-CG1 4.48Å; Q269-V274 HydrophobicContact CB-CG2 4.34Å; Q269-V274 HydrophobicContact CG-CB 4.38Å; Q269-V274 HydrophobicContact CG-CG1 4.46Å; Q269-V274 HydrophobicContact CG-CG2 4.36Å; Q269-V274 PolarHBondContact O-N 3Å
270T85.6Confident89Confident78 Ų7876.6 Ų76.648%0.47939%0.386SS..Hα-helixtrans-64.6-42.1177.9-56.50000111R266 L267 H273R266-T270 WeakPolarHBondContact O-CB 3.46Å; R266-T270 PolarHBondContact O-N 3.13Å; R266-T270 PolarHBondContact O-OG1 3.22Å; L267-T270 WeakPolarHBondContact O-CB 3.36Å; L267-T270 PolarHBondContact O-N 2.95Å; L267-T270 VanDerWaalsContact O-N 3.15Å; T270-H273 PolarHBondContact O-N 3.19Å
271L86.4Confident88.6Confident119 Ų11976.3 Ų76.362%0.62339%0.385SS*.Hα-helixtrans-70.2-33176.5-67.2175.1000112.7L267 S268 H273L267-L271 HydrophobicContact CD1-CD1 4.19Å; L267-L271 HydrophobicContact CD1-CG 4.21Å; L267-L271 HydrophobicContact CG-CD1 4.03Å; L267-L271 HydrophobicContact CG-CG 4.44Å; L267-L271 WeakPolarHBondContact O-CG 3.28Å; L267-L271 PolarHBondContact O-N 3.06Å; S268-L271 PolarHBondContact O-N 2.96Å; L271-H273 PolarHBondContact O-CD2 3.26Å; L271-H273 PolarHBondContact O-N 3.45Å
272S88.7Confident88.2Confident86 Ų8676.9 Ų76.960%0.60138%0.383SS*.THydrogen-bonded Turntrans-85.16.6178.2-52.10000113.4S268 Q269 V274S268-S272 VanDerWaalsContact O-CB 3.27Å; S268-S272 WeakPolarHBondContact O-CB 3.42Å; S268-S272 PolarHBondContact O-N 3.13Å; S268-S272 PolarHBondContact O-OG 3.06Å; Q269-S272 CarbonylContact O-C 3.37Å; Q269-S272 PolarHBondContact O-N 2.96Å; S272-V274 PolarHBondContact O-N 3.11Å; S272-V274 VanDerWaalsContact O-N 3.15Å
273H83.6Confident88Confident156 Ų15677 Ų7772%0.72239%0.385SS*.THydrogen-bonded Turntrans52.236.1-178.7-63.4-83.7000113.9Q269 T270 L271 D275Q269-H273 PolarHBondContact O-N 3.23Å; T270-H273 PolarHBondContact O-N 3.19Å; L271-H273 PolarHBondContact O-CD2 3.26Å; L271-H273 PolarHBondContact O-N 3.45Å; H273-D275 PolarHBondContact O-N 2.97Å
274V82.2Confident87.9Confident36 Ų3677.8 Ų77.822%0.21839%0.388CS..  trans-63.9129.2174.8163.30000109.7Q269 S272 R276 Y280 A281Q269-V274 HydrophobicContact CB-CB 4.07Å; Q269-V274 HydrophobicContact CB-CG1 4.48Å; Q269-V274 HydrophobicContact CB-CG2 4.34Å; Q269-V274 HydrophobicContact CG-CB 4.38Å; Q269-V274 HydrophobicContact CG-CG1 4.46Å; Q269-V274 HydrophobicContact CG-CG2 4.36Å; Q269-V274 PolarHBondContact O-N 3Å; S272-V274 PolarHBondContact O-N 3.11Å; S272-V274 VanDerWaalsContact O-N 3.15Å; V274-R276 PolarHBondContact O-N 2.9Å; V274-Y280 HydrophobicContact CG1-CE2 3.9Å; V274-Y280 WeakPolarHBondContact CG1-OH 3.46Å; V274-Y280 WeakPolarHBondContact CG2-OH 3.24Å; V274-A281 HydrophobicContact CG1-CB 4.12Å
275D81.6Confident87.7Confident81 Ų8175.3 Ų75.343%0.43338%0.376SS..  trans-62.2122.6172.9-178.110.8000110.8H273 H277 K278H273-D275 PolarHBondContact O-N 2.97Å; D275-H277 PolarHBondContact O-N 3.06Å; D275-H277 IonicContact OD1-CG 3.85Å; D275-H277 PolarHBondContact OD1-N 3.39Å; D275-H277 VanDerWaalsContact OD1-N 3.1Å; D275-H277 IonicContact OD1-ND1 2.91Å; D275-H277 PolarHBondContact OD1-ND1 3.04Å; D275-K278 HydrophobicContact CB-CD 4.46Å; D275-K278 HydrophobicContact CB-CG 4.18Å; D275-K278 PolarHBondContact O-N 2.92Å
276R81Confident87.6Confident179 Ų17972.8 Ų72.868%0.67536%0.362SS*.THydrogen-bonded Turntrans-65.3-22.8-177.5-68.8-177.8-74.1179.6-3112.5V274 K278 M282 I285V274-R276 PolarHBondContact O-N 2.9Å; R276-K278 VanDerWaalsContact C-N 3.29Å; R276-K278 PolarHBondContact O-N 3.41Å; R276-M282 VanDerWaalsContact O-CE 3.26Å; R276-M282 WeakPolarHBondContact O-CE 3.46Å; R276-M282 WeakPolarHBondContact O-CG 3.44Å; R276-I285 HydrophobicContact CB-CD1 4.43Å
277H82.1Confident87.8Confident139 Ų13969.5 Ų69.564%0.64435%0.352SS*.THydrogen-bonded Turntrans-81.5-7.3-178.1-55.687.7000113.4D275D275-H277 PolarHBondContact O-N 3.06Å; D275-H277 IonicContact OD1-CG 3.85Å; D275-H277 PolarHBondContact OD1-N 3.39Å; D275-H277 VanDerWaalsContact OD1-N 3.1Å; D275-H277 IonicContact OD1-ND1 2.91Å; D275-H277 PolarHBondContact OD1-ND1 3.04Å
278K87.1Confident88Confident99 Ų9968.6 Ų68.643%0.4335%0.348SS..SBendtrans-65.4140.4173.4-65.2-173.9-178.3-177.30109.7D275 R276 Y280 A281 M282D275-K278 HydrophobicContact CB-CD 4.46Å; D275-K278 HydrophobicContact CB-CG 4.18Å; D275-K278 PolarHBondContact O-N 2.92Å; R276-K278 VanDerWaalsContact C-N 3.29Å; R276-K278 PolarHBondContact O-N 3.41Å; K278-Y280 VanDerWaalsContact C-N 3.28Å; K278-Y280 HydrophobicContact CB-CD1 3.77Å; K278-Y280 HydrophobicContact CB-CE1 3.62Å; K278-Y280 HydrophobicContact CD-CD1 4.42Å; K278-Y280 HydrophobicContact CD-CE1 3.54Å; K278-Y280 HydrophobicContact CG-CE1 4.21Å; K278-Y280 PolarHBondContact O-N 2.89Å; K278-A281 HydrophobicContact CB-CB 4.37Å; K278-A281 WeakPolarHBondContact O-CA 3.48Å; K278-A281 WeakPolarHBondContact O-CB 3.41Å; K278-A281 PolarHBondContact O-N 2.91Å; K278-M282 PolarHBondContact O-N 3.3Å
279P86.1Confident88.1Confident75 Ų7571.4 Ų71.449%0.48735%0.349SS..Hα-helixtrans-58.5-38.1-174.121-33.1000113T7 A281 M282 N283T7-P279 HydrophobicContact CG2-CB 3.64Å; P279-A281 VanDerWaalsContact C-N 3.33Å; P279-A281 PolarHBondContact O-N 3.1Å; P279-M282 PolarHBondContact O-N 2.73Å; P279-N283 PolarHBondContact O-N 2.84Å; P279-N283 PolarHBondContact O-OD1 3.35Å
280Y87.7Confident88.5Confident108 Ų10870.9 Ų70.942%0.42435%0.348SS..Hα-helixtrans-65.5-36.7175.579.6-93.8000112.4V274 K278 N283 I284V274-Y280 HydrophobicContact CG1-CE2 3.9Å; V274-Y280 WeakPolarHBondContact CG1-OH 3.46Å; V274-Y280 WeakPolarHBondContact CG2-OH 3.24Å; K278-Y280 VanDerWaalsContact C-N 3.28Å; K278-Y280 HydrophobicContact CB-CD1 3.77Å; K278-Y280 HydrophobicContact CB-CE1 3.62Å; K278-Y280 HydrophobicContact CD-CD1 4.42Å; K278-Y280 HydrophobicContact CD-CE1 3.54Å; K278-Y280 HydrophobicContact CG-CE1 4.21Å; K278-Y280 PolarHBondContact O-N 2.89Å; Y280-N283 PolarHBondContact O-N 2.97Å; Y280-I284 VanDerWaalsContact O-CG1 3.3Å; Y280-I284 WeakPolarHBondContact O-CG1 3.07Å; Y280-I284 PolarHBondContact O-N 2.9Å; Y280-I284 VanDerWaalsContact O-N 3.08Å
281A88.3Confident89Confident1 Ų169.5 Ų69.51%0.00834%0.335CS..Hα-helixtrans-68.9-40.3-179.800000110.4V274 K278 P279 I284 I285V274-A281 HydrophobicContact CG1-CB 4.12Å; K278-A281 HydrophobicContact CB-CB 4.37Å; K278-A281 WeakPolarHBondContact O-CA 3.48Å; K278-A281 WeakPolarHBondContact O-CB 3.41Å; K278-A281 PolarHBondContact O-N 2.91Å; P279-A281 VanDerWaalsContact C-N 3.33Å; P279-A281 PolarHBondContact O-N 3.1Å; A281-I284 PolarHBondContact O-N 2.7Å; A281-I285 VanDerWaalsContact O-CG1 3.26Å; A281-I285 WeakPolarHBondContact O-CG1 3.22Å; A281-I285 PolarHBondContact O-N 3.05Å
282M88.6Confident89.5Confident71 Ų7165 Ų6535%0.3531%0.314SS..Hα-helixtrans-61.2-45.8173.3-70.8-61.9-174.900112.1R276 K278 P279 I284 I285 D286R276-M282 VanDerWaalsContact O-CE 3.26Å; R276-M282 WeakPolarHBondContact O-CE 3.46Å; R276-M282 WeakPolarHBondContact O-CG 3.44Å; K278-M282 PolarHBondContact O-N 3.3Å; P279-M282 PolarHBondContact O-N 2.73Å; M282-I284 VanDerWaalsContact C-N 3.32Å; M282-I284 PolarHBondContact O-N 2.59Å; M282-I285 WeakPolarHBondContact O-CB 3.25Å; M282-I285 PolarHBondContact O-N 2.91Å; M282-I285 VanDerWaalsContact O-N 3.09Å; M282-I285 HydrophobicContact SD-CD1 4.33Å; M282-D286 PolarHBondContact O-N 2.81Å
283N91.8Very high89.9Confident40 Ų4061 Ų6121%0.21429%0.285CS..Hα-helixtrans-59.1-42.6176.5-70.3-2.3000112.3I8 Y10 P279 Y280 D286 L287I8-N283 PolarHBondContact O-OD1 3.49Å; Y10-N283 HydrophobicContact CD2-CB 4.16Å; Y10-N283 HydrophobicContact CE2-CB 4.26Å; P279-N283 PolarHBondContact O-N 2.84Å; P279-N283 PolarHBondContact O-OD1 3.35Å; Y280-N283 PolarHBondContact O-N 2.97Å; N283-D286 PolarHBondContact O-N 2.88Å; N283-L287 WeakPolarHBondContact O-CB 3.49Å; N283-L287 VanDerWaalsContact O-CG 3.3Å; N283-L287 WeakPolarHBondContact O-CG 3.09Å; N283-L287 PolarHBondContact O-N 2.97Å
284I92.2Very high90.6Very high30 Ų3054.9 Ų54.915%0.15426%0.259CS..Hα-helixtrans-63.9-40.8175.5-68-57.2000111.3F262 I265 R266 Y280 A281 M282 S288F262-I284 HydrophobicContact CD1-CD1 4.09Å; F262-I284 HydrophobicContact CD1-CG2 4.34Å; F262-I284 HydrophobicContact CE1-CD1 3.71Å; I265-I284 HydrophobicContact CB-CG2 4.49Å; I265-I284 HydrophobicContact CG2-CD1 4.29Å; I265-I284 HydrophobicContact CG2-CG1 4.33Å; I265-I284 HydrophobicContact CG2-CG2 3.84Å; R266-I284 HydrophobicContact CG-CG2 3.7Å; Y280-I284 VanDerWaalsContact O-CG1 3.3Å; Y280-I284 WeakPolarHBondContact O-CG1 3.07Å; Y280-I284 PolarHBondContact O-N 2.9Å; Y280-I284 VanDerWaalsContact O-N 3.08Å; A281-I284 PolarHBondContact O-N 2.7Å; M282-I284 VanDerWaalsContact C-N 3.32Å; M282-I284 PolarHBondContact O-N 2.59Å; I284-S288 VanDerWaalsContact O-CB 3.32Å; I284-S288 WeakPolarHBondContact O-CB 3.4Å; I284-S288 PolarHBondContact O-N 2.82Å
285I91.2Very high91.3Very high18 Ų1853.1 Ų53.19%0.09225%0.248CC..Hα-helixtrans-61.4-48.3176.3-71.6164.6000110.3R276 A281 M282 S288 R289R276-I285 HydrophobicContact CB-CD1 4.43Å; A281-I285 VanDerWaalsContact O-CG1 3.26Å; A281-I285 WeakPolarHBondContact O-CG1 3.22Å; A281-I285 PolarHBondContact O-N 3.05Å; M282-I285 WeakPolarHBondContact O-CB 3.25Å; M282-I285 PolarHBondContact O-N 2.91Å; M282-I285 VanDerWaalsContact O-N 3.09Å; M282-I285 HydrophobicContact SD-CD1 4.33Å; I285-S288 PolarHBondContact O-N 2.8Å; I285-S288 PolarHBondContact O-OG 3.41Å; I285-R289 VanDerWaalsContact CG2-CZ 3.41Å; I285-R289 WeakPolarHBondContact O-CG 3.37Å; I285-R289 PolarHBondContact O-N 2.84Å
286D92.6Very high92.1Very high14 Ų1449.3 Ų49.38%0.07523%0.228CC..Hα-helixtrans-68.6-41-178.2-70.8-26.3000112.5V14 M282 N283 S288 R289 L290V14-D286 HydrophobicContact CG2-CB 4.29Å; V14-D286 WeakPolarHBondContact CG2-O 3.29Å; M282-D286 PolarHBondContact O-N 2.81Å; N283-D286 PolarHBondContact O-N 2.88Å; D286-S288 VanDerWaalsContact C-N 3.33Å; D286-S288 PolarHBondContact O-N 3.1Å; D286-R289 WeakPolarHBondContact O-CB 3.5Å; D286-R289 PolarHBondContact O-N 3.39Å; D286-R289 VanDerWaalsContact O-N 3.17Å; D286-R289 IonicContact OD1-CZ 3.99Å; D286-R289 IonicContact OD1-NH1 2.75Å; D286-R289 PolarHBondContact OD1-NH1 3.01Å; D286-L290 PolarHBondContact O-N 3.2Å
287L94.9Very high92.9Very high27 Ų2743.2 Ų43.214%0.14121%0.208CC..Hα-helixtrans-62.5-39.4172.3-71.7170.1000111.9Y10 F262 N283 R289 L290 F291Y10-L287 HydrophobicContact CD1-CD2 3.79Å; Y10-L287 HydrophobicContact CD1-CG 4.42Å; Y10-L287 HydrophobicContact CD2-CD1 4.28Å; Y10-L287 HydrophobicContact CD2-CD2 4.26Å; Y10-L287 HydrophobicContact CD2-CG 4Å; Y10-L287 HydrophobicContact CE1-CD2 3.94Å; Y10-L287 HydrophobicContact CE2-CD1 4.02Å; Y10-L287 HydrophobicContact CE2-CD2 4.39Å; Y10-L287 HydrophobicContact CE2-CG 4.21Å; Y10-L287 HydrophobicContact CG-CD2 3.96Å; Y10-L287 HydrophobicContact CG-CG 4.1Å; F262-L287 HydrophobicContact CD1-CB 3.85Å; F262-L287 HydrophobicContact CE1-CB 3.46Å; F262-L287 VanDerWaalsContact CE1-CB 3.46Å; F262-L287 HydrophobicContact CE1-CD1 3.64Å; F262-L287 HydrophobicContact CE1-CG 4.2Å; F262-L287 HydrophobicContact CE2-CB 4.36Å; F262-L287 HydrophobicContact CG-CB 4.46Å; F262-L287 HydrophobicContact CZ-CB 3.77Å; F262-L287 HydrophobicContact CZ-CD1 3.69Å; F262-L287 HydrophobicContact CZ-CG 4.28Å; N283-L287 WeakPolarHBondContact O-CB 3.49Å; N283-L287 VanDerWaalsContact O-CG 3.3Å; N283-L287 WeakPolarHBondContact O-CG 3.09Å; N283-L287 PolarHBondContact O-N 2.97Å; L287-R289 VanDerWaalsContact C-N 3.3Å; L287-R289 PolarHBondContact O-N 3.38Å; L287-L290 HydrophobicContact CD2-CD2 4.43Å; L287-L290 WeakPolarHBondContact O-CB 3.49Å; L287-L290 PolarHBondContact O-N 3.41Å; L287-F291 HydrophobicContact CB-CD2 4.5Å; L287-F291 HydrophobicContact CB-CE2 4.46Å; L287-F291 HydrophobicContact CD2-CE2 4.32Å; L287-F291 WeakPolarHBondContact O-CD2 3.29Å; L287-F291 PolarHBondContact O-N 2.95Å
288S94.8Very high93.6Very high3 Ų336.7 Ų36.72%0.02118%0.178CC..Hα-helixtrans-62.6-37.8174.8800000112.3R266 I284 I285 D286 S292R266-S288 VanDerWaalsContact CD-CB 3.41Å; R266-S288 WeakPolarHBondContact CD-OG 3.35Å; R266-S288 PolarHBondContact NH1-OG 2.96Å; I284-S288 VanDerWaalsContact O-CB 3.32Å; I284-S288 WeakPolarHBondContact O-CB 3.4Å; I284-S288 PolarHBondContact O-N 2.82Å; I285-S288 PolarHBondContact O-N 2.8Å; I285-S288 PolarHBondContact O-OG 3.41Å; D286-S288 VanDerWaalsContact C-N 3.33Å; D286-S288 PolarHBondContact O-N 3.1Å; S288-S292 VanDerWaalsContact O-CB 3.23Å; S288-S292 WeakPolarHBondContact O-CB 3.4Å; S288-S292 PolarHBondContact O-N 3.01Å
289R94.7Very high94.2Very high115 Ų11532.1 Ų32.143%0.43416%0.158SC..Hα-helixtrans-67.1-42.7176.1-70.8165.5174.2165.4-3.1110.8V14 I285 D286 L287 S292 S293V14-R289 HydrophobicContact CG1-CB 4.04Å; V14-R289 HydrophobicContact CG2-CB 4.25Å; I285-R289 VanDerWaalsContact CG2-CZ 3.41Å; I285-R289 WeakPolarHBondContact O-CG 3.37Å; I285-R289 PolarHBondContact O-N 2.84Å; D286-R289 WeakPolarHBondContact O-CB 3.5Å; D286-R289 PolarHBondContact O-N 3.39Å; D286-R289 VanDerWaalsContact O-N 3.17Å; D286-R289 IonicContact OD1-CZ 3.99Å; D286-R289 IonicContact OD1-NH1 2.75Å; D286-R289 PolarHBondContact OD1-NH1 3.01Å; L287-R289 VanDerWaalsContact C-N 3.3Å; L287-R289 PolarHBondContact O-N 3.38Å; R289-S292 PolarHBondContact O-N 3.44Å; R289-S293 PolarHBondContact O-N 3.04Å; R289-S293 PolarHBondContact O-OG 3.46Å
290L96.8Very high94.8Very high14 Ų1428.9 Ų28.97%0.07314%0.138CC..Hα-helixtrans-58.1-54.8175.2-179.964.3000110.4L13 V14 F17 D286 L287 S292 S293 V294L13-L290 HydrophobicContact CD2-CD2 3.52Å; L13-L290 HydrophobicContact CG-CD1 4.26Å; L13-L290 HydrophobicContact CG-CD2 3.97Å; V14-L290 HydrophobicContact CG2-CB 3.88Å; F17-L290 HydrophobicContact CB-CD1 3.82Å; F17-L290 HydrophobicContact CD2-CD1 4.19Å; F17-L290 HydrophobicContact CG-CD1 4Å; D286-L290 PolarHBondContact O-N 3.2Å; L287-L290 HydrophobicContact CD2-CD2 4.43Å; L287-L290 WeakPolarHBondContact O-CB 3.49Å; L287-L290 PolarHBondContact O-N 3.41Å; L290-S292 VanDerWaalsContact C-N 3.26Å; L290-S292 PolarHBondContact O-N 3.22Å; L290-S293 CarbonylContact O-C 3.45Å; L290-S293 PolarHBondContact O-N 3.41Å; L290-V294 HydrophobicContact CD1-CG2 4.18Å; L290-V294 HydrophobicContact CG-CG2 4.16Å; L290-V294 VanDerWaalsContact O-CG2 3.31Å; L290-V294 WeakPolarHBondContact O-CG2 3.1Å; L290-V294 PolarHBondContact O-N 3.42Å
291F97.5Very high95.2Very high49 Ų4925.4 Ų25.422%0.21513%0.128CC..Hα-helixtrans-68.5-25.8-178.1-69.8-62.4000113.3P258 M259 F262 L287 S293 V294 K295P258-F291 HydrophobicContact CB-CB 4.45Å; P258-F291 HydrophobicContact CB-CD1 3.54Å; P258-F291 HydrophobicContact CB-CD2 4.12Å; P258-F291 HydrophobicContact CB-CE1 3.69Å; P258-F291 HydrophobicContact CB-CE2 4.26Å; P258-F291 HydrophobicContact CB-CG 3.78Å; P258-F291 HydrophobicContact CB-CZ 4.05Å; P258-F291 HydrophobicContact CG-CD1 3.62Å; P258-F291 HydrophobicContact CG-CE1 3.94Å; P258-F291 HydrophobicContact CG-CG 4.21Å; M259-F291 HydrophobicContact CB-CB 4.32Å; F262-F291 AromaticContact CD2-CD2 3.4Å; F262-F291 HydrophobicContact CD2-CD2 3.4Å; F262-F291 AromaticContact CD2-CE2 3.72Å; F262-F291 HydrophobicContact CD2-CE2 3.72Å; F262-F291 HydrophobicContact CD2-CG 4.4Å; F262-F291 AromaticContact CE2-CD2 3.54Å; F262-F291 HydrophobicContact CE2-CD2 3.54Å; F262-F291 AromaticContact CE2-CE2 3.31Å; F262-F291 HydrophobicContact CE2-CE2 3.31Å; F262-F291 HydrophobicContact CE2-CZ 4.38Å; F262-F291 HydrophobicContact CG-CD2 4.27Å; F262-F291 HydrophobicContact CZ-CD2 4.46Å; F262-F291 HydrophobicContact CZ-CE2 4.09Å; L287-F291 HydrophobicContact CB-CD2 4.5Å; L287-F291 HydrophobicContact CB-CE2 4.46Å; L287-F291 HydrophobicContact CD2-CE2 4.32Å; L287-F291 WeakPolarHBondContact O-CD2 3.29Å; L287-F291 PolarHBondContact O-N 2.95Å; F291-S293 VanDerWaalsContact C-N 3.28Å; F291-S293 PolarHBondContact O-N 3.12Å; F291-V294 HydrophobicContact CD1-CB 4.37Å; F291-V294 PolarHBondContact O-N 3.12Å; F291-K295 WeakPolarHBondContact O-CB 3.42Å; F291-K295 PolarHBondContact O-N 2.6Å
292S95.7Very high95.7Very high25 Ų2525.5 Ų25.518%0.17513%0.128CC..Hα-helixtrans-65.3-29.6169.2-173.60000113.1M259 S288 R289 L290 K295M259-S292 VanDerWaalsContact SD-CA 3.55Å; M259-S292 PolarHBondContact SD-N 3Å; S288-S292 VanDerWaalsContact O-CB 3.23Å; S288-S292 WeakPolarHBondContact O-CB 3.4Å; S288-S292 PolarHBondContact O-N 3.01Å; R289-S292 PolarHBondContact O-N 3.44Å; L290-S292 VanDerWaalsContact C-N 3.26Å; L290-S292 PolarHBondContact O-N 3.22Å; S292-K295 VanDerWaalsContact O-CE 3.22Å; S292-K295 WeakPolarHBondContact O-CE 3.09Å; S292-K295 VanDerWaalsContact O-CG 3.29Å; S292-K295 WeakPolarHBondContact O-CG 3.12Å; S292-K295 PolarHBondContact O-NZ 3.31Å
293S97.4Very high96.1Very high1 Ų123 Ų231%0.00712%0.115CC..Hα-helixtrans-87.2-36.9173.3-62.30000111.6R18 D72 R289 L290 F291 K295 D296R18-S293 PolarHBondContact NE-OG 3.29Å; D72-S293 VanDerWaalsContact CG-OG 3.27Å; D72-S293 WeakPolarHBondContact OD2-CB 3.41Å; D72-S293 PolarHBondContact OD2-OG 3.04Å; R289-S293 PolarHBondContact O-N 3.04Å; R289-S293 PolarHBondContact O-OG 3.46Å; L290-S293 CarbonylContact O-C 3.45Å; L290-S293 PolarHBondContact O-N 3.41Å; F291-S293 VanDerWaalsContact C-N 3.28Å; F291-S293 PolarHBondContact O-N 3.12Å; S293-K295 VanDerWaalsContact C-N 3.34Å; S293-K295 PolarHBondContact O-N 2.88Å; S293-D296 WeakPolarHBondContact O-CB 3.35Å; S293-D296 PolarHBondContact O-N 2.86Å
294V98Very high96.4Very high27 Ų2725.6 Ų25.616%0.16413%0.125CC..Hα-helixtrans-63.2-38.6177.2172.70000111.5F17 L255 L290 F291 D296 I297F17-V294 HydrophobicContact CD2-CG2 4.04Å; F17-V294 HydrophobicContact CE1-CG2 4.28Å; F17-V294 HydrophobicContact CE2-CG2 3.58Å; F17-V294 HydrophobicContact CZ-CB 4.26Å; F17-V294 HydrophobicContact CZ-CG2 3.73Å; L255-V294 HydrophobicContact CD2-CG1 4.2Å; L290-V294 HydrophobicContact CD1-CG2 4.18Å; L290-V294 HydrophobicContact CG-CG2 4.16Å; L290-V294 VanDerWaalsContact O-CG2 3.31Å; L290-V294 WeakPolarHBondContact O-CG2 3.1Å; L290-V294 PolarHBondContact O-N 3.42Å; F291-V294 HydrophobicContact CD1-CB 4.37Å; F291-V294 PolarHBondContact O-N 3.12Å; V294-D296 PolarHBondContact O-N 3.49Å; V294-D296 VanDerWaalsContact O-N 3.09Å; V294-I297 HydrophobicContact CG1-CD1 4.28Å; V294-I297 WeakPolarHBondContact O-CB 3.3Å; V294-I297 WeakPolarHBondContact O-CD1 3.45Å; V294-I297 VanDerWaalsContact O-CG1 3.27Å; V294-I297 WeakPolarHBondContact O-CG1 3.39Å; V294-I297 PolarHBondContact O-N 3.05Å
295K97.7Very high96.7Very high0 Ų025.5 Ų25.50%013%0.125CC..THydrogen-bonded Turntrans-56.2-30.3177.874.9175.1163.458.10111.9Y109 Y256 M259 F291 S292 S293 I297 T298Y109-K295 VanDerWaalsContact CZ-NZ 3.26Å; Y109-K295 PolarHBondContact OH-NZ 3.06Å; Y109-K295 VanDerWaalsContact OH-NZ 3.11Å; Y256-K295 HydrophobicContact CD2-CB 4.21Å; Y256-K295 HydrophobicContact CE2-CB 4.24Å; Y256-K295 HydrophobicContact CE2-CD 4.27Å; M259-K295 HydrophobicContact CG-CD 4.07Å; F291-K295 WeakPolarHBondContact O-CB 3.42Å; F291-K295 PolarHBondContact O-N 2.6Å; S292-K295 VanDerWaalsContact O-CE 3.22Å; S292-K295 WeakPolarHBondContact O-CE 3.09Å; S292-K295 VanDerWaalsContact O-CG 3.29Å; S292-K295 WeakPolarHBondContact O-CG 3.12Å; S292-K295 PolarHBondContact O-NZ 3.31Å; S293-K295 VanDerWaalsContact C-N 3.34Å; S293-K295 PolarHBondContact O-N 2.88Å; K295-I297 PolarHBondContact O-N 3.36Å; K295-T298 VanDerWaalsContact O-CB 3.3Å; K295-T298 WeakPolarHBondContact O-CB 3.15Å; K295-T298 WeakPolarHBondContact O-CG2 2.93Å; K295-T298 PolarHBondContact O-N 3.46Å
296D97.7Very high97Very high0 Ų024.7 Ų24.70%012%0.121CC..THydrogen-bonded Turntrans-64.2-17.7-173.6-71.74.4000113N67 T68 S293 V294 T298 Y299N67-D296 PolarHBondContact ND2-OD2 3.4Å; T68-D296 HydrophobicContact CG2-CB 4.26Å; T68-D296 PolarHBondContact OG1-OD2 3.35Å; S293-D296 WeakPolarHBondContact O-CB 3.35Å; S293-D296 PolarHBondContact O-N 2.86Å; V294-D296 PolarHBondContact O-N 3.49Å; V294-D296 VanDerWaalsContact O-N 3.09Å; D296-T298 PolarHBondContact O-N 2.98Å; D296-T298 VanDerWaalsContact O-N 3.16Å; D296-Y299 HydrophobicContact CB-CD2 3.98Å; D296-Y299 HydrophobicContact CB-CE2 4.25Å; D296-Y299 WeakPolarHBondContact O-CB 3.35Å; D296-Y299 WeakPolarHBondContact O-CD2 3.25Å; D296-Y299 PolarHBondContact O-N 3.43Å; D296-Y299 WeakPolarHBondContact OD1-CE2 3.37Å
297I98.1Very high97.2Very high51 Ų5125.9 Ų25.926%0.26213%0.126SC..Hα-helixtrans-51.9-35167.6-63.7172.4000110.8F17 I25 L255 V294 K295 Y299 A300 V301F17-I297 HydrophobicContact CZ-CD1 4.32Å; I25-I297 HydrophobicContact CD1-CD1 4.27Å; I25-I297 HydrophobicContact CD1-CG1 3.56Å; I25-I297 HydrophobicContact CG1-CG1 4.12Å; L255-I297 HydrophobicContact CD1-CB 3.92Å; L255-I297 HydrophobicContact CD1-CG2 3.89Å; L255-I297 HydrophobicContact CD2-CB 4.28Å; L255-I297 HydrophobicContact CD2-CG2 4.49Å; V294-I297 HydrophobicContact CG1-CD1 4.28Å; V294-I297 WeakPolarHBondContact O-CB 3.3Å; V294-I297 WeakPolarHBondContact O-CD1 3.45Å; V294-I297 VanDerWaalsContact O-CG1 3.27Å; V294-I297 WeakPolarHBondContact O-CG1 3.39Å; V294-I297 PolarHBondContact O-N 3.05Å; K295-I297 PolarHBondContact O-N 3.36Å; I297-Y299 PolarHBondContact O-N 3.2Å; I297-Y299 VanDerWaalsContact O-N 3.14Å; I297-A300 PolarHBondContact O-N 3.01Å; I297-V301 HydrophobicContact CG2-CG1 3.61Å; I297-V301 WeakPolarHBondContact O-CG1 3.39Å; I297-V301 PolarHBondContact O-N 2.73Å
298T97.9Very high97.3Very high3 Ų329.6 Ų29.62%0.01815%0.146CC..Hα-helixtrans-61.1-25.7-180-167.40000113F252 Y256 K295 D296F252-T298 WeakPolarHBondContact CA-OG1 3.12Å; Y256-T298 HydrophobicContact CD2-CG2 4.32Å; Y256-T298 HydrophobicContact CE2-CG2 3.75Å; K295-T298 VanDerWaalsContact O-CB 3.3Å; K295-T298 WeakPolarHBondContact O-CB 3.15Å; K295-T298 WeakPolarHBondContact O-CG2 2.93Å; K295-T298 PolarHBondContact O-N 3.46Å; D296-T298 PolarHBondContact O-N 2.98Å; D296-T298 VanDerWaalsContact O-N 3.16Å
299Y98.2Very high97.3Very high2 Ų233.2 Ų33.21%0.00816%0.161CC..Hα-helixtrans-83.3-20.7179.7-51.3-51.2000111.7N33 N60 T63 Y109 Y256 D296 I297N33-Y299 PolarHBondContact ND2-O 2.89Å; N60-Y299 HydrophobicContact CB-CD1 4.47Å; N60-Y299 VanDerWaalsContact OD1-CD1 3.26Å; N60-Y299 WeakPolarHBondContact OD1-CD1 3.27Å; T63-Y299 HydrophobicContact CG2-CD2 3.52Å; T63-Y299 HydrophobicContact CG2-CE2 3.37Å; T63-Y299 HydrophobicContact CG2-CG 4.25Å; Y109-Y299 HydrophobicContact CD1-CE2 4.27Å; Y109-Y299 VanDerWaalsContact CD1-OH 3.25Å; Y109-Y299 WeakPolarHBondContact CD1-OH 3.48Å; Y109-Y299 HydrophobicContact CE1-CE2 4.03Å; Y256-Y299 PolarHBondContact OH-OH 2.83Å; D296-Y299 HydrophobicContact CB-CD2 3.98Å; D296-Y299 HydrophobicContact CB-CE2 4.25Å; D296-Y299 WeakPolarHBondContact O-CB 3.35Å; D296-Y299 WeakPolarHBondContact O-CD2 3.25Å; D296-Y299 PolarHBondContact O-N 3.43Å; D296-Y299 WeakPolarHBondContact OD1-CE2 3.37Å; I297-Y299 PolarHBondContact O-N 3.2Å; I297-Y299 VanDerWaalsContact O-N 3.14Å
300A98.1Very high97.2Very high7 Ų728.2 Ų28.26%0.05814%0.143CC..Hα-helixtrans-94.7-31.4-17900000113.7I25 L64 I297 N302I25-A300 HydrophobicContact CG2-CB 3.95Å; L64-A300 HydrophobicContact CD2-CB 4.43Å; I297-A300 PolarHBondContact O-N 3.01Å; A300-N302 VanDerWaalsContact C-N 3.32Å; A300-N302 PolarHBondContact O-N 2.99Å
301V97.8Very high97Very high36 Ų3635 Ų3522%0.21817%0.167CC..THydrogen-bonded Turntrans-71.5-20.6-171.8-68.20000115.1A251 I297 F303 F304 L305A251-V301 HydrophobicContact CB-CG2 4.24Å; I297-V301 HydrophobicContact CG2-CG1 3.61Å; I297-V301 WeakPolarHBondContact O-CG1 3.39Å; I297-V301 PolarHBondContact O-N 2.73Å; V301-F303 PolarHBondContact O-N 3.41Å; V301-F303 VanDerWaalsContact O-N 3.11Å; V301-F304 PolarHBondContact O-N 3.03Å; V301-L305 HydrophobicContact CG2-CD1 4.18Å; V301-L305 PolarHBondContact O-N 2.93Å; V301-L305 VanDerWaalsContact O-N 3.15Å
302N97.3Very high96.7Very high3 Ų335.6 Ų35.62%0.01617%0.173CC..Hα-helixtrans-54.4-37.3-172.7-73.7-11.9000113.6I36 N60 A300 F304 L305 Y306I36-N302 HydrophobicContact CD1-CB 3.91Å; N60-N302 PolarHBondContact ND2-ND2 3.34Å; A300-N302 VanDerWaalsContact C-N 3.32Å; A300-N302 PolarHBondContact O-N 2.99Å; N302-F304 PolarHBondContact O-N 3.02Å; N302-L305 PolarHBondContact O-N 2.04Å; N302-Y306 HydrophobicContact CB-CE2 4.35Å; N302-Y306 WeakPolarHBondContact O-CB 3.3Å; N302-Y306 WeakPolarHBondContact O-CD2 3.45Å; N302-Y306 VanDerWaalsContact O-CG 3.26Å; N302-Y306 PolarHBondContact O-N 3.42Å
303F97.8Very high96.6Very high17 Ų1734.4 Ų34.48%0.07517%0.165CC..Hα-helixtrans-59.8-46.9178.6170.9-104.6000112.1G32 F35 I36 V301 Y306 L307 F313 F317G32-F303 WeakPolarHBondContact O-CD2 3.34Å; F35-F303 HydrophobicContact CB-CD2 3.93Å; F35-F303 HydrophobicContact CB-CE2 3.61Å; F35-F303 HydrophobicContact CD2-CE2 4.1Å; F35-F303 HydrophobicContact CD2-CZ 4.29Å; F35-F303 HydrophobicContact CG-CE2 4.08Å; I36-F303 HydrophobicContact CD1-CB 4.04Å; I36-F303 HydrophobicContact CG1-CB 4.36Å; I36-F303 HydrophobicContact CG1-CD2 4.38Å; V301-F303 PolarHBondContact O-N 3.41Å; V301-F303 VanDerWaalsContact O-N 3.11Å; F303-Y306 PolarHBondContact O-N 3.29Å; F303-L307 HydrophobicContact CD1-CD1 4.14Å; F303-L307 HydrophobicContact CE1-CD1 3.49Å; F303-L307 VanDerWaalsContact CE1-CD1 3.49Å; F303-L307 HydrophobicContact CE1-CG 4.4Å; F303-L307 HydrophobicContact CE2-CD1 4.25Å; F303-L307 HydrophobicContact CE2-CG 4.4Å; F303-L307 HydrophobicContact CZ-CD1 3.55Å; F303-L307 HydrophobicContact CZ-CG 4.18Å; F303-L307 PolarHBondContact O-N 3.23Å; F303-F313 AromaticContact CD2-CE1 3.89Å; F303-F313 HydrophobicContact CD2-CE1 3.89Å; F303-F313 AromaticContact CD2-CZ 3.85Å; F303-F313 HydrophobicContact CD2-CZ 3.85Å; F303-F313 AromaticContact CE2-CE1 3.9Å; F303-F313 HydrophobicContact CE2-CE1 3.9Å; F303-F313 HydrophobicContact CE2-CZ 4.07Å; F303-F317 HydrophobicContact CE2-CD2 4.15Å; F303-F317 HydrophobicContact CE2-CE2 4.07Å; F303-F317 HydrophobicContact CZ-CD2 4.12Å; F303-F317 AromaticContact CZ-CE2 3.66Å; F303-F317 HydrophobicContact CZ-CE2 3.66Å; F303-F317 AromaticContact CZ-CZ 3.85Å; F303-F317 HydrophobicContact CZ-CZ 3.85Å
304F97.9Very high96.5Very high96 Ų9638.9 Ų38.942%0.42118%0.181SC..Hα-helixtrans-67.9-40.8179.2-57.4-73.2000111.6I28 V301 N302 Y306 L307 I308I28-F304 HydrophobicContact CG2-CE2 3.43Å; I28-F304 VanDerWaalsContact CG2-CE2 3.43Å; I28-F304 HydrophobicContact CG2-CZ 3.54Å; V301-F304 PolarHBondContact O-N 3.03Å; N302-F304 PolarHBondContact O-N 3.02Å; F304-Y306 VanDerWaalsContact C-N 3.31Å; F304-Y306 PolarHBondContact O-N 3.32Å; F304-L307 WeakPolarHBondContact O-CB 3.21Å; F304-L307 PolarHBondContact O-N 3Å; F304-I308 WeakPolarHBondContact O-CG1 3.17Å; F304-I308 PolarHBondContact O-N 2.9Å
305L97.9Very high96.3Very high28 Ų2841.7 Ų41.715%0.14719%0.192CC..Hα-helixtrans-60.5-42.7175.9-63.2178.4000111.1A247 L248 A251 V301 N302 L307 I308 F309A247-L305 HydrophobicContact CB-CD2 4.22Å; L248-L305 HydrophobicContact CB-CD1 3.97Å; A251-L305 HydrophobicContact CB-CD1 4.23Å; V301-L305 HydrophobicContact CG2-CD1 4.18Å; V301-L305 PolarHBondContact O-N 2.93Å; V301-L305 VanDerWaalsContact O-N 3.15Å; N302-L305 PolarHBondContact O-N 2.04Å; L305-L307 PolarHBondContact O-N 3.34Å; L305-I308 PolarHBondContact O-N 2.92Å; L305-F309 HydrophobicContact CD2-CE2 4.25Å; L305-F309 VanDerWaalsContact O-CD2 3.24Å; L305-F309 WeakPolarHBondContact O-CD2 3.42Å; L305-F309 PolarHBondContact O-N 3.24Å
306Y97.6Very high96.1Very high1 Ų142.7 Ų42.70%0.00420%0.203CC..Hα-helixtrans-65.3-38.1175.1-66.3-24.2000112.9I36 F40 F49 S53 L248 N302 F303 F304 I308 L310 F313I36-Y306 HydrophobicContact CD1-CD2 3.75Å; I36-Y306 HydrophobicContact CD1-CE2 3.75Å; I36-Y306 HydrophobicContact CG1-CD2 3.81Å; I36-Y306 HydrophobicContact CG1-CE2 4.08Å; I36-Y306 HydrophobicContact CG2-CD2 4.26Å; I36-Y306 HydrophobicContact CG2-CE2 3.89Å; F40-Y306 AromaticContact CE2-CD2 3.88Å; F40-Y306 HydrophobicContact CE2-CD2 3.88Å; F40-Y306 AromaticContact CE2-CE2 3.86Å; F40-Y306 HydrophobicContact CE2-CE2 3.86Å; F40-Y306 HydrophobicContact CZ-CD2 4.34Å; F49-Y306 HydrophobicContact CE1-CD1 4.45Å; F49-Y306 AromaticContact CE1-CE1 3.99Å; F49-Y306 HydrophobicContact CE1-CE1 3.99Å; F49-Y306 HydrophobicContact CZ-CD1 4.08Å; F49-Y306 AromaticContact CZ-CE1 3.54Å; F49-Y306 HydrophobicContact CZ-CE1 3.54Å; S53-Y306 PolarHBondContact OG-OH 3.43Å; L248-Y306 HydrophobicContact CD2-CE1 3.91Å; N302-Y306 HydrophobicContact CB-CE2 4.35Å; N302-Y306 WeakPolarHBondContact O-CB 3.3Å; N302-Y306 WeakPolarHBondContact O-CD2 3.45Å; N302-Y306 VanDerWaalsContact O-CG 3.26Å; N302-Y306 PolarHBondContact O-N 3.42Å; F303-Y306 PolarHBondContact O-N 3.29Å; F304-Y306 VanDerWaalsContact C-N 3.31Å; F304-Y306 PolarHBondContact O-N 3.32Å; Y306-I308 VanDerWaalsContact C-N 3.3Å; Y306-I308 PolarHBondContact O-N 2.71Å; Y306-L310 HydrophobicContact CD1-CD1 3.38Å; Y306-L310 HydrophobicContact CE1-CD1 4.16Å; Y306-L310 HydrophobicContact CG-CD1 3.72Å; Y306-L310 VanDerWaalsContact O-CB 3.28Å; Y306-L310 WeakPolarHBondContact O-CB 3.39Å; Y306-L310 PolarHBondContact O-N 2.88Å; Y306-F313 HydrophobicContact CD2-CE2 4.39Å; Y306-F313 HydrophobicContact CD2-CZ 4.49Å
307L97Very high96Very high38 Ų3844.7 Ų44.720%0.19921%0.212CC..Hα-helixtrans-60.2-39.4171.6-73.8174.7000112.3F303 F304 L305 F313 R314 F317F303-L307 HydrophobicContact CD1-CD1 4.14Å; F303-L307 HydrophobicContact CE1-CD1 3.49Å; F303-L307 VanDerWaalsContact CE1-CD1 3.49Å; F303-L307 HydrophobicContact CE1-CG 4.4Å; F303-L307 HydrophobicContact CE2-CD1 4.25Å; F303-L307 HydrophobicContact CE2-CG 4.4Å; F303-L307 HydrophobicContact CZ-CD1 3.55Å; F303-L307 HydrophobicContact CZ-CG 4.18Å; F303-L307 PolarHBondContact O-N 3.23Å; F304-L307 WeakPolarHBondContact O-CB 3.21Å; F304-L307 PolarHBondContact O-N 3Å; L305-L307 PolarHBondContact O-N 3.34Å; L307-F313 HydrophobicContact CD2-CD1 3.85Å; L307-F313 HydrophobicContact CD2-CE1 3.94Å; L307-F313 HydrophobicContact CG-CD1 4.13Å; L307-F313 HydrophobicContact CG-CE1 3.98Å; L307-R314 HydrophobicContact CD2-CG 4.2Å; L307-R314 WeakPolarHBondContact O-CD 3.49Å; L307-R314 WeakPolarHBondContact O-CG 3.27Å; L307-R314 PolarHBondContact O-NH1 3.24Å; L307-F317 HydrophobicContact CD2-CB 4.12Å; L307-F317 HydrophobicContact CD2-CD1 3.85Å; L307-F317 HydrophobicContact CD2-CE1 4.47Å; L307-F317 HydrophobicContact CD2-CG 4.07Å
308I96.5Very high95.8Very high106 Ų10647.7 Ų47.754%0.54423%0.225SC..Hα-helixtrans-71-50.5-178.8-67.1164.7000111.2F304 L305 Y306 R314F304-I308 WeakPolarHBondContact O-CG1 3.17Å; F304-I308 PolarHBondContact O-N 2.9Å; L305-I308 PolarHBondContact O-N 2.92Å; Y306-I308 VanDerWaalsContact C-N 3.3Å; Y306-I308 PolarHBondContact O-N 2.71Å; I308-R314 PolarHBondContact O-NH1 3.14Å
309F94.9Very high95.6Very high78 Ų7856.7 Ų56.734%0.34226%0.259SS..Hα-helixtrans-93.6-22.9-167.9-67.1-75.5000114.8F243 A247 L305F243-F309 HydrophobicContact CB-CD1 3.88Å; F243-F309 HydrophobicContact CB-CE1 4.38Å; A247-F309 HydrophobicContact CB-CD2 3.69Å; A247-F309 HydrophobicContact CB-CE2 3.23Å; A247-F309 HydrophobicContact CB-CZ 3.76Å; L305-F309 HydrophobicContact CD2-CE2 4.25Å; L305-F309 VanDerWaalsContact O-CD2 3.24Å; L305-F309 WeakPolarHBondContact O-CD2 3.42Å; L305-F309 PolarHBondContact O-N 3.24Å
310L94.4Very high95.2Very high11 Ų1158 Ų586%0.05827%0.266CS..  trans-111.2107.3-173.3-64.2157.6000112.2F40 F49 R241 Y306 N312 F313 R314F40-L310 HydrophobicContact CZ-CD1 4.04Å; F49-L310 HydrophobicContact CE1-CD1 3.67Å; F49-L310 HydrophobicContact CE1-CD2 4.48Å; F49-L310 HydrophobicContact CZ-CD1 3.62Å; F49-L310 HydrophobicContact CZ-CD2 4.29Å; R241-L310 HydrophobicContact CB-CD2 4.26Å; R241-L310 HydrophobicContact CG-CD2 3.55Å; Y306-L310 HydrophobicContact CD1-CD1 3.38Å; Y306-L310 HydrophobicContact CE1-CD1 4.16Å; Y306-L310 HydrophobicContact CG-CD1 3.72Å; Y306-L310 VanDerWaalsContact O-CB 3.28Å; Y306-L310 WeakPolarHBondContact O-CB 3.39Å; Y306-L310 PolarHBondContact O-N 2.88Å; L310-N312 VanDerWaalsContact C-N 3.35Å; L310-N312 PolarHBondContact O-N 3.46Å; L310-F313 HydrophobicContact CB-CB 3.57Å; L310-F313 HydrophobicContact CD1-CB 4.37Å; L310-F313 WeakPolarHBondContact O-CB 3.25Å; L310-F313 PolarHBondContact O-N 2.86Å; L310-R314 PolarHBondContact O-N 3.37Å; L310-R314 VanDerWaalsContact O-N 3.11Å
311R92.1Very high94.9Very high155 Ų15561.7 Ų61.759%0.58528%0.283SS*.Hα-helixtrans-60.5-41.3176.5-173.6176.2177.6-176.4-3.6112.8F313 R314 H315R311-F313 VanDerWaalsContact C-N 3.29Å; R311-F313 PolarHBondContact O-N 3.11Å; R311-R314 PolarHBondContact O-N 3.33Å; R311-H315 PolarHBondContact NE-CE1 3.04Å; R311-H315 VanDerWaalsContact NE-CE1 3.28Å; R311-H315 PolarHBondContact NE-NE2 3.35Å; R311-H315 PolarHBondContact O-N 2.76Å
312N90.3Very high94.5Very high62 Ų6263.4 Ų63.433%0.33230%0.296SS..Hα-helixtrans-64.6-37.2178.8-64.82.6000111.6M237 L310 H315 G316M237-N312 PolarHBondContact SD-ND2 3.43Å; L310-N312 VanDerWaalsContact C-N 3.35Å; L310-N312 PolarHBondContact O-N 3.46Å; N312-H315 PolarHBondContact O-N 3.29Å; N312-G316 PolarHBondContact O-N 3.25Å
313F94.3Very high93.9Very high1 Ų166.4 Ų66.40%0.00431%0.314CS..Hα-helixtrans-64-45.4176.4-169.6-98.1000111I36 I39 F40 F303 Y306 L307 L310 R311 H315 G316 F317I36-F313 HydrophobicContact CG1-CE2 4.2Å; I36-F313 HydrophobicContact CG1-CZ 3.91Å; I39-F313 HydrophobicContact CB-CD2 4.14Å; I39-F313 HydrophobicContact CB-CE2 3.84Å; I39-F313 HydrophobicContact CD1-CD2 4.16Å; I39-F313 HydrophobicContact CD1-CE1 4.03Å; I39-F313 HydrophobicContact CD1-CE2 3.63Å; I39-F313 HydrophobicContact CD1-CZ 3.56Å; I39-F313 HydrophobicContact CG1-CE2 4.33Å; I39-F313 HydrophobicContact CG2-CD2 3.61Å; I39-F313 HydrophobicContact CG2-CE2 3.86Å; I39-F313 HydrophobicContact CG2-CG 4.38Å; F40-F313 HydrophobicContact CD2-CE2 4.37Å; F40-F313 AromaticContact CE1-CD2 4Å; F40-F313 HydrophobicContact CE1-CD2 4Å; F40-F313 AromaticContact CE2-CD2 3.88Å; F40-F313 HydrophobicContact CE2-CD2 3.88Å; F40-F313 AromaticContact CE2-CE2 3.91Å; F40-F313 HydrophobicContact CE2-CE2 3.91Å; F40-F313 AromaticContact CZ-CD2 3.56Å; F40-F313 HydrophobicContact CZ-CD2 3.56Å; F40-F313 HydrophobicContact CZ-CE2 4.09Å; F40-F313 HydrophobicContact CZ-CG 4.47Å; F303-F313 AromaticContact CD2-CE1 3.89Å; F303-F313 HydrophobicContact CD2-CE1 3.89Å; F303-F313 AromaticContact CD2-CZ 3.85Å; F303-F313 HydrophobicContact CD2-CZ 3.85Å; F303-F313 AromaticContact CE2-CE1 3.9Å; F303-F313 HydrophobicContact CE2-CE1 3.9Å; F303-F313 HydrophobicContact CE2-CZ 4.07Å; Y306-F313 HydrophobicContact CD2-CE2 4.39Å; Y306-F313 HydrophobicContact CD2-CZ 4.49Å; L307-F313 HydrophobicContact CD2-CD1 3.85Å; L307-F313 HydrophobicContact CD2-CE1 3.94Å; L307-F313 HydrophobicContact CG-CD1 4.13Å; L307-F313 HydrophobicContact CG-CE1 3.98Å; L310-F313 HydrophobicContact CB-CB 3.57Å; L310-F313 HydrophobicContact CD1-CB 4.37Å; L310-F313 WeakPolarHBondContact O-CB 3.25Å; L310-F313 PolarHBondContact O-N 2.86Å; R311-F313 VanDerWaalsContact C-N 3.29Å; R311-F313 PolarHBondContact O-N 3.11Å; F313-H315 PolarHBondContact O-N 3.32Å; F313-G316 PolarHBondContact O-N 3.5Å; F313-F317 WeakPolarHBondContact O-CB 3.25Å; F313-F317 PolarHBondContact O-N 3.35Å
314R95.7Very high93.1Very high94 Ų9470.6 Ų70.636%0.35534%0.341SS..Hα-helixtrans-57.6-48.1174-70.5-164.3-68.2-98.99.4112.9L307 I308 L310 R311 G316 F317 Q318L307-R314 HydrophobicContact CD2-CG 4.2Å; L307-R314 WeakPolarHBondContact O-CD 3.49Å; L307-R314 WeakPolarHBondContact O-CG 3.27Å; L307-R314 PolarHBondContact O-NH1 3.24Å; I308-R314 PolarHBondContact O-NH1 3.14Å; L310-R314 PolarHBondContact O-N 3.37Å; L310-R314 VanDerWaalsContact O-N 3.11Å; R311-R314 PolarHBondContact O-N 3.33Å; R314-G316 VanDerWaalsContact C-N 3.31Å; R314-G316 PolarHBondContact O-N 2.86Å; R314-F317 PolarHBondContact O-N 2.84Å; R314-Q318 WeakPolarHBondContact O-CB 3.44Å; R314-Q318 WeakPolarHBondContact O-CG 3.29Å; R314-Q318 PolarHBondContact O-N 3.28Å
315H93.6Very high92.2Very high86 Ų8673.6 Ų73.640%0.39835%0.351SS..Hα-helixtrans-63.2-39.5177.9-63.7166.6000111.6R311 N312 F313 R319R311-H315 PolarHBondContact NE-CE1 3.04Å; R311-H315 VanDerWaalsContact NE-CE1 3.28Å; R311-H315 PolarHBondContact NE-NE2 3.35Å; R311-H315 PolarHBondContact O-N 2.76Å; N312-H315 PolarHBondContact O-N 3.29Å; F313-H315 PolarHBondContact O-N 3.32Å; H315-R319 WeakPolarHBondContact O-CB 3.46Å; H315-R319 PolarHBondContact O-N 3.37Å
316G93.9Very high91.4Very high22 Ų2276.1 Ų76.123%0.22737%0.37CS..Hα-helixtrans-61.5-44.5174.900000112.4N312 F313 R314 R319 L320N312-G316 PolarHBondContact O-N 3.25Å; F313-G316 PolarHBondContact O-N 3.5Å; R314-G316 VanDerWaalsContact C-N 3.31Å; R314-G316 PolarHBondContact O-N 2.86Å; G316-R319 PolarHBondContact O-N 2.99Å; G316-L320 WeakPolarHBondContact O-CG 3.24Å; G316-L320 PolarHBondContact O-N 2.85Å
317F95.1Very high90.4Very high42 Ų4283.3 Ų83.318%0.18440%0.401CS..Hα-helixtrans-63-49176-177.7-114.7000112.3F35 I39 F303 L307 F313 R314 R319 L320 I321F35-F317 HydrophobicContact CD1-CD2 4.15Å; F35-F317 HydrophobicContact CD1-CE2 4.07Å; F35-F317 HydrophobicContact CD2-CE2 4.22Å; F35-F317 HydrophobicContact CE1-CD2 4.43Å; F35-F317 HydrophobicContact CE1-CE2 4.06Å; F35-F317 HydrophobicContact CE2-CE2 4.19Å; F35-F317 HydrophobicContact CG-CD2 4.38Å; F35-F317 HydrophobicContact CG-CE2 4.16Å; F35-F317 HydrophobicContact CZ-CE2 4.12Å; I39-F317 HydrophobicContact CD1-CB 3.75Å; I39-F317 HydrophobicContact CD1-CD2 4.14Å; I39-F317 HydrophobicContact CD1-CG 4.44Å; F303-F317 HydrophobicContact CE2-CD2 4.15Å; F303-F317 HydrophobicContact CE2-CE2 4.07Å; F303-F317 HydrophobicContact CZ-CD2 4.12Å; F303-F317 AromaticContact CZ-CE2 3.66Å; F303-F317 HydrophobicContact CZ-CE2 3.66Å; F303-F317 AromaticContact CZ-CZ 3.85Å; F303-F317 HydrophobicContact CZ-CZ 3.85Å; L307-F317 HydrophobicContact CD2-CB 4.12Å; L307-F317 HydrophobicContact CD2-CD1 3.85Å; L307-F317 HydrophobicContact CD2-CE1 4.47Å; L307-F317 HydrophobicContact CD2-CG 4.07Å; F313-F317 WeakPolarHBondContact O-CB 3.25Å; F313-F317 PolarHBondContact O-N 3.35Å; R314-F317 PolarHBondContact O-N 2.84Å; F317-R319 VanDerWaalsContact C-N 3.31Å; F317-R319 PolarHBondContact O-N 3.21Å; F317-L320 PolarHBondContact O-N 3.2Å; F317-L320 VanDerWaalsContact O-N 3.14Å; F317-I321 HydrophobicContact CD1-CD1 3.93Å; F317-I321 HydrophobicContact CD2-CD1 4.31Å; F317-I321 HydrophobicContact CE1-CD1 3.34Å; F317-I321 HydrophobicContact CE1-CG1 4.49Å; F317-I321 HydrophobicContact CE2-CD1 3.77Å; F317-I321 HydrophobicContact CE2-CG1 4.3Å; F317-I321 HydrophobicContact CG-CD1 4.4Å; F317-I321 HydrophobicContact CZ-CD1 3.27Å; F317-I321 HydrophobicContact CZ-CG1 4.26Å; F317-I321 PolarHBondContact O-N 3.22Å
318Q94.3Very high89.3Confident113 Ų11389.4 Ų89.453%0.52843%0.426SS..Hα-helixtrans-56.6-45.4175.4-74.5173.7-21.300111.2R314 L320 I321 C322R314-Q318 WeakPolarHBondContact O-CB 3.44Å; R314-Q318 WeakPolarHBondContact O-CG 3.29Å; R314-Q318 PolarHBondContact O-N 3.28Å; Q318-L320 VanDerWaalsContact C-N 3.34Å; Q318-L320 PolarHBondContact O-N 3.03Å; Q318-I321 PolarHBondContact O-N 3.1Å; Q318-C322 WeakPolarHBondContact O-CB 3.42Å; Q318-C322 PolarHBondContact O-N 3.23Å; Q318-C322 PolarHBondContact O-SG 2.63Å
319R92.5Very high88.3Confident193 Ų19388.2 Ų88.273%0.72842%0.424SS*.Hα-helixtrans-61.9-40.3177.5-173.1177.9179.4-178.42.4112.3H315 G316 F317 T323H315-R319 WeakPolarHBondContact O-CB 3.46Å; H315-R319 PolarHBondContact O-N 3.37Å; G316-R319 PolarHBondContact O-N 2.99Å; F317-R319 VanDerWaalsContact C-N 3.31Å; F317-R319 PolarHBondContact O-N 3.21Å; R319-T323 WeakPolarHBondContact O-CB 2.84Å; R319-T323 PolarHBondContact O-N 2.85Å; R319-T323 PolarHBondContact O-OG1 3.48Å
320L91.1Very high87.1Confident30 Ų3088.1 Ų88.116%0.15743%0.433CS..Hα-helixtrans-63-48.5176.4-74.1174.7000111.3F35 L38 I39 K42 G316 F317 Q318 T323 V324F35-L320 HydrophobicContact CD1-CD1 4.45Å; L38-L320 HydrophobicContact CB-CD1 4.44Å; I39-L320 HydrophobicContact CD1-CD1 4.22Å; I39-L320 HydrophobicContact CG1-CD1 3.41Å; I39-L320 VanDerWaalsContact CG1-CD1 3.41Å; K42-L320 HydrophobicContact CD-CD2 4.14Å; K42-L320 VanDerWaalsContact NZ-CD2 3.28Å; G316-L320 WeakPolarHBondContact O-CG 3.24Å; G316-L320 PolarHBondContact O-N 2.85Å; F317-L320 PolarHBondContact O-N 3.2Å; F317-L320 VanDerWaalsContact O-N 3.14Å; Q318-L320 VanDerWaalsContact C-N 3.34Å; Q318-L320 PolarHBondContact O-N 3.03Å; L320-T323 PolarHBondContact O-N 3.08Å; L320-V324 WeakPolarHBondContact O-CG2 3.38Å; L320-V324 PolarHBondContact O-N 3.3Å; L320-V324 VanDerWaalsContact O-N 3.07Å
321I89.9Confident85.9Confident83 Ų8391.2 Ų91.243%0.42646%0.456SS..Hα-helixtrans-62.5-48178.2-68.8178.9000111.1F317 Q318 T323 V324 Y325F317-I321 HydrophobicContact CD1-CD1 3.93Å; F317-I321 HydrophobicContact CD2-CD1 4.31Å; F317-I321 HydrophobicContact CE1-CD1 3.34Å; F317-I321 HydrophobicContact CE1-CG1 4.49Å; F317-I321 HydrophobicContact CE2-CD1 3.77Å; F317-I321 HydrophobicContact CE2-CG1 4.3Å; F317-I321 HydrophobicContact CG-CD1 4.4Å; F317-I321 HydrophobicContact CZ-CD1 3.27Å; F317-I321 HydrophobicContact CZ-CG1 4.26Å; F317-I321 PolarHBondContact O-N 3.22Å; Q318-I321 PolarHBondContact O-N 3.1Å; I321-T323 VanDerWaalsContact C-N 3.3Å; I321-T323 PolarHBondContact O-N 3.37Å; I321-V324 PolarHBondContact O-N 3.05Å; I321-Y325 WeakPolarHBondContact O-CB 3.32Å; I321-Y325 PolarHBondContact O-N 3.18Å
322C89.6Confident84.3Confident73 Ų7386.5 Ų86.549%0.49346%0.455SS..Hα-helixtrans-60.9-39.5178.1-69.20000111.7Q318 V324 Y325 C326Q318-C322 WeakPolarHBondContact O-CB 3.42Å; Q318-C322 PolarHBondContact O-N 3.23Å; Q318-C322 PolarHBondContact O-SG 2.63Å; C322-V324 VanDerWaalsContact C-N 3.33Å; C322-V324 PolarHBondContact O-N 3.33Å; C322-Y325 PolarHBondContact O-N 3.41Å; C322-C326 WeakPolarHBondContact O-CB 3.37Å; C322-C326 PolarHBondContact O-N 2.58Å; C322-C326 PolarHBondContact O-SG 2.93Å
323T84.7Confident82.7Confident65 Ų6587.4 Ų87.440%0.39947%0.466SS..Hα-helixtrans-64-40.4177.2-560000111.4R319 L320 I321 K327R319-T323 WeakPolarHBondContact O-CB 2.84Å; R319-T323 PolarHBondContact O-N 2.85Å; R319-T323 PolarHBondContact O-OG1 3.48Å; L320-T323 PolarHBondContact O-N 3.08Å; I321-T323 VanDerWaalsContact C-N 3.3Å; I321-T323 PolarHBondContact O-N 3.37Å; T323-K327 HydrophobicContact CG2-CD 4.46Å; T323-K327 WeakPolarHBondContact O-CB 3.21Å; T323-K327 WeakPolarHBondContact O-CG 3.08Å; T323-K327 PolarHBondContact O-N 2.74Å
324V80.9Confident80.9Confident105 Ų10594.5 Ų94.564%0.63650%0.503SS*.Hα-helixtrans-64.9-43175.11730000110.6L320 I321 C322 K328L320-V324 WeakPolarHBondContact O-CG2 3.38Å; L320-V324 PolarHBondContact O-N 3.3Å; L320-V324 VanDerWaalsContact O-N 3.07Å; I321-V324 PolarHBondContact O-N 3.05Å; C322-V324 VanDerWaalsContact C-N 3.33Å; C322-V324 PolarHBondContact O-N 3.33Å; V324-K328 WeakPolarHBondContact O-CB 3.33Å; V324-K328 PolarHBondContact O-N 2.73Å
325Y80.1Confident78.7Confident159 Ų15998 Ų9862%0.62452%0.523SS*.Hα-helixtrans-63.7-50.4177.3-172.4-97.2000112.2I321 C322 K327 K328 V329I321-Y325 WeakPolarHBondContact O-CB 3.32Å; I321-Y325 PolarHBondContact O-N 3.18Å; C322-Y325 PolarHBondContact O-N 3.41Å; Y325-K327 PolarHBondContact O-N 2.95Å; Y325-K328 WeakPolarHBondContact O-CB 3.48Å; Y325-K328 PolarHBondContact O-N 3.35Å; Y325-K328 VanDerWaalsContact O-N 3.12Å; Y325-V329 HydrophobicContact CD1-CG2 4.13Å; Y325-V329 HydrophobicContact CE1-CG2 3.78Å; Y325-V329 WeakPolarHBondContact O-CG2 3.22Å; Y325-V329 PolarHBondContact O-N 3.29Å
326C80.3Confident76.6Confident81 Ų81104.4 Ų104.455%0.54754%0.544SS..Hα-helixtrans-62.7-38.8179-68.10000112.5C322 K328 V329 S330C322-C326 WeakPolarHBondContact O-CB 3.37Å; C322-C326 PolarHBondContact O-N 2.58Å; C322-C326 PolarHBondContact O-SG 2.93Å; C326-K328 VanDerWaalsContact C-N 3.34Å; C326-V329 PolarHBondContact O-N 3.15Å; C326-S330 PolarHBondContact O-N 3.37Å
327K77.2Confident74.6Confident152 Ų152108.9 Ų108.966%0.66157%0.569SS**Hα-helixtrans-63.4-40173.1-78.7-174.1175.5-1670112T323 Y325 S330 S331T323-K327 HydrophobicContact CG2-CD 4.46Å; T323-K327 WeakPolarHBondContact O-CB 3.21Å; T323-K327 WeakPolarHBondContact O-CG 3.08Å; T323-K327 PolarHBondContact O-N 2.74Å; Y325-K327 PolarHBondContact O-N 2.95Å; K327-S330 PolarHBondContact O-N 3.24Å; K327-S331 WeakPolarHBondContact O-CB 3.16Å; K327-S331 PolarHBondContact O-N 3.5Å
328K73.8Confident72.6Confident166 Ų166116 Ų11672%0.72260%0.603SS**Hα-helixtrans-64.8-41.6177-166.3175.2-177.9179.90111.8V324 Y325 C326 S331 G332V324-K328 WeakPolarHBondContact O-CB 3.33Å; V324-K328 PolarHBondContact O-N 2.73Å; Y325-K328 WeakPolarHBondContact O-CB 3.48Å; Y325-K328 PolarHBondContact O-N 3.35Å; Y325-K328 VanDerWaalsContact O-N 3.12Å; C326-K328 VanDerWaalsContact C-N 3.34Å; K328-S331 PolarHBondContact O-N 3Å; K328-G332 PolarHBondContact O-N 3.05Å
329V75.5Confident70.6Confident82 Ų82121.8 Ų121.850%0.49762%0.62SS.*Hα-helixtrans-62.9-47.1175.6174.70000111.3Y325 C326 S331 G332 S333Y325-V329 HydrophobicContact CD1-CG2 4.13Å; Y325-V329 HydrophobicContact CE1-CG2 3.78Å; Y325-V329 WeakPolarHBondContact O-CG2 3.22Å; Y325-V329 PolarHBondContact O-N 3.29Å; C326-V329 PolarHBondContact O-N 3.15Å; V329-S331 VanDerWaalsContact C-N 3.34Å; V329-S331 PolarHBondContact O-N 2.72Å; V329-G332 PolarHBondContact O-N 3Å; V329-S333 PolarHBondContact O-N 2.85Å; V329-S333 PolarHBondContact O-OG 2.97Å
330S70.8Confident68.6Low75 Ų75118.4 Ų118.452%0.52462%0.621SS.*Hα-helixtrans-65.6-32.9179179.70000113.6C326 K327 S333C326-S330 PolarHBondContact O-N 3.37Å; K327-S330 PolarHBondContact O-N 3.24Å; S330-S333 PolarHBondContact O-OG 3.3Å
331S67.8Low66.7Low77 Ų77125.9 Ų125.954%0.53866%0.655SS.*Hα-helixtrans-75.1-33.5176.1-166.10000112.2K327 K328 V329 S333 L334K327-S331 WeakPolarHBondContact O-CB 3.16Å; K327-S331 PolarHBondContact O-N 3.5Å; K328-S331 PolarHBondContact O-N 3Å; V329-S331 VanDerWaalsContact C-N 3.34Å; V329-S331 PolarHBondContact O-N 2.72Å; S331-S333 VanDerWaalsContact C-N 3.33Å; S331-L334 PolarHBondContact O-N 2.98Å
332G58.7Low65.3Low56 Ų56132.8 Ų132.858%0.57769%0.693SS**Hα-helixtrans-67-32.2175.900000113.2K328 V329 L334K328-G332 PolarHBondContact O-N 3.05Å; V329-G332 PolarHBondContact O-N 3Å; G332-L334 VanDerWaalsContact C-N 3.34Å
333S57.9Low64Low81 Ų81135.8 Ų135.857%0.56670%0.703SS**Hα-helixtrans-72.8-21.8175.350.30000114.3V329 S330 S331 H335V329-S333 PolarHBondContact O-N 2.85Å; V329-S333 PolarHBondContact O-OG 2.97Å; S330-S333 PolarHBondContact O-OG 3.3Å; S331-S333 VanDerWaalsContact C-N 3.33Å; S333-H335 VanDerWaalsContact C-N 3.35Å
334L55.4Low62.9Low149 Ų149139.5 Ų139.578%0.7872%0.719SS**Hα-helixtrans-79.5-17.2179.5-129.788000113.2S331 G332 R336S331-L334 PolarHBondContact O-N 2.98Å; G332-L334 VanDerWaalsContact C-N 3.34Å; L334-R336 VanDerWaalsContact C-N 3.35Å; L334-R336 PolarHBondContact O-N 3.18Å
335H50.6Low62Low167 Ų167141.4 Ų141.477%0.77372%0.723SS**THydrogen-bonded Turntrans-94.829.4178.2-88.4-36.7000113.6S333 P337S333-H335 VanDerWaalsContact C-N 3.35Å; H335-P337 WeakPolarHBondContact O-CD 3.17Å
336R49.8Very low60.9Low222 Ų222140.4 Ų140.484%0.83873%0.729SS**  trans-73.6112.4166.3-146179.9-161-170.64.3107.6L334 Q338L334-R336 VanDerWaalsContact C-N 3.35Å; L334-R336 PolarHBondContact O-N 3.18Å; R336-Q338 PolarHBondContact O-N 3.36Å
337P51.1Low59.7Low116 Ų116144.1 Ų144.175%0.75374%0.741SS**  trans-63.5132.1-178.516.4-16000109.2H335 R339H335-P337 WeakPolarHBondContact O-CD 3.17Å; P337-R339 PolarHBondContact O-N 3.11Å; P337-R339 VanDerWaalsContact O-N 3.12Å
338Q52.9Low58.5Low191 Ų191143.5 Ų143.589%0.89375%0.746SS**  trans-54.6118.9166.4-79.9175.7-43.400107.2R336 T340R336-Q338 PolarHBondContact O-N 3.36Å; Q338-T340 PolarHBondContact O-N 3.12Å; Q338-T340 VanDerWaalsContact O-N 3.11Å
339R51.6Low57.4Low234 Ų234141.9 Ų141.988%0.88375%0.748SS**  trans-56.3114.1173.8-163.2-179.1-134.2177.6-0.3106.5P337 E341P337-R339 PolarHBondContact O-N 3.11Å; P337-R339 VanDerWaalsContact O-N 3.12Å; R339-E341 PolarHBondContact O-N 3.13Å; R339-E341 VanDerWaalsContact O-N 3.13Å
340T51.4Low56Low123 Ų123146.5 Ų146.576%0.75577%0.767SS**  trans-58.7113.2166.537.90000107.1Q338 D342Q338-T340 PolarHBondContact O-N 3.12Å; Q338-T340 VanDerWaalsContact O-N 3.11Å; T340-D342 PolarHBondContact O-N 3.44Å
341E51.8Low54.8Low187 Ų187152.5 Ų152.587%0.87479%0.787SS**  trans-73.3109.8163-69.7176.8158.400106.2R339R339-E341 PolarHBondContact O-N 3.13Å; R339-E341 VanDerWaalsContact O-N 3.13Å
342D58.8Low53.6Low227 Ų227159.4 Ų159.4100%1.21481%0.81SS**  trans-111.60155-74.8-31.9000107.6T340T340-D342 PolarHBondContact O-N 3.44Å

Retrieved 342 of 342 residues in 99.1 ms (Link to these results)

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