G4V6S5_SCHMA Loading...

Putative amine GPCR

AlphaFold DB , UniProt , Accession G4V6S5, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 354 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
1M33.3Very low60.8Low209 Ų20999.7 Ų99.7100%1.0358%0.582SS**  086.80-109-178.3173.400108.5
2F42.1Very low63.2Low139 Ų13993.8 Ų93.861%0.6154%0.542SS*.  trans-107.686.4-178.6-62.2-74.2000107.6D4F2-D4 PolarHBondContact O-N 3.13Å; F2-D4 VanDerWaalsContact O-N 3.07Å
3G40.8Very low65.3Low50 Ų5090.5 Ų90.552%0.51552%0.516SS..  trans-61.7110.1172.700000108.8
4D44.6Very low67.2Low123 Ų12391.4 Ų91.466%0.65852%0.517SS*.  trans23.298.6157.7-122.624.6000115.4F2 S6 V7F2-D4 PolarHBondContact O-N 3.13Å; F2-D4 VanDerWaalsContact O-N 3.07Å; D4-S6 VanDerWaalsContact CB-OG 3.29Å; D4-S6 WeakPolarHBondContact CB-OG 3.43Å; D4-S6 PolarHBondContact O-N 2.8Å; D4-S6 PolarHBondContact OD2-OG 3.33Å; D4-V7 PolarHBondContact O-N 2.84Å
5N51.3Low69Low131 Ų13193.7 Ų93.770%0.70152%0.519SS*.THydrogen-bonded Turntrans-56.50.3168.9-74.1-32000113.5V7N5-V7 VanDerWaalsContact C-N 3.29Å; N5-V7 PolarHBondContact O-N 2.73Å
6S53.1Low70.5Confident87 Ų8788 Ų8861%0.60849%0.488SS*.THydrogen-bonded Turntrans-68.3-18.8178.4590000114D4D4-S6 VanDerWaalsContact CB-OG 3.29Å; D4-S6 WeakPolarHBondContact CB-OG 3.43Å; D4-S6 PolarHBondContact O-N 2.8Å; D4-S6 PolarHBondContact OD2-OG 3.33Å
7V67.2Low71.8Confident96 Ų9683.8 Ų83.858%0.58247%0.466SS*.SBendtrans-85.6-26.6-173.2-175.50000113.8D4 N5D4-V7 PolarHBondContact O-N 2.84Å; N5-V7 VanDerWaalsContact C-N 3.29Å; N5-V7 PolarHBondContact O-N 2.73Å
8I76.1Confident73.1Confident13 Ų1384.9 Ų84.97%0.06747%0.47CS..SBendtrans-104.9117.3-174.5-62.4147.4000109.5S10 Y12 Y13 L290 R293I8-S10 PolarHBondContact O-N 2.73Å; I8-Y12 HydrophobicContact CG2-CD1 3.6Å; I8-Y12 HydrophobicContact CG2-CE1 4.45Å; I8-Y12 HydrophobicContact CG2-CG 3.97Å; I8-Y13 HydrophobicContact CB-CE2 3.95Å; I8-Y13 HydrophobicContact CG2-CD2 4.07Å; I8-Y13 HydrophobicContact CG2-CE2 3.53Å; I8-L290 HydrophobicContact CG2-CD1 4.34Å; I8-R293 VanDerWaalsContact CD1-CD 3.4Å
9P84.2Confident74.2Confident70 Ų7081.3 Ų81.346%0.45545%0.452SS..  trans-55.5135.5-179.6-2533.4000111.6V11 Y12P9-V11 HydrophobicContact CB-CB 4.41Å; P9-V11 PolarHBondContact O-N 3.23Å; P9-Y12 WeakPolarHBondContact O-CB 3.4Å; P9-Y12 PolarHBondContact O-N 3.49Å
10S86.5Confident75.2Confident94 Ų9477.5 Ų77.566%0.65743%0.431SS*.Hα-helixtrans-54.1-28.5174.9-47.80000112.5I8 Y12 Y13 I14I8-S10 PolarHBondContact O-N 2.73Å; S10-Y12 VanDerWaalsContact C-N 3.29Å; S10-Y12 PolarHBondContact O-N 3.45Å; S10-Y13 PolarHBondContact O-N 3.14Å; S10-I14 PolarHBondContact O-N 3.11Å
11V89.4Confident76.2Confident85 Ų8577.8 Ų77.852%0.51543%0.431SS..Hα-helixtrans-57-39.6173.7178.80000112.2P9 Y13 I14 F15P9-V11 HydrophobicContact CB-CB 4.41Å; P9-V11 PolarHBondContact O-N 3.23Å; V11-Y13 PolarHBondContact O-N 3.06Å; V11-I14 PolarHBondContact O-N 3.15Å; V11-F15 HydrophobicContact CG1-CD2 3.58Å; V11-F15 HydrophobicContact CG1-CE2 3.35Å; V11-F15 WeakPolarHBondContact O-CD2 3.39Å; V11-F15 PolarHBondContact O-N 3.4Å; V11-F15 VanDerWaalsContact O-N 3.11Å
12Y89.7Confident79.1Confident28 Ų2869.5 Ų69.511%0.1139%0.393CS..Hα-helixtrans-60.9-46176.3167.9-89.8000111.1I8 P9 S10 I14 F15 A16 L66 L290 R293 L294 F297I8-Y12 HydrophobicContact CG2-CD1 3.6Å; I8-Y12 HydrophobicContact CG2-CE1 4.45Å; I8-Y12 HydrophobicContact CG2-CG 3.97Å; P9-Y12 WeakPolarHBondContact O-CB 3.4Å; P9-Y12 PolarHBondContact O-N 3.49Å; S10-Y12 VanDerWaalsContact C-N 3.29Å; S10-Y12 PolarHBondContact O-N 3.45Å; Y12-I14 VanDerWaalsContact C-N 3.29Å; Y12-I14 PolarHBondContact O-N 3.26Å; Y12-F15 PolarHBondContact O-N 3.16Å; Y12-A16 HydrophobicContact CE1-CB 4.09Å; Y12-A16 VanDerWaalsContact O-CB 3.27Å; Y12-A16 WeakPolarHBondContact O-CB 3.41Å; Y12-A16 PolarHBondContact O-N 3.2Å; Y12-L66 HydrophobicContact CE1-CD1 4Å; Y12-L290 HydrophobicContact CD2-CD1 4.39Å; Y12-R293 HydrophobicContact CE1-CB 4.08Å; Y12-R293 HydrophobicContact CE1-CG 4.43Å; Y12-R293 HydrophobicContact CE2-CB 4.21Å; Y12-R293 WeakPolarHBondContact OH-CB 3.38Å; Y12-R293 PolarHBondContact OH-O 2.89Å; Y12-L294 HydrophobicContact CE2-CD2 4.45Å; Y12-F297 HydrophobicContact CE2-CB 4.04Å; Y12-F297 HydrophobicContact CE2-CG 4.3Å
13Y90.4Very high81.7Confident52 Ų5262.9 Ų62.920%0.20436%0.364CS..Hα-helixtrans-60.1-40.5179.7-72.5-87000111.7I8 S10 V11 S17 L66 R293I8-Y13 HydrophobicContact CB-CE2 3.95Å; I8-Y13 HydrophobicContact CG2-CD2 4.07Å; I8-Y13 HydrophobicContact CG2-CE2 3.53Å; S10-Y13 PolarHBondContact O-N 3.14Å; V11-Y13 PolarHBondContact O-N 3.06Å; Y13-S17 VanDerWaalsContact O-CB 3.25Å; Y13-S17 WeakPolarHBondContact O-CB 3.47Å; Y13-S17 PolarHBondContact O-N 2.83Å; Y13-S17 PolarHBondContact O-OG 2.8Å; Y13-L66 HydrophobicContact CD1-CD1 3.5Å; Y13-L66 VanDerWaalsContact CD1-CD1 3.5Å; Y13-L66 HydrophobicContact CD1-CG 3.97Å; Y13-L66 HydrophobicContact CE1-CD1 3.77Å; Y13-L66 HydrophobicContact CE1-CG 4.44Å; Y13-L66 HydrophobicContact CG-CD1 4.49Å; Y13-R293 VanDerWaalsContact CE1-NH1 3.31Å; Y13-R293 PolarHBondContact OH-NH1 2.88Å; Y13-R293 PolarHBondContact OH-NH2 3.33Å
14I92.4Very high84.4Confident102 Ų10261.7 Ų61.752%0.52335%0.347SS..Hα-helixtrans-62.8-50.9177.4-63169.2000110.5S10 V11 Y12 S17 I18S10-I14 PolarHBondContact O-N 3.11Å; V11-I14 PolarHBondContact O-N 3.15Å; Y12-I14 VanDerWaalsContact C-N 3.29Å; Y12-I14 PolarHBondContact O-N 3.26Å; I14-S17 PolarHBondContact O-N 2.72Å; I14-I18 HydrophobicContact CG2-CD1 3.93Å; I14-I18 VanDerWaalsContact O-CG1 3.31Å; I14-I18 WeakPolarHBondContact O-CG1 3.34Å; I14-I18 PolarHBondContact O-N 2.85Å
15F93.6Very high86.8Confident127 Ų12760.9 Ų60.956%0.55734%0.342SS*.Hα-helixtrans-65.5-43.4-179.2-76.9-62.2000112.9V11 Y12 I18 A19 F297V11-F15 HydrophobicContact CG1-CD2 3.58Å; V11-F15 HydrophobicContact CG1-CE2 3.35Å; V11-F15 WeakPolarHBondContact O-CD2 3.39Å; V11-F15 PolarHBondContact O-N 3.4Å; V11-F15 VanDerWaalsContact O-N 3.11Å; Y12-F15 PolarHBondContact O-N 3.16Å; F15-I18 PolarHBondContact O-N 3.22Å; F15-A19 WeakPolarHBondContact O-CB 3.42Å; F15-A19 PolarHBondContact O-N 3.11Å; F15-F297 HydrophobicContact CB-CE2 4.49Å
16A92.8Very high89Confident2 Ų259 Ų592%0.01733%0.328CS..Hα-helixtrans-59.7-47.5175.800000110.7Y12 I18 A19 D20 L66 F297Y12-A16 HydrophobicContact CE1-CB 4.09Å; Y12-A16 VanDerWaalsContact O-CB 3.27Å; Y12-A16 WeakPolarHBondContact O-CB 3.41Å; Y12-A16 PolarHBondContact O-N 3.2Å; A16-I18 VanDerWaalsContact C-N 3.35Å; A16-I18 PolarHBondContact O-N 2.66Å; A16-A19 WeakPolarHBondContact O-CB 3.48Å; A16-A19 PolarHBondContact O-N 2.91Å; A16-A19 VanDerWaalsContact O-N 3.15Å; A16-D20 WeakPolarHBondContact O-CB 3.47Å; A16-D20 PolarHBondContact O-N 3.45Å; A16-D20 VanDerWaalsContact O-OD1 3.12Å; A16-L66 HydrophobicContact CB-CD1 4.29Å; A16-L66 HydrophobicContact CB-CD2 3.82Å; A16-F297 HydrophobicContact CB-CD2 4.11Å
17S93.3Very high91.1Very high16 Ų1654.9 Ų54.911%0.11230%0.299CS..Hα-helixtrans-59.9-43178.9-56.30000112.9Y13 I14 I21 L66 F67Y13-S17 VanDerWaalsContact O-CB 3.25Å; Y13-S17 WeakPolarHBondContact O-CB 3.47Å; Y13-S17 PolarHBondContact O-N 2.83Å; Y13-S17 PolarHBondContact O-OG 2.8Å; I14-S17 PolarHBondContact O-N 2.72Å; S17-I21 WeakPolarHBondContact O-CB 3.21Å; S17-I21 WeakPolarHBondContact O-CD1 3.39Å; S17-I21 WeakPolarHBondContact O-CG1 3.31Å; S17-I21 PolarHBondContact O-N 3.29Å; S17-L66 WeakPolarHBondContact OG-CD2 3.5Å; S17-F67 WeakPolarHBondContact OG-CZ 3.25Å
18I94.6Very high92.4Very high104 Ų10454.5 Ų54.553%0.53329%0.293SS..Hα-helixtrans-63.5-46.5177.1-68.4167.3000110.1I14 F15 A16 S22I14-I18 HydrophobicContact CG2-CD1 3.93Å; I14-I18 VanDerWaalsContact O-CG1 3.31Å; I14-I18 WeakPolarHBondContact O-CG1 3.34Å; I14-I18 PolarHBondContact O-N 2.85Å; F15-I18 PolarHBondContact O-N 3.22Å; A16-I18 VanDerWaalsContact C-N 3.35Å; A16-I18 PolarHBondContact O-N 2.66Å; I18-S22 WeakPolarHBondContact O-CB 3.44Å; I18-S22 PolarHBondContact O-N 3.44Å; I18-S22 PolarHBondContact O-OG 3.27Å; I18-S22 VanDerWaalsContact O-OG 3.1Å
19A94.1Very high93.3Very high17 Ų1757.5 Ų57.514%0.1431%0.306CS..Hα-helixtrans-58.5-52.217800000110.5F15 A16 S22 G23 F297 S304F15-A19 WeakPolarHBondContact O-CB 3.42Å; F15-A19 PolarHBondContact O-N 3.11Å; A16-A19 WeakPolarHBondContact O-CB 3.48Å; A16-A19 PolarHBondContact O-N 2.91Å; A16-A19 VanDerWaalsContact O-N 3.15Å; A19-S22 PolarHBondContact O-N 2.98Å; A19-S22 PolarHBondContact O-OG 3.33Å; A19-G23 PolarHBondContact O-N 3.31Å; A19-F297 HydrophobicContact CB-CE2 4.13Å; A19-S304 PolarHBondContact O-OG 2.81Å
20D94Very high93.8Very high5 Ų554.2 Ų54.23%0.02728%0.284CS..Hα-helixtrans-63.6-47.3-176.3-56.4-11.6000112.3A16 S22 G23 V24 I63 V300A16-D20 WeakPolarHBondContact O-CB 3.47Å; A16-D20 PolarHBondContact O-N 3.45Å; A16-D20 VanDerWaalsContact O-OD1 3.12Å; D20-S22 PolarHBondContact O-N 3.32Å; D20-G23 PolarHBondContact O-N 3.31Å; D20-V24 WeakPolarHBondContact O-CG2 3.49Å; D20-V24 PolarHBondContact O-N 2.88Å; D20-I63 HydrophobicContact CB-CD1 3.96Å; D20-I63 HydrophobicContact CB-CG1 3.29Å; D20-V300 HydrophobicContact CB-CG1 4.37Å; D20-V300 WeakPolarHBondContact OD1-CG1 3.42Å
21I95.8Very high94.2Very high84 Ų8452.4 Ų52.443%0.43127%0.267SS..Hα-helixtrans-62-45.7177.7-68.3167.8000110.2S17 G23 V24 L25 I63S17-I21 WeakPolarHBondContact O-CB 3.21Å; S17-I21 WeakPolarHBondContact O-CD1 3.39Å; S17-I21 WeakPolarHBondContact O-CG1 3.31Å; S17-I21 PolarHBondContact O-N 3.29Å; I21-G23 VanDerWaalsContact C-N 3.27Å; I21-G23 PolarHBondContact O-N 3.3Å; I21-V24 PolarHBondContact O-N 3.06Å; I21-L25 HydrophobicContact CG2-CD1 4.01Å; I21-L25 HydrophobicContact CG2-CG 4.49Å; I21-L25 WeakPolarHBondContact O-CG 3.21Å; I21-L25 PolarHBondContact O-N 2.81Å; I21-I63 HydrophobicContact CG1-CD1 3.93Å
22S95.5Very high94.3Very high34 Ų3452.8 Ų52.824%0.23827%0.265CS..Hα-helixtrans-62-39.1177.577.20000111.4I18 A19 D20 L25 F26I18-S22 WeakPolarHBondContact O-CB 3.44Å; I18-S22 PolarHBondContact O-N 3.44Å; I18-S22 PolarHBondContact O-OG 3.27Å; I18-S22 VanDerWaalsContact O-OG 3.1Å; A19-S22 PolarHBondContact O-N 2.98Å; A19-S22 PolarHBondContact O-OG 3.33Å; D20-S22 PolarHBondContact O-N 3.32Å; S22-L25 PolarHBondContact O-N 3.24Å; S22-F26 WeakPolarHBondContact O-CB 3.37Å; S22-F26 WeakPolarHBondContact O-CD2 3.43Å; S22-F26 WeakPolarHBondContact O-CG 3.24Å; S22-F26 PolarHBondContact O-N 3.06Å
23G96.3Very high94.4Very high0 Ų052.3 Ų52.30%026%0.264CS..Hα-helixtrans-61-48.317700000112.4A19 D20 I21 L25 N27 S304A19-G23 PolarHBondContact O-N 3.31Å; D20-G23 PolarHBondContact O-N 3.31Å; I21-G23 VanDerWaalsContact C-N 3.27Å; I21-G23 PolarHBondContact O-N 3.3Å; G23-L25 PolarHBondContact O-N 3.5Å; G23-N27 VanDerWaalsContact O-CB 3.25Å; G23-N27 WeakPolarHBondContact O-CB 3.3Å; G23-N27 PolarHBondContact O-N 3.26Å; G23-N27 PolarHBondContact O-ND2 2.93Å; G23-S304 VanDerWaalsContact CA-OG 3.27Å; G23-S304 WeakPolarHBondContact CA-OG 3.4Å
24V96.9Very high94.4Very high25 Ų2549.9 Ų49.915%0.15225%0.254CS..Hα-helixtrans-58.9-49.6175.3175.30000110.7D20 I21 N27 I28 C59 F60 I63D20-V24 WeakPolarHBondContact O-CG2 3.49Å; D20-V24 PolarHBondContact O-N 2.88Å; I21-V24 PolarHBondContact O-N 3.06Å; V24-N27 PolarHBondContact O-N 3.27Å; V24-I28 HydrophobicContact CG1-CD1 3.69Å; V24-I28 HydrophobicContact CG1-CG1 4.45Å; V24-I28 VanDerWaalsContact O-CG1 3.3Å; V24-I28 WeakPolarHBondContact O-CG1 3.41Å; V24-I28 PolarHBondContact O-N 3.14Å; V24-C59 HydrophobicContact CG2-CB 3.64Å; V24-F60 HydrophobicContact CG2-CB 4.05Å; V24-I63 HydrophobicContact CG2-CD1 3.99Å
25L96.4Very high94.2Very high106 Ų10648.4 Ų48.456%0.55525%0.253SS*.Hα-helixtrans-63.2-45.9-177.7-68.7175.9000112.6I21 S22 G23 I28 F29I21-L25 HydrophobicContact CG2-CD1 4.01Å; I21-L25 HydrophobicContact CG2-CG 4.49Å; I21-L25 WeakPolarHBondContact O-CG 3.21Å; I21-L25 PolarHBondContact O-N 2.81Å; S22-L25 PolarHBondContact O-N 3.24Å; G23-L25 PolarHBondContact O-N 3.5Å; L25-I28 PolarHBondContact O-N 3.29Å; L25-F29 WeakPolarHBondContact O-CB 3.06Å; L25-F29 PolarHBondContact O-N 2.7Å
26F96Very high93.9Very high91 Ų9149.3 Ų49.340%0.39926%0.257SS..Hα-helixtrans-68-36.1179.6-70.7-44.4000112.6S22 T30 P307 I308S22-F26 WeakPolarHBondContact O-CB 3.37Å; S22-F26 WeakPolarHBondContact O-CD2 3.43Å; S22-F26 WeakPolarHBondContact O-CG 3.24Å; S22-F26 PolarHBondContact O-N 3.06Å; F26-T30 WeakPolarHBondContact O-CB 3.01Å; F26-T30 PolarHBondContact O-N 3.02Å; F26-T30 PolarHBondContact O-OG1 3.43Å; F26-P307 HydrophobicContact CB-CB 4.24Å; F26-P307 HydrophobicContact CB-CG 4.45Å; F26-I308 HydrophobicContact CD2-CD1 4.01Å; F26-I308 HydrophobicContact CD2-CG1 4.38Å; F26-I308 HydrophobicContact CE2-CD1 3.99Å
27N96.8Very high93.4Very high1 Ų149.5 Ų49.51%0.00526%0.258CS..Hα-helixtrans-66.8-45.9175.1-86-65.1000112G23 V24 T30 L31 C52 D55 S303 P307G23-N27 VanDerWaalsContact O-CB 3.25Å; G23-N27 WeakPolarHBondContact O-CB 3.3Å; G23-N27 PolarHBondContact O-N 3.26Å; G23-N27 PolarHBondContact O-ND2 2.93Å; V24-N27 PolarHBondContact O-N 3.27Å; N27-T30 PolarHBondContact O-N 3.49Å; N27-L31 WeakPolarHBondContact O-CB 3.38Å; N27-L31 PolarHBondContact O-N 3.12Å; N27-C52 WeakPolarHBondContact CB-O 3.15Å; N27-C52 WeakPolarHBondContact OD1-CA 3.17Å; N27-C52 PolarHBondContact OD1-O 3.07Å; N27-D55 WeakPolarHBondContact OD1-CB 3.48Å; N27-S303 PolarHBondContact ND2-O 3.19Å; N27-P307 HydrophobicContact CB-CG 4.34Å; N27-P307 VanDerWaalsContact CG-CG 3.45Å; N27-P307 WeakPolarHBondContact OD1-CG 3.17Å
28I96.5Very high92.7Very high88 Ų8853 Ų5345%0.45128%0.275SS..Hα-helixtrans-60.7-48.6175.2-68.8170000110.6V24 L25 T30 L31 I32V24-I28 HydrophobicContact CG1-CD1 3.69Å; V24-I28 HydrophobicContact CG1-CG1 4.45Å; V24-I28 VanDerWaalsContact O-CG1 3.3Å; V24-I28 WeakPolarHBondContact O-CG1 3.41Å; V24-I28 PolarHBondContact O-N 3.14Å; L25-I28 PolarHBondContact O-N 3.29Å; I28-T30 VanDerWaalsContact C-N 3.31Å; I28-T30 PolarHBondContact O-N 3.29Å; I28-L31 PolarHBondContact O-N 3.39Å; I28-I32 HydrophobicContact CG2-CD1 3.85Å; I28-I32 VanDerWaalsContact O-CG1 3.3Å; I28-I32 WeakPolarHBondContact O-CG1 3.3Å; I28-I32 PolarHBondContact O-N 3.36Å
29F94.8Very high91.8Very high77 Ų7748.4 Ų48.434%0.33825%0.252SS..Hα-helixtrans-56.9-47178.2172-99.1000111.5L25 I32 F33 L311 L321L25-F29 WeakPolarHBondContact O-CB 3.06Å; L25-F29 PolarHBondContact O-N 2.7Å; F29-I32 PolarHBondContact O-N 3.24Å; F29-F33 VanDerWaalsContact O-CB 3.27Å; F29-F33 WeakPolarHBondContact O-CB 3.36Å; F29-F33 PolarHBondContact O-N 2.96Å; F29-L311 HydrophobicContact CD1-CD1 4.2Å; F29-L311 HydrophobicContact CE1-CD1 3.94Å; F29-L321 HydrophobicContact CE1-CD1 4.25Å; F29-L321 HydrophobicContact CZ-CD1 4.01Å
30T93.5Very high91Very high0 Ų049.2 Ų49.20%026%0.262CS..Hα-helixtrans-72-36.7-176.6-58.30000111.7F26 N27 I28 F33 I34 P307 L310 L311F26-T30 WeakPolarHBondContact O-CB 3.01Å; F26-T30 PolarHBondContact O-N 3.02Å; F26-T30 PolarHBondContact O-OG1 3.43Å; N27-T30 PolarHBondContact O-N 3.49Å; I28-T30 VanDerWaalsContact C-N 3.31Å; I28-T30 PolarHBondContact O-N 3.29Å; T30-F33 PolarHBondContact O-N 3.48Å; T30-I34 HydrophobicContact CG2-CD1 3.53Å; T30-I34 HydrophobicContact CG2-CG1 4.07Å; T30-I34 WeakPolarHBondContact O-CB 3.49Å; T30-I34 VanDerWaalsContact O-CG1 3.25Å; T30-I34 WeakPolarHBondContact O-CG1 3.38Å; T30-I34 PolarHBondContact O-N 3.26Å; T30-P307 HydrophobicContact CG2-CB 4.08Å; T30-P307 WeakPolarHBondContact OG1-CB 3.42Å; T30-L310 HydrophobicContact CG2-CD2 4.47Å; T30-L311 HydrophobicContact CG2-CD2 4.37Å; T30-L311 HydrophobicContact CG2-CG 4.19Å; T30-L311 WeakPolarHBondContact OG1-CD1 3.24Å
31L95Very high90.4Very high57 Ų5750.1 Ų50.130%0.29827%0.268SS..Hα-helixtrans-58-50.9171.6175.661.9000111N27 I28 F33 S35 C49 C52N27-L31 WeakPolarHBondContact O-CB 3.38Å; N27-L31 PolarHBondContact O-N 3.12Å; I28-L31 PolarHBondContact O-N 3.39Å; L31-F33 VanDerWaalsContact C-N 3.33Å; L31-F33 PolarHBondContact O-N 3.32Å; L31-S35 VanDerWaalsContact O-CB 3.24Å; L31-S35 WeakPolarHBondContact O-CB 3.37Å; L31-S35 PolarHBondContact O-N 3.48Å; L31-S35 PolarHBondContact O-OG 3.04Å; L31-C49 HydrophobicContact CD1-CB 3.74Å; L31-C49 WeakPolarHBondContact CD1-O 3.31Å; L31-C52 HydrophobicContact CB-CB 3.96Å
32I92.6Very high90Very high93 Ų9353.5 Ų53.548%0.47728%0.28SS..Hα-helixtrans-60.2-48177.4-67.2170.1000109.3I28 F29 I34 S35 F36I28-I32 HydrophobicContact CG2-CD1 3.85Å; I28-I32 VanDerWaalsContact O-CG1 3.3Å; I28-I32 WeakPolarHBondContact O-CG1 3.3Å; I28-I32 PolarHBondContact O-N 3.36Å; F29-I32 PolarHBondContact O-N 3.24Å; I32-I34 PolarHBondContact O-N 3.12Å; I32-S35 PolarHBondContact O-N 2.95Å; I32-F36 HydrophobicContact CG2-CD2 4.14Å; I32-F36 HydrophobicContact CG2-CE2 3.71Å; I32-F36 WeakPolarHBondContact O-CD2 3.38Å; I32-F36 PolarHBondContact O-N 3.08Å
33F90.6Very high89.6Confident18 Ų1851.9 Ų51.98%0.07927%0.269CS..Hα-helixtrans-59.7-50.9-177.9-171.7-107.7000111.9F29 T30 L31 S35 F36 T37 L311 L317 R320 L321F29-F33 VanDerWaalsContact O-CB 3.27Å; F29-F33 WeakPolarHBondContact O-CB 3.36Å; F29-F33 PolarHBondContact O-N 2.96Å; T30-F33 PolarHBondContact O-N 3.48Å; L31-F33 VanDerWaalsContact C-N 3.33Å; L31-F33 PolarHBondContact O-N 3.32Å; F33-S35 VanDerWaalsContact C-N 3.35Å; F33-S35 PolarHBondContact O-N 3.2Å; F33-F36 PolarHBondContact O-N 3.38Å; F33-T37 HydrophobicContact CD1-CG2 4.23Å; F33-T37 HydrophobicContact CE1-CG2 4.12Å; F33-T37 HydrophobicContact CZ-CG2 4.43Å; F33-T37 WeakPolarHBondContact O-CG2 3.49Å; F33-T37 PolarHBondContact O-N 3.37Å; F33-L311 HydrophobicContact CD1-CD2 3.59Å; F33-L311 HydrophobicContact CE1-CD2 3.81Å; F33-L317 HydrophobicContact CD1-CD2 3.89Å; F33-L317 HydrophobicContact CE1-CB 4.13Å; F33-L317 HydrophobicContact CE1-CD2 3.64Å; F33-L317 HydrophobicContact CE1-CG 4.45Å; F33-R320 HydrophobicContact CE2-CG 4.09Å; F33-R320 HydrophobicContact CZ-CB 3.86Å; F33-R320 HydrophobicContact CZ-CG 3.74Å; F33-L321 HydrophobicContact CE2-CD1 4.43Å; F33-L321 HydrophobicContact CZ-CB 4.02Å; F33-L321 HydrophobicContact CZ-CD1 4.37Å
34I90.1Very high89.2Confident0 Ų052 Ų520%027%0.27CS..Hα-helixtrans-66.3-37180-67.4173.2000111.2T30 I32 F36 T37 L39 T45 C49 L310 L317T30-I34 HydrophobicContact CG2-CD1 3.53Å; T30-I34 HydrophobicContact CG2-CG1 4.07Å; T30-I34 WeakPolarHBondContact O-CB 3.49Å; T30-I34 VanDerWaalsContact O-CG1 3.25Å; T30-I34 WeakPolarHBondContact O-CG1 3.38Å; T30-I34 PolarHBondContact O-N 3.26Å; I32-I34 PolarHBondContact O-N 3.12Å; I34-F36 PolarHBondContact O-N 3.04Å; I34-F36 VanDerWaalsContact O-N 3.09Å; I34-T37 WeakPolarHBondContact CA-OG1 3.22Å; I34-T37 CarbonylContact O-C 3.6Å; I34-T37 WeakPolarHBondContact O-CA 3.26Å; I34-T37 PolarHBondContact O-N 3.43Å; I34-T37 PolarHBondContact O-OG1 2.99Å; I34-L39 HydrophobicContact CD1-CD1 3.99Å; I34-L39 HydrophobicContact CG1-CD1 4.09Å; I34-L39 HydrophobicContact CG2-CD1 3.64Å; I34-L39 HydrophobicContact CG2-CG 4.29Å; I34-T45 HydrophobicContact CG2-CG2 4.12Å; I34-C49 VanDerWaalsContact CG2-SG 3.6Å; I34-L310 HydrophobicContact CD1-CD2 3.33Å; I34-L310 HydrophobicContact CD1-CG 4.18Å; I34-L317 HydrophobicContact CD1-CD1 4.4Å; I34-L317 HydrophobicContact CG1-CD1 4.28Å; I34-L317 HydrophobicContact CG1-CD2 4.17Å
35S88.7Confident88.8Confident71 Ų7151.8 Ų51.850%0.49727%0.268SS..Hα-helixtrans-57-28.7176.9-63.80000112.2L31 I32 F33L31-S35 VanDerWaalsContact O-CB 3.24Å; L31-S35 WeakPolarHBondContact O-CB 3.37Å; L31-S35 PolarHBondContact O-N 3.48Å; L31-S35 PolarHBondContact O-OG 3.04Å; I32-S35 PolarHBondContact O-N 2.95Å; F33-S35 VanDerWaalsContact C-N 3.35Å; F33-S35 PolarHBondContact O-N 3.2Å
36F86.8Confident88.6Confident146 Ų14649.4 Ų49.464%0.6426%0.255SS*.THydrogen-bonded Turntrans-91.8-3.7172.9-61.5-64.4000114.4I32 F33 I34 R320I32-F36 HydrophobicContact CG2-CD2 4.14Å; I32-F36 HydrophobicContact CG2-CE2 3.71Å; I32-F36 WeakPolarHBondContact O-CD2 3.38Å; I32-F36 PolarHBondContact O-N 3.08Å; F33-F36 PolarHBondContact O-N 3.38Å; I34-F36 PolarHBondContact O-N 3.04Å; I34-F36 VanDerWaalsContact O-N 3.09Å; F36-R320 PolarHBondContact O-NH1 3.48Å; F36-R320 PolarHBondContact O-NH2 3.19Å
37T83.9Confident88.5Confident6 Ų645.2 Ų45.24%0.03724%0.237CC..SBendtrans-115.2127.9179.180.20000112.6F33 I34 L39 L317F33-T37 HydrophobicContact CD1-CG2 4.23Å; F33-T37 HydrophobicContact CE1-CG2 4.12Å; F33-T37 HydrophobicContact CZ-CG2 4.43Å; F33-T37 WeakPolarHBondContact O-CG2 3.49Å; F33-T37 PolarHBondContact O-N 3.37Å; I34-T37 WeakPolarHBondContact CA-OG1 3.22Å; I34-T37 CarbonylContact O-C 3.6Å; I34-T37 WeakPolarHBondContact O-CA 3.26Å; I34-T37 PolarHBondContact O-N 3.43Å; I34-T37 PolarHBondContact O-OG1 2.99Å; T37-L39 PolarHBondContact O-N 2.98Å; T37-L317 HydrophobicContact CG2-CD2 3.89Å; T37-L317 VanDerWaalsContact OG1-CD2 3.3Å; T37-L317 WeakPolarHBondContact OG1-CD2 3.27Å
38N78.5Confident88.3Confident91 Ų9145.3 Ų45.349%0.48724%0.238SC..  trans-78.8114.6166.7-169-17.8000109.6G40 T45 K316N38-G40 PolarHBondContact OD1-N 3.41Å; N38-G40 VanDerWaalsContact OD1-N 3.11Å; N38-G40 PolarHBondContact OD1-O 3.34Å; N38-T45 PolarHBondContact OD1-OG1 2.98Å; N38-K316 WeakPolarHBondContact O-CD 3.37Å; N38-K316 WeakPolarHBondContact O-CE 3.26Å; N38-K316 PolarHBondContact O-NZ 3.21Å
39L75.3Confident88.3Confident6 Ų642.1 Ų42.13%0.03122%0.223CC..  trans-83.2-14.8-178.8-84175.7000114I34 T37 T45 F48 Q249 L317I34-L39 HydrophobicContact CD1-CD1 3.99Å; I34-L39 HydrophobicContact CG1-CD1 4.09Å; I34-L39 HydrophobicContact CG2-CD1 3.64Å; I34-L39 HydrophobicContact CG2-CG 4.29Å; T37-L39 PolarHBondContact O-N 2.98Å; L39-T45 PolarHBondContact N-OG1 3.23Å; L39-F48 HydrophobicContact CD1-CB 4.14Å; L39-F48 HydrophobicContact CD1-CD2 3.84Å; L39-F48 HydrophobicContact CD1-CG 4.16Å; L39-Q249 PolarHBondContact O-NE2 3.43Å; L39-L317 HydrophobicContact CD1-CD1 4.24Å; L39-L317 HydrophobicContact CD2-CD1 3.7Å; L39-L317 HydrophobicContact CD2-CD2 3.59Å; L39-L317 HydrophobicContact CD2-CG 3.43Å; L39-L317 VanDerWaalsContact CD2-CG 3.43Å; L39-L317 HydrophobicContact CG-CD1 4.5Å; L39-L317 HydrophobicContact CG-CD2 4.25Å; L39-L317 HydrophobicContact CG-CG 4.48Å
40G76.5Confident88.3Confident35 Ų3539.9 Ų39.936%0.36122%0.216SC..SBendtrans166.7-111-174.900000111.5N38N38-G40 PolarHBondContact OD1-N 3.41Å; N38-G40 VanDerWaalsContact OD1-N 3.11Å; N38-G40 PolarHBondContact OD1-O 3.34Å
41S82.3Confident88.4Confident23 Ų2340 Ų4016%0.16122%0.216CC..SBendtrans-77.2159.6168.565.20000110.4S43 S44 T45 Y121S41-S43 PolarHBondContact O-N 2.91Å; S41-S44 PolarHBondContact O-N 3.4Å; S41-S44 WeakPolarHBondContact OG-CB 3.28Å; S41-S44 PolarHBondContact OG-N 3.4Å; S41-S44 VanDerWaalsContact OG-N 3.17Å; S41-T45 PolarHBondContact O-N 2.97Å; S41-T45 VanDerWaalsContact O-N 3.13Å; S41-T45 PolarHBondContact O-OG1 3.43Å; S41-T45 VanDerWaalsContact O-OG1 3.08Å; S41-Y121 PolarHBondContact OG-OH 2.97Å
42K86.2Confident88.5Confident156 Ų15637.5 Ų37.568%0.67820%0.203SC*.Hα-helixtrans-57.8-39.5171-173.9-180178-177.60111T45 I46K42-T45 PolarHBondContact O-N 2.92Å; K42-I46 HydrophobicContact CG-CD1 3.9Å; K42-I46 VanDerWaalsContact O-CG1 3.3Å; K42-I46 WeakPolarHBondContact O-CG1 3.42Å; K42-I46 PolarHBondContact O-N 3.43Å
43S87.3Confident88.6Confident0 Ų034.3 Ų34.30%019%0.193CC..Hα-helixtrans-59.3-54177.6-176.10000111.4S41 T45 I46 L47 D110 Q125 L129S41-S43 PolarHBondContact O-N 2.91Å; S43-T45 VanDerWaalsContact C-N 3.31Å; S43-T45 PolarHBondContact O-N 3.25Å; S43-I46 PolarHBondContact O-N 3.01Å; S43-I46 VanDerWaalsContact O-N 3.09Å; S43-L47 WeakPolarHBondContact O-CG 3.48Å; S43-L47 PolarHBondContact O-N 3.18Å; S43-D110 PolarHBondContact OG-OD1 2.97Å; S43-Q125 VanDerWaalsContact N-NE2 3.14Å; S43-L129 WeakPolarHBondContact OG-CD2 3.34Å
44S87.8Confident88.9Confident2 Ų234.8 Ų34.81%0.01420%0.196CC..Hα-helixtrans-56.6-43.5178.4-176.50000112.9S41 I46 L47 F48S41-S44 PolarHBondContact O-N 3.4Å; S41-S44 WeakPolarHBondContact OG-CB 3.28Å; S41-S44 PolarHBondContact OG-N 3.4Å; S41-S44 VanDerWaalsContact OG-N 3.17Å; S44-I46 PolarHBondContact O-N 3.47Å; S44-L47 PolarHBondContact O-N 2.94Å; S44-F48 WeakPolarHBondContact O-CB 3.38Å; S44-F48 WeakPolarHBondContact O-CD2 3.48Å; S44-F48 PolarHBondContact O-N 2.84Å; S44-F48 WeakPolarHBondContact OG-CD2 3.31Å; S44-F48 VanDerWaalsContact OG-CE2 3.26Å; S44-F48 WeakPolarHBondContact OG-CE2 3.41Å
45T89.5Confident89.2Confident21 Ų2134.9 Ų34.913%0.12920%0.196CC..Hα-helixtrans-63.8-42.6179-53.10000110.9I34 N38 L39 S41 K42 S43 F48 C49I34-T45 HydrophobicContact CG2-CG2 4.12Å; N38-T45 PolarHBondContact OD1-OG1 2.98Å; L39-T45 PolarHBondContact N-OG1 3.23Å; S41-T45 PolarHBondContact O-N 2.97Å; S41-T45 VanDerWaalsContact O-N 3.13Å; S41-T45 PolarHBondContact O-OG1 3.43Å; S41-T45 VanDerWaalsContact O-OG1 3.08Å; K42-T45 PolarHBondContact O-N 2.92Å; S43-T45 VanDerWaalsContact C-N 3.31Å; S43-T45 PolarHBondContact O-N 3.25Å; T45-F48 PolarHBondContact O-N 3.09Å; T45-C49 WeakPolarHBondContact O-CB 3.27Å; T45-C49 PolarHBondContact O-N 3.34Å; T45-C49 PolarHBondContact O-SG 3.39Å
46I93.1Very high89.6Confident55 Ų5532 Ų3228%0.28218%0.178SC..Hα-helixtrans-63.1-45.8177.1-70.8167.3000111.3K42 S43 S44 C49 T50 L129 Y133K42-I46 HydrophobicContact CG-CD1 3.9Å; K42-I46 VanDerWaalsContact O-CG1 3.3Å; K42-I46 WeakPolarHBondContact O-CG1 3.42Å; K42-I46 PolarHBondContact O-N 3.43Å; S43-I46 PolarHBondContact O-N 3.01Å; S43-I46 VanDerWaalsContact O-N 3.09Å; S44-I46 PolarHBondContact O-N 3.47Å; I46-C49 PolarHBondContact O-N 3.1Å; I46-T50 WeakPolarHBondContact O-CB 3.3Å; I46-T50 PolarHBondContact O-N 3.09Å; I46-T50 PolarHBondContact O-OG1 3.33Å; I46-L129 HydrophobicContact CD1-CD1 3.79Å; I46-L129 HydrophobicContact CG2-CD2 4.39Å; I46-Y133 HydrophobicContact CG2-CE2 4.17Å; I46-Y133 WeakPolarHBondContact CG2-OH 3.44Å
47L93.6Very high90.1Very high3 Ų328.3 Ų28.32%0.01616%0.164CC..Hα-helixtrans-64-41.5179.1-69.5170.1000112.1S43 S44 T50 Q51 N103 I107 D110 L129S43-L47 WeakPolarHBondContact O-CG 3.48Å; S43-L47 PolarHBondContact O-N 3.18Å; S44-L47 PolarHBondContact O-N 2.94Å; L47-T50 PolarHBondContact O-N 3.22Å; L47-Q51 WeakPolarHBondContact O-CB 3.25Å; L47-Q51 PolarHBondContact O-N 3.5Å; L47-N103 PolarHBondContact O-ND2 3.04Å; L47-N103 VanDerWaalsContact O-ND2 3.07Å; L47-I107 HydrophobicContact CB-CD1 4.38Å; L47-I107 HydrophobicContact CB-CG1 3.71Å; L47-I107 HydrophobicContact CD1-CG1 4.42Å; L47-D110 HydrophobicContact CD1-CB 3.7Å; L47-L129 HydrophobicContact CD2-CD2 4.38Å; L47-L129 HydrophobicContact CG-CD2 4.26Å
48F93Very high90.6Very high3 Ų328.7 Ų28.71%0.01317%0.168CC..Hα-helixtrans-68-39.5175.5-79.3-59.3000112.9L39 S44 T45 T50 Q51 C52 I107 V253 I257 L310L39-F48 HydrophobicContact CD1-CB 4.14Å; L39-F48 HydrophobicContact CD1-CD2 3.84Å; L39-F48 HydrophobicContact CD1-CG 4.16Å; S44-F48 WeakPolarHBondContact O-CB 3.38Å; S44-F48 WeakPolarHBondContact O-CD2 3.48Å; S44-F48 PolarHBondContact O-N 2.84Å; S44-F48 WeakPolarHBondContact OG-CD2 3.31Å; S44-F48 VanDerWaalsContact OG-CE2 3.26Å; S44-F48 WeakPolarHBondContact OG-CE2 3.41Å; T45-F48 PolarHBondContact O-N 3.09Å; F48-T50 VanDerWaalsContact C-N 3.31Å; F48-Q51 WeakPolarHBondContact O-CB 3.37Å; F48-Q51 PolarHBondContact O-N 3.24Å; F48-C52 PolarHBondContact O-N 3.36Å; F48-C52 VanDerWaalsContact O-N 3.1Å; F48-C52 PolarHBondContact O-SG 3.25Å; F48-I107 HydrophobicContact CD1-CD1 4.07Å; F48-I107 HydrophobicContact CE1-CD1 4.22Å; F48-I107 HydrophobicContact CE1-CG2 4.06Å; F48-I107 HydrophobicContact CZ-CG2 4Å; F48-V253 HydrophobicContact CZ-CG1 4.47Å; F48-I257 HydrophobicContact CE1-CG1 4.16Å; F48-I257 HydrophobicContact CZ-CD1 3.92Å; F48-I257 HydrophobicContact CZ-CG1 3.83Å; F48-L310 HydrophobicContact CB-CD2 4.4Å; F48-L310 HydrophobicContact CD1-CD1 4.02Å; F48-L310 HydrophobicContact CD1-CD2 3.79Å; F48-L310 HydrophobicContact CE1-CD1 3.83Å; F48-L310 HydrophobicContact CE1-CD2 4.37Å; F48-L310 HydrophobicContact CG-CD2 4.27Å; F48-L310 HydrophobicContact CZ-CD1 4.2Å
49C94.5Very high91.5Very high21 Ų2124.4 Ų24.414%0.14215%0.145CC..Hα-helixtrans-60.9-44.6172.2-72.60000110.8L31 I34 T45 I46 Q51 C52 G53L31-C49 HydrophobicContact CD1-CB 3.74Å; L31-C49 WeakPolarHBondContact CD1-O 3.31Å; I34-C49 VanDerWaalsContact CG2-SG 3.6Å; T45-C49 WeakPolarHBondContact O-CB 3.27Å; T45-C49 PolarHBondContact O-N 3.34Å; T45-C49 PolarHBondContact O-SG 3.39Å; I46-C49 PolarHBondContact O-N 3.1Å; C49-Q51 VanDerWaalsContact C-N 3.31Å; C49-Q51 PolarHBondContact O-N 3Å; C49-C52 PolarHBondContact O-N 3.49Å; C49-G53 PolarHBondContact O-N 3.15Å
50T95.4Very high92.5Very high31 Ų3128.8 Ų28.819%0.1916%0.164CC..Hα-helixtrans-64.9-37.6178.9-54.70000111.7I46 L47 F48 C52 G53 F54 Y133I46-T50 WeakPolarHBondContact O-CB 3.3Å; I46-T50 PolarHBondContact O-N 3.09Å; I46-T50 PolarHBondContact O-OG1 3.33Å; L47-T50 PolarHBondContact O-N 3.22Å; F48-T50 VanDerWaalsContact C-N 3.31Å; T50-C52 PolarHBondContact O-N 3.33Å; T50-G53 CarbonylContact O-C 3.59Å; T50-G53 WeakPolarHBondContact O-CA 3.43Å; T50-G53 PolarHBondContact O-N 3.32Å; T50-G53 VanDerWaalsContact O-N 3.07Å; T50-F54 HydrophobicContact CG2-CD1 4.49Å; T50-F54 HydrophobicContact CG2-CD2 3.83Å; T50-F54 HydrophobicContact CG2-CE1 4.06Å; T50-F54 HydrophobicContact CG2-CE2 3.34Å; T50-F54 HydrophobicContact CG2-CG 4.4Å; T50-F54 HydrophobicContact CG2-CZ 3.46Å; T50-F54 VanDerWaalsContact CG2-CZ 3.46Å; T50-F54 PolarHBondContact O-N 3.45Å; T50-Y133 WeakPolarHBondContact CB-OH 3.3Å; T50-Y133 HydrophobicContact CG2-CE1 3.96Å; T50-Y133 PolarHBondContact OG1-OH 2.89Å
51Q95.7Very high93.2Very high2 Ų228.4 Ų28.41%0.00915%0.153CC..Hα-helixtrans-57.3-49.5173.5-173.658.43400111.2L47 F48 C49 G53 F54 D55 N100 N103 I107 M260L47-Q51 WeakPolarHBondContact O-CB 3.25Å; L47-Q51 PolarHBondContact O-N 3.5Å; F48-Q51 WeakPolarHBondContact O-CB 3.37Å; F48-Q51 PolarHBondContact O-N 3.24Å; C49-Q51 VanDerWaalsContact C-N 3.31Å; C49-Q51 PolarHBondContact O-N 3Å; Q51-G53 PolarHBondContact O-N 3.24Å; Q51-F54 PolarHBondContact O-N 3.3Å; Q51-D55 WeakPolarHBondContact CG-OD2 3.39Å; Q51-D55 VanDerWaalsContact NE2-CG 3.32Å; Q51-D55 PolarHBondContact NE2-OD1 2.9Å; Q51-D55 VanDerWaalsContact NE2-OD1 3.12Å; Q51-D55 PolarHBondContact NE2-OD2 3.49Å; Q51-D55 VanDerWaalsContact O-CB 3.31Å; Q51-D55 WeakPolarHBondContact O-CB 3.34Å; Q51-D55 PolarHBondContact O-N 2.76Å; Q51-N100 PolarHBondContact NE2-OD1 2.97Å; Q51-N103 WeakPolarHBondContact CA-ND2 3.2Å; Q51-N103 WeakPolarHBondContact CB-ND2 3.44Å; Q51-N103 PolarHBondContact N-ND2 3.48Å; Q51-N103 PolarHBondContact OE1-ND2 3.46Å; Q51-I107 HydrophobicContact CB-CD1 3.96Å; Q51-I107 HydrophobicContact CG-CD1 4.19Å; Q51-M260 HydrophobicContact CG-CE 3.98Å
52C96.3Very high93.7Very high4 Ų427.8 Ų27.83%0.02715%0.149CC..Hα-helixtrans-61.2-34.5175.5-64.90000112.4N27 L31 F48 C49 T50 G56N27-C52 WeakPolarHBondContact CB-O 3.15Å; N27-C52 WeakPolarHBondContact OD1-CA 3.17Å; N27-C52 PolarHBondContact OD1-O 3.07Å; L31-C52 HydrophobicContact CB-CB 3.96Å; F48-C52 PolarHBondContact O-N 3.36Å; F48-C52 VanDerWaalsContact O-N 3.1Å; F48-C52 PolarHBondContact O-SG 3.25Å; C49-C52 PolarHBondContact O-N 3.49Å; T50-C52 PolarHBondContact O-N 3.33Å; C52-G56 PolarHBondContact O-N 3.08Å
53G96.4Very high94Very high26 Ų2622.1 Ų22.127%0.26813%0.125SC..Hα-helixtrans-62.4-50.6173.300000112.4C49 T50 Q51 G56 L57C49-G53 PolarHBondContact O-N 3.15Å; T50-G53 CarbonylContact O-C 3.59Å; T50-G53 WeakPolarHBondContact O-CA 3.43Å; T50-G53 PolarHBondContact O-N 3.32Å; T50-G53 VanDerWaalsContact O-N 3.07Å; Q51-G53 PolarHBondContact O-N 3.24Å; G53-G56 PolarHBondContact O-N 2.94Å; G53-L57 WeakPolarHBondContact O-CG 3.37Å; G53-L57 PolarHBondContact O-N 3.16Å
54F97Very high94.2Very high29 Ų2924.3 Ų24.313%0.12714%0.137CC..Hα-helixtrans-69.4-41.2-179.6-63.7-25.3000113T50 Q51 G56 L57 A58 L99 N100 N103 I136T50-F54 HydrophobicContact CG2-CD1 4.49Å; T50-F54 HydrophobicContact CG2-CD2 3.83Å; T50-F54 HydrophobicContact CG2-CE1 4.06Å; T50-F54 HydrophobicContact CG2-CE2 3.34Å; T50-F54 HydrophobicContact CG2-CG 4.4Å; T50-F54 HydrophobicContact CG2-CZ 3.46Å; T50-F54 VanDerWaalsContact CG2-CZ 3.46Å; T50-F54 PolarHBondContact O-N 3.45Å; Q51-F54 PolarHBondContact O-N 3.3Å; F54-G56 VanDerWaalsContact C-N 3.33Å; F54-G56 PolarHBondContact O-N 3.09Å; F54-L57 HydrophobicContact CD1-CD1 4.44Å; F54-L57 PolarHBondContact O-N 3.27Å; F54-A58 WeakPolarHBondContact O-CB 3.39Å; F54-A58 PolarHBondContact O-N 3.41Å; F54-L99 HydrophobicContact CD1-CB 4.01Å; F54-L99 HydrophobicContact CD1-CD1 4.24Å; F54-L99 VanDerWaalsContact CD2-C 3.44Å; F54-L99 HydrophobicContact CD2-CB 3.87Å; F54-L99 WeakPolarHBondContact CD2-O 3.36Å; F54-L99 HydrophobicContact CE1-CB 3.99Å; F54-L99 HydrophobicContact CE1-CD1 3.85Å; F54-L99 HydrophobicContact CE1-CD2 4.46Å; F54-L99 HydrophobicContact CE1-CG 4.34Å; F54-L99 HydrophobicContact CE2-CB 3.82Å; F54-L99 HydrophobicContact CE2-CD2 4.45Å; F54-L99 WeakPolarHBondContact CE2-O 3.45Å; F54-L99 HydrophobicContact CG-CB 3.97Å; F54-L99 HydrophobicContact CZ-CB 3.89Å; F54-L99 HydrophobicContact CZ-CD1 4.24Å; F54-L99 HydrophobicContact CZ-CD2 4.02Å; F54-L99 HydrophobicContact CZ-CG 4.28Å; F54-N100 HydrophobicContact CB-CB 4.02Å; F54-N103 HydrophobicContact CD2-CB 3.76Å; F54-N103 HydrophobicContact CE2-CB 3.84Å; F54-I136 HydrophobicContact CE2-CG2 4.37Å
55D96.5Very high94.2Very high1 Ų127.1 Ų27.11%0.00515%0.154CC..Hα-helixtrans-59.9-44.6172.7-77.3-31.7000110.7N27 Q51 A58 C59 N100 S303 N306N27-D55 WeakPolarHBondContact OD1-CB 3.48Å; Q51-D55 WeakPolarHBondContact CG-OD2 3.39Å; Q51-D55 VanDerWaalsContact NE2-CG 3.32Å; Q51-D55 PolarHBondContact NE2-OD1 2.9Å; Q51-D55 VanDerWaalsContact NE2-OD1 3.12Å; Q51-D55 PolarHBondContact NE2-OD2 3.49Å; Q51-D55 VanDerWaalsContact O-CB 3.31Å; Q51-D55 WeakPolarHBondContact O-CB 3.34Å; Q51-D55 PolarHBondContact O-N 2.76Å; D55-A58 PolarHBondContact O-N 3.17Å; D55-C59 PolarHBondContact O-N 3.17Å; D55-C59 PolarHBondContact O-SG 2.73Å; D55-N100 PolarHBondContact OD1-ND2 2.96Å; D55-N100 PolarHBondContact OD1-OD1 3.1Å; D55-S303 WeakPolarHBondContact OD1-CA 3.44Å; D55-N306 PolarHBondContact OD1-ND2 3.48Å; D55-N306 VanDerWaalsContact OD2-CB 3.3Å; D55-N306 WeakPolarHBondContact OD2-CB 3.21Å; D55-N306 PolarHBondContact OD2-ND2 3.35Å
56G97.1Very high94.2Very high11 Ų1127 Ų2711%0.11315%0.152CC..Hα-helixtrans-63.4-40.717600000113.2C52 G53 F54 C59 F60C52-G56 PolarHBondContact O-N 3.08Å; G53-G56 PolarHBondContact O-N 2.94Å; F54-G56 VanDerWaalsContact C-N 3.33Å; F54-G56 PolarHBondContact O-N 3.09Å; G56-C59 PolarHBondContact O-N 3.06Å; G56-F60 WeakPolarHBondContact O-CB 3.26Å; G56-F60 PolarHBondContact O-N 3.49Å
57L96.2Very high94Very high68 Ų6830.4 Ų30.436%0.35617%0.165SC..Hα-helixtrans-65.9-41.2174.7-74.2172.2000111.8G53 F54 C59 F60 F61 I96G53-L57 WeakPolarHBondContact O-CG 3.37Å; G53-L57 PolarHBondContact O-N 3.16Å; F54-L57 HydrophobicContact CD1-CD1 4.44Å; F54-L57 PolarHBondContact O-N 3.27Å; L57-C59 PolarHBondContact O-N 3.41Å; L57-F60 PolarHBondContact O-N 3.13Å; L57-F61 HydrophobicContact CB-CD2 4.47Å; L57-F61 HydrophobicContact CD2-CE2 4.14Å; L57-F61 WeakPolarHBondContact O-CD2 3.43Å; L57-F61 PolarHBondContact O-N 2.92Å; L57-I96 HydrophobicContact CB-CD1 4.43Å; L57-I96 HydrophobicContact CB-CG2 3.98Å; L57-I96 HydrophobicContact CD1-CD1 4.3Å
58A95.2Very high93.6Very high15 Ų1533.6 Ų33.612%0.12419%0.185CC..Hα-helixtrans-59.6-47.4176.500000111F54 D55 A62 I96F54-A58 WeakPolarHBondContact O-CB 3.39Å; F54-A58 PolarHBondContact O-N 3.41Å; D55-A58 PolarHBondContact O-N 3.17Å; A58-A62 WeakPolarHBondContact O-CB 3.48Å; A58-A62 PolarHBondContact O-N 3.26Å; A58-I96 HydrophobicContact CB-CG2 4Å
59C96.4Very high93.1Very high0 Ų037.6 Ų37.60%021%0.214CC..Hα-helixtrans-61.1-44.4173.9-63.60000111.9V24 D55 G56 L57 A62 I63 V300V24-C59 HydrophobicContact CG2-CB 3.64Å; D55-C59 PolarHBondContact O-N 3.17Å; D55-C59 PolarHBondContact O-SG 2.73Å; G56-C59 PolarHBondContact O-N 3.06Å; L57-C59 PolarHBondContact O-N 3.41Å; C59-A62 WeakPolarHBondContact O-CB 3.09Å; C59-A62 PolarHBondContact O-N 3.4Å; C59-I63 WeakPolarHBondContact O-CG1 3.4Å; C59-I63 PolarHBondContact O-N 3.22Å; C59-I63 VanDerWaalsContact O-N 3.08Å; C59-V300 HydrophobicContact CB-CG1 4.48Å
60F95.7Very high92.6Very high98 Ų9837.7 Ų37.743%0.4321%0.213SC..Hα-helixtrans-61.9-46.5-179.7177.7-108.5000112.5V24 G56 L57 A62 I63 I64V24-F60 HydrophobicContact CG2-CB 4.05Å; G56-F60 WeakPolarHBondContact O-CB 3.26Å; G56-F60 PolarHBondContact O-N 3.49Å; L57-F60 PolarHBondContact O-N 3.13Å; F60-A62 VanDerWaalsContact C-N 3.31Å; F60-A62 PolarHBondContact O-N 3.09Å; F60-I63 WeakPolarHBondContact O-CB 3.45Å; F60-I63 PolarHBondContact O-N 3.38Å; F60-I64 HydrophobicContact CD1-CD1 3.92Å; F60-I64 HydrophobicContact CE1-CD1 3.41Å; F60-I64 VanDerWaalsContact CE1-CD1 3.41Å; F60-I64 HydrophobicContact CE1-CG1 4.43Å; F60-I64 HydrophobicContact CE2-CD1 4.36Å; F60-I64 HydrophobicContact CZ-CD1 3.66Å; F60-I64 HydrophobicContact CZ-CG1 4.4Å; F60-I64 WeakPolarHBondContact O-CG1 3.46Å; F60-I64 PolarHBondContact O-N 3.36Å; F60-I64 VanDerWaalsContact O-N 3.15Å
61F92.7Very high92.2Very high28 Ų2840.2 Ų40.212%0.12323%0.225CC..Hα-helixtrans-69.9-28.6177.6-78-67.3000112.8L57 I64 T65 W87 W92 I96L57-F61 HydrophobicContact CB-CD2 4.47Å; L57-F61 HydrophobicContact CD2-CE2 4.14Å; L57-F61 WeakPolarHBondContact O-CD2 3.43Å; L57-F61 PolarHBondContact O-N 2.92Å; F61-I64 HydrophobicContact CD1-CD1 4.06Å; F61-I64 HydrophobicContact CE1-CD1 4.17Å; F61-I64 PolarHBondContact O-N 3.23Å; F61-T65 WeakPolarHBondContact O-CB 3.45Å; F61-T65 PolarHBondContact O-N 3.43Å; F61-T65 PolarHBondContact O-OG1 3.43Å; F61-W87 AromaticContact CD1-CH2 3.76Å; F61-W87 HydrophobicContact CD1-CH2 3.76Å; F61-W87 AromaticContact CD1-CZ3 3.73Å; F61-W87 HydrophobicContact CD1-CZ3 3.73Å; F61-W87 HydrophobicContact CE1-CH2 4.2Å; F61-W87 AromaticContact CE1-CZ3 3.84Å; F61-W87 HydrophobicContact CE1-CZ3 3.84Å; F61-W92 AromaticContact CD1-CD1 3.74Å; F61-W92 AromaticContact CD1-NE1 3.78Å; F61-W92 AromaticContact CD2-NE1 3.8Å; F61-W92 AromaticContact CE1-CD1 3.58Å; F61-W92 AromaticContact CE1-NE1 3.22Å; F61-W92 AromaticContact CE2-NE1 3.23Å; F61-W92 AromaticContact CZ-CD1 3.78Å; F61-W92 AromaticContact CZ-CE2 3.91Å; F61-W92 HydrophobicContact CZ-CZ2 4.34Å; F61-W92 AromaticContact CZ-NE1 2.93Å; F61-I96 HydrophobicContact CD2-CG1 3.96Å; F61-I96 HydrophobicContact CE2-CD1 4.35Å; F61-I96 HydrophobicContact CE2-CG1 4.22Å
62A92.6Very high91.8Very high9 Ų940.6 Ų40.67%0.07423%0.227CC..Hα-helixtrans-61.7-44.8169.600000111.7A58 C59 F60 I64 T65 L66 V296 V300A58-A62 WeakPolarHBondContact O-CB 3.48Å; A58-A62 PolarHBondContact O-N 3.26Å; C59-A62 WeakPolarHBondContact O-CB 3.09Å; C59-A62 PolarHBondContact O-N 3.4Å; F60-A62 VanDerWaalsContact C-N 3.31Å; F60-A62 PolarHBondContact O-N 3.09Å; A62-I64 PolarHBondContact O-N 3.47Å; A62-T65 PolarHBondContact O-N 3.12Å; A62-L66 VanDerWaalsContact O-CB 3.31Å; A62-L66 WeakPolarHBondContact O-CB 3.36Å; A62-L66 PolarHBondContact O-N 3.29Å; A62-V296 HydrophobicContact CB-CG1 4.29Å; A62-V300 HydrophobicContact CB-CG2 3.43Å; A62-V300 VanDerWaalsContact CB-CG2 3.43Å
63I92.5Very high91.4Very high37 Ų3742 Ų4219%0.1924%0.243CC..Hα-helixtrans-57.3-49.5174.3-60.9173.1000110.6D20 I21 V24 C59 F60 T65 L66 F67D20-I63 HydrophobicContact CB-CD1 3.96Å; D20-I63 HydrophobicContact CB-CG1 3.29Å; I21-I63 HydrophobicContact CG1-CD1 3.93Å; V24-I63 HydrophobicContact CG2-CD1 3.99Å; C59-I63 WeakPolarHBondContact O-CG1 3.4Å; C59-I63 PolarHBondContact O-N 3.22Å; C59-I63 VanDerWaalsContact O-N 3.08Å; F60-I63 WeakPolarHBondContact O-CB 3.45Å; F60-I63 PolarHBondContact O-N 3.38Å; I63-T65 VanDerWaalsContact C-N 3.3Å; I63-T65 PolarHBondContact O-N 3.24Å; I63-L66 WeakPolarHBondContact O-CB 3.11Å; I63-L66 PolarHBondContact O-N 3.17Å; I63-L66 VanDerWaalsContact O-N 3.16Å; I63-F67 HydrophobicContact CG2-CD2 3.83Å; I63-F67 HydrophobicContact CG2-CE2 4.11Å; I63-F67 WeakPolarHBondContact O-CD2 3.14Å; I63-F67 PolarHBondContact O-N 3.15Å; I63-F67 VanDerWaalsContact O-N 3.16Å
64I91.5Very high91.1Very high46 Ų4646.9 Ų46.924%0.23626%0.263CS..Hα-helixtrans-60.5-45.4-178.5-60.4172.2000109.7F60 F61 A62 L66 F67 T68 W87F60-I64 HydrophobicContact CD1-CD1 3.92Å; F60-I64 HydrophobicContact CE1-CD1 3.41Å; F60-I64 VanDerWaalsContact CE1-CD1 3.41Å; F60-I64 HydrophobicContact CE1-CG1 4.43Å; F60-I64 HydrophobicContact CE2-CD1 4.36Å; F60-I64 HydrophobicContact CZ-CD1 3.66Å; F60-I64 HydrophobicContact CZ-CG1 4.4Å; F60-I64 WeakPolarHBondContact O-CG1 3.46Å; F60-I64 PolarHBondContact O-N 3.36Å; F60-I64 VanDerWaalsContact O-N 3.15Å; F61-I64 HydrophobicContact CD1-CD1 4.06Å; F61-I64 HydrophobicContact CE1-CD1 4.17Å; F61-I64 PolarHBondContact O-N 3.23Å; A62-I64 PolarHBondContact O-N 3.47Å; I64-L66 VanDerWaalsContact C-N 3.29Å; I64-L66 PolarHBondContact O-N 3.1Å; I64-F67 PolarHBondContact O-N 2.56Å; I64-T68 WeakPolarHBondContact CG2-OG1 3.43Å; I64-T68 WeakPolarHBondContact O-CA 3.4Å; I64-T68 WeakPolarHBondContact O-CB 3.29Å; I64-T68 PolarHBondContact O-N 3.38Å; I64-T68 PolarHBondContact O-OG1 3.1Å; I64-W87 HydrophobicContact CB-CH2 3.99Å; I64-W87 HydrophobicContact CB-CZ2 4.21Å; I64-W87 HydrophobicContact CG2-CH2 3.49Å; I64-W87 VanDerWaalsContact CG2-CH2 3.49Å; I64-W87 HydrophobicContact CG2-CZ2 3.49Å; I64-W87 VanDerWaalsContact CG2-CZ2 3.49Å
65T88.4Confident90.9Very high61 Ų6150.5 Ų50.537%0.37428%0.276SS..Hα-helixtrans-65.6-31.8178.8-54.20000112.3F61 A62 I63F61-T65 WeakPolarHBondContact O-CB 3.45Å; F61-T65 PolarHBondContact O-N 3.43Å; F61-T65 PolarHBondContact O-OG1 3.43Å; A62-T65 PolarHBondContact O-N 3.12Å; I63-T65 VanDerWaalsContact C-N 3.3Å; I63-T65 PolarHBondContact O-N 3.24Å
66L88.9Confident90.7Very high19 Ų1956.4 Ų56.410%0.09931%0.308CS..Hα-helixtrans-69.2-38.2-179.8-172.764.3000112.2Y12 Y13 A16 S17 A62 I63 I64Y12-L66 HydrophobicContact CE1-CD1 4Å; Y13-L66 HydrophobicContact CD1-CD1 3.5Å; Y13-L66 VanDerWaalsContact CD1-CD1 3.5Å; Y13-L66 HydrophobicContact CD1-CG 3.97Å; Y13-L66 HydrophobicContact CE1-CD1 3.77Å; Y13-L66 HydrophobicContact CE1-CG 4.44Å; Y13-L66 HydrophobicContact CG-CD1 4.49Å; A16-L66 HydrophobicContact CB-CD1 4.29Å; A16-L66 HydrophobicContact CB-CD2 3.82Å; S17-L66 WeakPolarHBondContact OG-CD2 3.5Å; A62-L66 VanDerWaalsContact O-CB 3.31Å; A62-L66 WeakPolarHBondContact O-CB 3.36Å; A62-L66 PolarHBondContact O-N 3.29Å; I63-L66 WeakPolarHBondContact O-CB 3.11Å; I63-L66 PolarHBondContact O-N 3.17Å; I63-L66 VanDerWaalsContact O-N 3.16Å; I64-L66 VanDerWaalsContact C-N 3.29Å; I64-L66 PolarHBondContact O-N 3.1Å
67F87.9Confident90.4Very high127 Ų12761.1 Ų61.156%0.55733%0.33SS*.Hα-helixtrans-107-16.5-172.7-68.8-67.1000115.2S17 I63 I64S17-F67 WeakPolarHBondContact OG-CZ 3.25Å; I63-F67 HydrophobicContact CG2-CD2 3.83Å; I63-F67 HydrophobicContact CG2-CE2 4.11Å; I63-F67 WeakPolarHBondContact O-CD2 3.14Å; I63-F67 PolarHBondContact O-N 3.15Å; I63-F67 VanDerWaalsContact O-N 3.16Å; I64-F67 PolarHBondContact O-N 2.56Å
68T85.1Confident90.3Very high70 Ų7066.3 Ų66.343%0.42935%0.346SS..  trans-100.4111.1-174.8-490000110.8I64 V70I64-T68 WeakPolarHBondContact CG2-OG1 3.43Å; I64-T68 WeakPolarHBondContact O-CA 3.4Å; I64-T68 WeakPolarHBondContact O-CB 3.29Å; I64-T68 PolarHBondContact O-N 3.38Å; I64-T68 PolarHBondContact O-OG1 3.1Å; T68-V70 HydrophobicContact CG2-CG2 3.96Å
69S82.3Confident90.2Very high87 Ų8768.7 Ų68.761%0.60835%0.353SS*.  trans-86.4112.9158.854.80000108.7D71S69-D71 PolarHBondContact O-N 3.36Å
70V84.1Confident90.1Very high23 Ų2368.7 Ų68.714%0.13935%0.353CS..  trans-83.8115.7176.2-1800000108.8T68 I72 Y75 L83 I88T68-V70 HydrophobicContact CG2-CG2 3.96Å; V70-I72 HydrophobicContact CG1-CG1 4.01Å; V70-Y75 HydrophobicContact CG1-CE2 4.39Å; V70-L83 HydrophobicContact CG1-CB 4.43Å; V70-L83 HydrophobicContact CG1-CD1 3.87Å; V70-I88 HydrophobicContact CB-CD1 4.29Å
71D86.9Confident90.1Very high83 Ų8366.2 Ų66.244%0.44435%0.346SS..  trans-97.3111.8166.6-1759.3000109.2S69 N74 Y75S69-D71 PolarHBondContact O-N 3.36Å; D71-N74 PolarHBondContact OD2-ND2 2.82Å; D71-N74 VanDerWaalsContact OD2-ND2 3.1Å; D71-Y75 WeakPolarHBondContact O-CD2 3.39Å; D71-Y75 WeakPolarHBondContact O-CE2 3.49Å
72I87.1Confident90.2Very high10 Ų1069.3 Ų69.35%0.05136%0.359CS..G310 helixtrans-75.2-30.3-167.1-69.5173.7000111.8V70 N74 Y75 A80 C84 I88 C158V70-I72 HydrophobicContact CG1-CG1 4.01Å; I72-N74 PolarHBondContact O-N 2.88Å; I72-N74 VanDerWaalsContact O-N 3.1Å; I72-Y75 PolarHBondContact O-N 2.92Å; I72-Y75 VanDerWaalsContact O-N 3.13Å; I72-A80 HydrophobicContact CG2-CB 3.41Å; I72-A80 VanDerWaalsContact CG2-CB 3.41Å; I72-C84 HydrophobicContact CD1-CB 4.09Å; I72-I88 HydrophobicContact CD1-CG1 4.05Å; I72-C158 HydrophobicContact CD1-CB 3.26Å
73G88.5Confident90.3Very high34 Ų3469.7 Ų69.735%0.35136%0.36SS..G310 helixtrans-66.7-11.4-17800000115.1Y75G73-Y75 VanDerWaalsContact C-N 3.29Å
74N90.3Very high90.4Very high128 Ų12867.9 Ų67.968%0.68435%0.351SS*.G310 helixtrans-84.8-1.2176-65-44.3000113.6D71 I72D71-N74 PolarHBondContact OD2-ND2 2.82Å; D71-N74 VanDerWaalsContact OD2-ND2 3.1Å; I72-N74 PolarHBondContact O-N 2.88Å; I72-N74 VanDerWaalsContact O-N 3.1Å
75Y92.3Very high90.6Very high106 Ų10669.6 Ų69.642%0.41636%0.355SS..SBendtrans-115.9154.6-175.1-64.3-77.3000112V70 D71 I72 G73 F79 L83V70-Y75 HydrophobicContact CG1-CE2 4.39Å; D71-Y75 WeakPolarHBondContact O-CD2 3.39Å; D71-Y75 WeakPolarHBondContact O-CE2 3.49Å; I72-Y75 PolarHBondContact O-N 2.92Å; I72-Y75 VanDerWaalsContact O-N 3.13Å; G73-Y75 VanDerWaalsContact C-N 3.29Å; Y75-F79 AromaticContact CD1-CD1 3.36Å; Y75-F79 HydrophobicContact CD1-CD1 3.36Å; Y75-F79 AromaticContact CD1-CE1 3.54Å; Y75-F79 HydrophobicContact CD1-CE1 3.54Å; Y75-F79 AromaticContact CE1-CD1 3.99Å; Y75-F79 HydrophobicContact CE1-CD1 3.99Å; Y75-F79 AromaticContact CE1-CE1 3.64Å; Y75-F79 HydrophobicContact CE1-CE1 3.64Å; Y75-F79 AromaticContact CG-CD1 3.71Å; Y75-F79 HydrophobicContact CG-CD1 3.71Å; Y75-F79 HydrophobicContact CG-CE1 4.14Å; Y75-L83 HydrophobicContact CD1-CD1 4.46Å; Y75-L83 HydrophobicContact CD2-CD1 3.61Å; Y75-L83 HydrophobicContact CE2-CD1 3.7Å; Y75-L83 HydrophobicContact CG-CD1 4.01Å
76N92.8Very high90.9Very high125 Ų12568.2 Ų68.267%0.66835%0.345SS*.  trans-60.5147.4173.6-65.2-13.6000111W78 F79 A80N76-W78 VanDerWaalsContact C-N 3.32Å; N76-W78 PolarHBondContact O-N 2.98Å; N76-W78 VanDerWaalsContact O-N 3.1Å; N76-F79 PolarHBondContact O-N 3.27Å; N76-A80 PolarHBondContact O-N 3.19Å
77D90.2Very high91.1Very high109 Ų10969.7 Ų69.758%0.58335%0.349SS*.Hα-helixtrans-46.9-47-172.3-173.553.6000114.3F79 A80 V81 H153D77-F79 PolarHBondContact O-N 2.87Å; D77-A80 WeakPolarHBondContact O-CB 3.43Å; D77-A80 PolarHBondContact O-N 2.88Å; D77-V81 VanDerWaalsContact O-CG2 3.27Å; D77-V81 WeakPolarHBondContact O-CG2 3.41Å; D77-V81 PolarHBondContact O-N 3.43Å; D77-H153 IonicContact OD1-CE1 3.92Å; D77-H153 PolarHBondContact OD1-CE1 2.87Å; D77-H153 IonicContact OD1-ND1 2.66Å
78W94.2Very high91.2Very high178 Ų17866.8 Ų66.867%0.67434%0.338SS*.Hα-helixtrans-63.9-39.1179.283.1-93.2000113.2N76 F82N76-W78 VanDerWaalsContact C-N 3.32Å; N76-W78 PolarHBondContact O-N 2.98Å; N76-W78 VanDerWaalsContact O-N 3.1Å; W78-F82 PolarHBondContact O-N 2.82Å
79F94.9Very high91.5Very high64 Ų6463.6 Ų63.628%0.28132%0.319SS..Hα-helixtrans-78.9-33.9-178.3-170.3-114.3000110.7Y75 N76 D77 F82 L83Y75-F79 AromaticContact CD1-CD1 3.36Å; Y75-F79 HydrophobicContact CD1-CD1 3.36Å; Y75-F79 AromaticContact CD1-CE1 3.54Å; Y75-F79 HydrophobicContact CD1-CE1 3.54Å; Y75-F79 AromaticContact CE1-CD1 3.99Å; Y75-F79 HydrophobicContact CE1-CD1 3.99Å; Y75-F79 AromaticContact CE1-CE1 3.64Å; Y75-F79 HydrophobicContact CE1-CE1 3.64Å; Y75-F79 AromaticContact CG-CD1 3.71Å; Y75-F79 HydrophobicContact CG-CD1 3.71Å; Y75-F79 HydrophobicContact CG-CE1 4.14Å; N76-F79 PolarHBondContact O-N 3.27Å; D77-F79 PolarHBondContact O-N 2.87Å; F79-F82 HydrophobicContact CD2-CD1 4.03Å; F79-F82 AromaticContact CE2-CD1 3.83Å; F79-F82 HydrophobicContact CE2-CD1 3.83Å; F79-F82 HydrophobicContact CE2-CE1 4.23Å; F79-F82 WeakPolarHBondContact O-CB 3.29Å; F79-F82 PolarHBondContact O-N 2.93Å; F79-L83 HydrophobicContact CD1-CD1 3.77Å; F79-L83 HydrophobicContact CD1-CG 4.19Å; F79-L83 HydrophobicContact CE1-CD1 3.53Å; F79-L83 HydrophobicContact CE1-CD2 4.25Å; F79-L83 HydrophobicContact CE1-CG 3.92Å; F79-L83 HydrophobicContact CZ-CD1 4.19Å; F79-L83 HydrophobicContact CZ-CD2 4.06Å; F79-L83 HydrophobicContact CZ-CG 4.1Å; F79-L83 WeakPolarHBondContact O-CB 3.09Å; F79-L83 WeakPolarHBondContact O-CG 3.32Å; F79-L83 PolarHBondContact O-N 3.49Å
80A94.4Very high92Very high0 Ų061.2 Ų61.20%030%0.298CS..Hα-helixtrans-57.3-46.8168.500000111.6I72 N76 D77 L83 C84I72-A80 HydrophobicContact CG2-CB 3.41Å; I72-A80 VanDerWaalsContact CG2-CB 3.41Å; N76-A80 PolarHBondContact O-N 3.19Å; D77-A80 WeakPolarHBondContact O-CB 3.43Å; D77-A80 PolarHBondContact O-N 2.88Å; A80-L83 PolarHBondContact O-N 3.42Å; A80-C84 WeakPolarHBondContact O-CB 3.46Å; A80-C84 PolarHBondContact O-N 2.75Å
81V94.7Very high92.5Very high46 Ų4661.2 Ų61.228%0.27930%0.296SS..Hα-helixtrans-61.8-43.9173.6173.20000111.5D77 C84 R85 H153D77-V81 VanDerWaalsContact O-CG2 3.27Å; D77-V81 WeakPolarHBondContact O-CG2 3.41Å; D77-V81 PolarHBondContact O-N 3.43Å; V81-C84 PolarHBondContact O-N 2.98Å; V81-R85 HydrophobicContact CG1-CG 4.39Å; V81-R85 WeakPolarHBondContact O-CB 3.35Å; V81-R85 WeakPolarHBondContact O-CG 3.3Å; V81-R85 PolarHBondContact O-N 3.36Å; V81-H153 HydrophobicContact CG2-CB 3.9Å; V81-H153 WeakPolarHBondContact CG2-ND1 3.24Å
82F95.3Very high92.8Very high93 Ų9361.6 Ų61.641%0.40829%0.291SS..Hα-helixtrans-59-50.2176.3171.9-93.5000111.7W78 F79 C84 R85 I86W78-F82 PolarHBondContact O-N 2.82Å; F79-F82 HydrophobicContact CD2-CD1 4.03Å; F79-F82 AromaticContact CE2-CD1 3.83Å; F79-F82 HydrophobicContact CE2-CD1 3.83Å; F79-F82 HydrophobicContact CE2-CE1 4.23Å; F79-F82 WeakPolarHBondContact O-CB 3.29Å; F79-F82 PolarHBondContact O-N 2.93Å; F82-C84 PolarHBondContact O-N 2.68Å; F82-R85 PolarHBondContact O-N 3.27Å; F82-I86 HydrophobicContact CD2-CB 4.31Å; F82-I86 HydrophobicContact CD2-CG1 3.79Å; F82-I86 HydrophobicContact CE2-CB 4.05Å; F82-I86 HydrophobicContact CE2-CG1 3.73Å; F82-I86 HydrophobicContact CE2-CG2 4.11Å; F82-I86 HydrophobicContact CG-CG1 4.49Å; F82-I86 HydrophobicContact CZ-CB 4.19Å; F82-I86 HydrophobicContact CZ-CG1 4.38Å; F82-I86 HydrophobicContact CZ-CG2 3.99Å; F82-I86 VanDerWaalsContact O-CB 3.29Å; F82-I86 WeakPolarHBondContact O-CB 3.19Å; F82-I86 PolarHBondContact O-N 3.05Å
83L93.9Very high93Very high17 Ų1763.1 Ų63.19%0.08930%0.301CS..Iπ-helixtrans-61.1-44.2178.1-72.3174000111.3V70 Y75 F79 A80 R85 W87 I88V70-L83 HydrophobicContact CG1-CB 4.43Å; V70-L83 HydrophobicContact CG1-CD1 3.87Å; Y75-L83 HydrophobicContact CD1-CD1 4.46Å; Y75-L83 HydrophobicContact CD2-CD1 3.61Å; Y75-L83 HydrophobicContact CE2-CD1 3.7Å; Y75-L83 HydrophobicContact CG-CD1 4.01Å; F79-L83 HydrophobicContact CD1-CD1 3.77Å; F79-L83 HydrophobicContact CD1-CG 4.19Å; F79-L83 HydrophobicContact CE1-CD1 3.53Å; F79-L83 HydrophobicContact CE1-CD2 4.25Å; F79-L83 HydrophobicContact CE1-CG 3.92Å; F79-L83 HydrophobicContact CZ-CD1 4.19Å; F79-L83 HydrophobicContact CZ-CD2 4.06Å; F79-L83 HydrophobicContact CZ-CG 4.1Å; F79-L83 WeakPolarHBondContact O-CB 3.09Å; F79-L83 WeakPolarHBondContact O-CG 3.32Å; F79-L83 PolarHBondContact O-N 3.49Å; A80-L83 PolarHBondContact O-N 3.42Å; L83-R85 PolarHBondContact O-N 2.87Å; L83-W87 HydrophobicContact CD2-CB 4.25Å; L83-W87 CarbonylContact O-C 3.56Å; L83-W87 WeakPolarHBondContact O-CA 3.49Å; L83-W87 WeakPolarHBondContact O-CB 3.36Å; L83-W87 PolarHBondContact O-N 3.46Å; L83-I88 PolarHBondContact O-N 3.3Å
84C94.9Very high93.3Very high0 Ų062 Ų620%029%0.286CS..Iπ-helixtrans-57.8-52.1175.7-1790000111.3I72 A80 V81 F82 I88 S89 V151 H153 C158I72-C84 HydrophobicContact CD1-CB 4.09Å; A80-C84 WeakPolarHBondContact O-CB 3.46Å; A80-C84 PolarHBondContact O-N 2.75Å; V81-C84 PolarHBondContact O-N 2.98Å; F82-C84 PolarHBondContact O-N 2.68Å; C84-I88 WeakPolarHBondContact O-CB 3.3Å; C84-S89 PolarHBondContact O-N 2.79Å; C84-V151 VanDerWaalsContact O-CG2 3.28Å; C84-V151 WeakPolarHBondContact O-CG2 3.45Å; C84-H153 HydrophobicContact CB-CB 4.34Å; C84-C158 WeakPolarHBondContact CA-SG 3.46Å; C84-C158 HydrophobicContact CB-CB 3.69Å; C84-C158 WeakPolarHBondContact CB-SG 3.22Å; C84-C158 WeakPolarHBondContact SG-CB 3.25Å; C84-C158 CovalentContact SG-SG 2.04Å; C84-C158 PolarHBondContact SG-SG 3.45Å
85R95Very high93.7Very high82 Ų8256.8 Ų56.831%0.30926%0.258SS..Iπ-helixtrans-78.5-29.8-171.4-74-166.2-177.2-67.8-1.4115.5V81 F82 L83 S89 I148 V151V81-R85 HydrophobicContact CG1-CG 4.39Å; V81-R85 WeakPolarHBondContact O-CB 3.35Å; V81-R85 WeakPolarHBondContact O-CG 3.3Å; V81-R85 PolarHBondContact O-N 3.36Å; F82-R85 PolarHBondContact O-N 3.27Å; L83-R85 PolarHBondContact O-N 2.87Å; R85-S89 VanDerWaalsContact C-OG 3.28Å; R85-S89 VanDerWaalsContact O-CB 3.28Å; R85-S89 WeakPolarHBondContact O-CB 3.33Å; R85-S89 PolarHBondContact O-OG 3.27Å; R85-I148 HydrophobicContact CB-CG2 3.97Å; R85-I148 HydrophobicContact CG-CG2 4.23Å; R85-I148 PolarHBondContact NH1-O 3.08Å; R85-V151 PolarHBondContact NH1-O 2.84Å
86I94.8Very high93.9Very high32 Ų3252 Ų5216%0.16424%0.24CC..Iπ-helixtrans-106.2-36.6-173.9-60-58.5000111.5F82 Y91 W92 I148F82-I86 HydrophobicContact CD2-CB 4.31Å; F82-I86 HydrophobicContact CD2-CG1 3.79Å; F82-I86 HydrophobicContact CE2-CB 4.05Å; F82-I86 HydrophobicContact CE2-CG1 3.73Å; F82-I86 HydrophobicContact CE2-CG2 4.11Å; F82-I86 HydrophobicContact CG-CG1 4.49Å; F82-I86 HydrophobicContact CZ-CB 4.19Å; F82-I86 HydrophobicContact CZ-CG1 4.38Å; F82-I86 HydrophobicContact CZ-CG2 3.99Å; F82-I86 VanDerWaalsContact O-CB 3.29Å; F82-I86 WeakPolarHBondContact O-CB 3.19Å; F82-I86 PolarHBondContact O-N 3.05Å; I86-Y91 HydrophobicContact CD1-CD1 3.97Å; I86-Y91 HydrophobicContact CD1-CE1 4.46Å; I86-Y91 HydrophobicContact CD1-CG 4.46Å; I86-Y91 HydrophobicContact CG2-CD1 4.25Å; I86-Y91 PolarHBondContact O-N 2.81Å; I86-W92 HydrophobicContact CG2-CB 4.18Å; I86-W92 HydrophobicContact CG2-CE3 4.17Å; I86-W92 WeakPolarHBondContact O-CB 3.38Å; I86-W92 PolarHBondContact O-N 3.45Å; I86-W92 VanDerWaalsContact O-N 3.07Å; I86-I148 HydrophobicContact CD1-CD1 4.1Å; I86-I148 HydrophobicContact CD1-CG1 4.47Å
87W92.9Very high94Very high50 Ų5047.3 Ų47.319%0.18921%0.214CC..Iπ-helixtrans-94.8-59.1-176.4-170.2-93.4000112.2F61 I64 L83 S89 E90F61-W87 AromaticContact CD1-CH2 3.76Å; F61-W87 HydrophobicContact CD1-CH2 3.76Å; F61-W87 AromaticContact CD1-CZ3 3.73Å; F61-W87 HydrophobicContact CD1-CZ3 3.73Å; F61-W87 HydrophobicContact CE1-CH2 4.2Å; F61-W87 AromaticContact CE1-CZ3 3.84Å; F61-W87 HydrophobicContact CE1-CZ3 3.84Å; I64-W87 HydrophobicContact CB-CH2 3.99Å; I64-W87 HydrophobicContact CB-CZ2 4.21Å; I64-W87 HydrophobicContact CG2-CH2 3.49Å; I64-W87 VanDerWaalsContact CG2-CH2 3.49Å; I64-W87 HydrophobicContact CG2-CZ2 3.49Å; I64-W87 VanDerWaalsContact CG2-CZ2 3.49Å; L83-W87 HydrophobicContact CD2-CB 4.25Å; L83-W87 CarbonylContact O-C 3.56Å; L83-W87 WeakPolarHBondContact O-CA 3.49Å; L83-W87 WeakPolarHBondContact O-CB 3.36Å; L83-W87 PolarHBondContact O-N 3.46Å; W87-S89 VanDerWaalsContact C-N 3.33Å; W87-S89 PolarHBondContact O-N 3.44Å; W87-E90 WeakPolarHBondContact O-CA 3.38Å; W87-E90 PolarHBondContact O-N 3.38Å
88I91.1Very high94.3Very high65 Ų6542.1 Ų42.133%0.33319%0.186SC..Iπ-helixtrans-67.3-33.2-176.5-60-61.2000112.3V70 I72 L83 C84 E90V70-I88 HydrophobicContact CB-CD1 4.29Å; I72-I88 HydrophobicContact CD1-CG1 4.05Å; L83-I88 PolarHBondContact O-N 3.3Å; C84-I88 WeakPolarHBondContact O-CB 3.3Å; I88-E90 PolarHBondContact O-N 3.2Å; I88-E90 VanDerWaalsContact O-N 3.16Å
89S92Very high94.5Very high3 Ų334.4 Ų34.42%0.02116%0.158CC..THydrogen-bonded Turntrans-64.6-10.4171.370.90000114.6C84 R85 W87 Y91 F147C84-S89 PolarHBondContact O-N 2.79Å; R85-S89 VanDerWaalsContact C-OG 3.28Å; R85-S89 VanDerWaalsContact O-CB 3.28Å; R85-S89 WeakPolarHBondContact O-CB 3.33Å; R85-S89 PolarHBondContact O-OG 3.27Å; W87-S89 VanDerWaalsContact C-N 3.33Å; W87-S89 PolarHBondContact O-N 3.44Å; S89-Y91 PolarHBondContact O-N 3.26Å; S89-Y91 WeakPolarHBondContact OG-CB 2.91Å; S89-Y91 PolarHBondContact OG-N 3.42Å; S89-Y91 VanDerWaalsContact OG-N 3.12Å; S89-F147 WeakPolarHBondContact CB-O 3.22Å
90E91.4Very high94.5Very high37 Ų3731.5 Ų31.517%0.17315%0.145CC..  trans61.412.6-169.7-56.8146.8-137.600114.9W87 I88 W92 T93 K94 R292W87-E90 WeakPolarHBondContact O-CA 3.38Å; W87-E90 PolarHBondContact O-N 3.38Å; I88-E90 PolarHBondContact O-N 3.2Å; I88-E90 VanDerWaalsContact O-N 3.16Å; E90-W92 PolarHBondContact O-N 2.94Å; E90-W92 VanDerWaalsContact O-N 3.16Å; E90-T93 PolarHBondContact O-N 2.77Å; E90-K94 HydrophobicContact CB-CD 4.45Å; E90-K94 HydrophobicContact CB-CG 4.44Å; E90-K94 VanDerWaalsContact O-CB 3.32Å; E90-K94 WeakPolarHBondContact O-CB 3.08Å; E90-K94 WeakPolarHBondContact O-CG 3.32Å; E90-K94 PolarHBondContact O-N 3.19Å; E90-K94 WeakPolarHBondContact OE2-CE 3.42Å; E90-K94 IonicContact OE2-NZ 3.56Å; E90-R292 IonicContact OE1-CZ 3.37Å; E90-R292 IonicContact OE1-NE 2.86Å; E90-R292 IonicContact OE1-NH1 3.84Å; E90-R292 PolarHBondContact OE1-NH1 2.94Å; E90-R292 IonicContact OE1-NH2 3.97Å; E90-R292 PolarHBondContact OE1-NH2 3.43Å; E90-R292 IonicContact OE2-CZ 3.02Å; E90-R292 IonicContact OE2-NH2 3.72Å
91Y94.5Very high94.6Very high23 Ų2331.5 Ų31.59%0.0915%0.145CC..Hα-helixtrans-49.1-45.6176.6173.8-92.8000111I86 S89 K94 L95 I141 P144 I145 I148I86-Y91 HydrophobicContact CD1-CD1 3.97Å; I86-Y91 HydrophobicContact CD1-CE1 4.46Å; I86-Y91 HydrophobicContact CD1-CG 4.46Å; I86-Y91 HydrophobicContact CG2-CD1 4.25Å; I86-Y91 PolarHBondContact O-N 2.81Å; S89-Y91 PolarHBondContact O-N 3.26Å; S89-Y91 WeakPolarHBondContact OG-CB 2.91Å; S89-Y91 PolarHBondContact OG-N 3.42Å; S89-Y91 VanDerWaalsContact OG-N 3.12Å; Y91-K94 PolarHBondContact O-N 3.24Å; Y91-L95 HydrophobicContact CE1-CD1 3.74Å; Y91-L95 VanDerWaalsContact O-CB 3.32Å; Y91-L95 WeakPolarHBondContact O-CB 3.45Å; Y91-L95 PolarHBondContact O-N 3.02Å; Y91-I141 PolarHBondContact OH-O 3.26Å; Y91-P144 HydrophobicContact CD2-CB 3.73Å; Y91-P144 WeakPolarHBondContact CD2-O 3.42Å; Y91-P144 HydrophobicContact CE2-CB 3.85Å; Y91-P144 HydrophobicContact CE2-CG 4.45Å; Y91-I145 HydrophobicContact CE2-CG1 4.12Å; Y91-I148 HydrophobicContact CD2-CD1 3.63Å; Y91-I148 HydrophobicContact CD2-CG1 3.58Å; Y91-I148 HydrophobicContact CE2-CD1 3.86Å; Y91-I148 HydrophobicContact CE2-CG1 4.3Å; Y91-I148 HydrophobicContact CG-CD1 3.99Å; Y91-I148 HydrophobicContact CG-CG1 3.82Å
92W93.7Very high94.7Very high91 Ų9129.3 Ų29.335%0.34513%0.132SC..Hα-helixtrans-64.9-48-178.8-166.4-101.5000113.5F61 I86 E90 K94 L95 I96F61-W92 AromaticContact CD1-CD1 3.74Å; F61-W92 AromaticContact CD1-NE1 3.78Å; F61-W92 AromaticContact CD2-NE1 3.8Å; F61-W92 AromaticContact CE1-CD1 3.58Å; F61-W92 AromaticContact CE1-NE1 3.22Å; F61-W92 AromaticContact CE2-NE1 3.23Å; F61-W92 AromaticContact CZ-CD1 3.78Å; F61-W92 AromaticContact CZ-CE2 3.91Å; F61-W92 HydrophobicContact CZ-CZ2 4.34Å; F61-W92 AromaticContact CZ-NE1 2.93Å; I86-W92 HydrophobicContact CG2-CB 4.18Å; I86-W92 HydrophobicContact CG2-CE3 4.17Å; I86-W92 WeakPolarHBondContact O-CB 3.38Å; I86-W92 PolarHBondContact O-N 3.45Å; I86-W92 VanDerWaalsContact O-N 3.07Å; E90-W92 PolarHBondContact O-N 2.94Å; E90-W92 VanDerWaalsContact O-N 3.16Å; W92-K94 VanDerWaalsContact C-N 3.29Å; W92-K94 PolarHBondContact O-N 3.36Å; W92-L95 WeakPolarHBondContact O-CB 3.31Å; W92-L95 PolarHBondContact O-N 3.32Å; W92-I96 WeakPolarHBondContact O-CG1 3.31Å; W92-I96 PolarHBondContact O-N 3.02Å; W92-I96 VanDerWaalsContact O-N 3.08Å
93T92.4Very high94.8Very high42 Ų4224.9 Ų24.926%0.25811%0.113SC..Hα-helixtrans-60-42.9177.6-56.70000111E90 I96 E97E90-T93 PolarHBondContact O-N 2.77Å; T93-I96 PolarHBondContact O-N 3.26Å; T93-E97 PolarHBondContact O-N 2.77Å
94K94.8Very high94.8Very high10 Ų1024 Ų244%0.04311%0.108CC..Hα-helixtrans-66.4-38.7177.7-75.4-175.7-172.5177.60112.6E90 Y91 W92 E97 L98 P144 F147 W177E90-K94 HydrophobicContact CB-CD 4.45Å; E90-K94 HydrophobicContact CB-CG 4.44Å; E90-K94 VanDerWaalsContact O-CB 3.32Å; E90-K94 WeakPolarHBondContact O-CB 3.08Å; E90-K94 WeakPolarHBondContact O-CG 3.32Å; E90-K94 PolarHBondContact O-N 3.19Å; E90-K94 WeakPolarHBondContact OE2-CE 3.42Å; E90-K94 IonicContact OE2-NZ 3.56Å; Y91-K94 PolarHBondContact O-N 3.24Å; W92-K94 VanDerWaalsContact C-N 3.29Å; W92-K94 PolarHBondContact O-N 3.36Å; K94-E97 PolarHBondContact O-N 2.88Å; K94-L98 PolarHBondContact O-N 3.04Å; K94-P144 HydrophobicContact CB-CB 3.94Å; K94-P144 HydrophobicContact CB-CG 4.25Å; K94-F147 HydrophobicContact CD-CD1 4.24Å; K94-F147 HydrophobicContact CD-CD2 3.47Å; K94-F147 VanDerWaalsContact CD-CD2 3.47Å; K94-F147 HydrophobicContact CD-CE1 4.3Å; K94-F147 HydrophobicContact CD-CE2 3.53Å; K94-F147 HydrophobicContact CD-CG 3.85Å; K94-F147 HydrophobicContact CD-CZ 3.96Å; K94-W177 HydrophobicContact CB-CH2 3.31Å; K94-W177 HydrophobicContact CB-CZ2 4.01Å; K94-W177 HydrophobicContact CB-CZ3 3.88Å; K94-W177 HydrophobicContact CD-CH2 4.05Å; K94-W177 HydrophobicContact CD-CZ2 4.25Å; K94-W177 HydrophobicContact CD-CZ3 4.25Å; K94-W177 HydrophobicContact CG-CH2 3.61Å; K94-W177 HydrophobicContact CG-CZ2 3.82Å; K94-W177 HydrophobicContact CG-CZ3 4.26Å; K94-W177 WeakPolarHBondContact O-CH2 3.31Å
95L97.3Very high94.9Very high19 Ų1924.4 Ų24.410%0.09911%0.11CC..Hα-helixtrans-59.2-48.4173.2-179.7155.6000110.8Y91 W92 E97 L98 L99 A140 I141Y91-L95 HydrophobicContact CE1-CD1 3.74Å; Y91-L95 VanDerWaalsContact O-CB 3.32Å; Y91-L95 WeakPolarHBondContact O-CB 3.45Å; Y91-L95 PolarHBondContact O-N 3.02Å; W92-L95 WeakPolarHBondContact O-CB 3.31Å; W92-L95 PolarHBondContact O-N 3.32Å; L95-E97 VanDerWaalsContact C-N 3.34Å; L95-E97 PolarHBondContact O-N 3.39Å; L95-L98 PolarHBondContact O-N 3.47Å; L95-L99 HydrophobicContact CD2-CD1 3.63Å; L95-L99 HydrophobicContact CD2-CG 4.11Å; L95-L99 WeakPolarHBondContact O-CG 3.41Å; L95-L99 PolarHBondContact O-N 2.93Å; L95-A140 HydrophobicContact CG-CB 4.45Å; L95-I141 HydrophobicContact CD1-CG1 4.41Å
96I96.3Very high94.9Very high7 Ų721.9 Ų21.94%0.03610%0.101CC..Hα-helixtrans-63.2-41178-62.1-59.3000111.5L57 A58 F61 W92 T93 L98 L99 N100L57-I96 HydrophobicContact CB-CD1 4.43Å; L57-I96 HydrophobicContact CB-CG2 3.98Å; L57-I96 HydrophobicContact CD1-CD1 4.3Å; A58-I96 HydrophobicContact CB-CG2 4Å; F61-I96 HydrophobicContact CD2-CG1 3.96Å; F61-I96 HydrophobicContact CE2-CD1 4.35Å; F61-I96 HydrophobicContact CE2-CG1 4.22Å; W92-I96 WeakPolarHBondContact O-CG1 3.31Å; W92-I96 PolarHBondContact O-N 3.02Å; W92-I96 VanDerWaalsContact O-N 3.08Å; T93-I96 PolarHBondContact O-N 3.26Å; I96-L98 VanDerWaalsContact C-N 3.33Å; I96-L98 PolarHBondContact O-N 3.41Å; I96-L99 HydrophobicContact CD1-CD1 4.09Å; I96-L99 PolarHBondContact O-N 3.37Å; I96-N100 WeakPolarHBondContact O-CB 3.39Å; I96-N100 PolarHBondContact O-N 2.78Å
97E94.8Very high94.9Very high26 Ų2620.3 Ų20.312%0.1219%0.093CC..Hα-helixtrans-58.1-44.7174.4-172.4177.8172.200111.4T93 K94 L95 N100 V101 W177 H268T93-E97 PolarHBondContact O-N 2.77Å; K94-E97 PolarHBondContact O-N 2.88Å; L95-E97 VanDerWaalsContact C-N 3.34Å; L95-E97 PolarHBondContact O-N 3.39Å; E97-N100 WeakPolarHBondContact O-CB 3.4Å; E97-N100 PolarHBondContact O-N 2.89Å; E97-V101 HydrophobicContact CG-CG2 4.4Å; E97-V101 VanDerWaalsContact O-CG2 3.31Å; E97-V101 WeakPolarHBondContact O-CG2 3.2Å; E97-V101 PolarHBondContact O-N 3.27Å; E97-W177 HydrophobicContact CG-CZ2 4.48Å; E97-H268 IonicContact OE1-CE1 3.15Å; E97-H268 PolarHBondContact OE1-CE1 3.28Å; E97-H268 IonicContact OE1-ND1 2.61Å; E97-H268 PolarHBondContact OE1-ND1 3.35Å
98L96.9Very high94.9Very high0 Ų018 Ų180%08%0.084CC..Hα-helixtrans-71.9-33.5179.6-92.2-86.7000113.1K94 L95 I96 N100 S102 N139 A140 T143 W177 A181K94-L98 PolarHBondContact O-N 3.04Å; L95-L98 PolarHBondContact O-N 3.47Å; I96-L98 VanDerWaalsContact C-N 3.33Å; I96-L98 PolarHBondContact O-N 3.41Å; L98-N100 VanDerWaalsContact C-N 3.31Å; L98-S102 WeakPolarHBondContact O-CB 3.36Å; L98-S102 PolarHBondContact O-N 3.48Å; L98-S102 PolarHBondContact O-OG 2.96Å; L98-N139 VanDerWaalsContact CD1-ND2 3.29Å; L98-N139 WeakPolarHBondContact CD1-ND2 3.39Å; L98-A140 HydrophobicContact CB-CB 3.88Å; L98-T143 HydrophobicContact CD1-CG2 4.43Å; L98-W177 HydrophobicContact CD2-CE3 4.33Å; L98-W177 HydrophobicContact CD2-CH2 3.05Å; L98-W177 HydrophobicContact CD2-CZ2 3.46Å; L98-W177 VanDerWaalsContact CD2-CZ2 3.46Å; L98-W177 HydrophobicContact CD2-CZ3 3.55Å; L98-W177 HydrophobicContact CG-CH2 3.84Å; L98-W177 HydrophobicContact CG-CZ3 3.97Å; L98-A181 HydrophobicContact CD1-CB 4.45Å; L98-A181 HydrophobicContact CD2-CB 3.55Å
99L97.9Very high95Very high16 Ų1616.5 Ų16.58%0.0848%0.076CC..Hα-helixtrans-58.4-47.7169.5-73.2177.6000110.4F54 L95 I96 N103 I136 L137 A140F54-L99 HydrophobicContact CD1-CB 4.01Å; F54-L99 HydrophobicContact CD1-CD1 4.24Å; F54-L99 VanDerWaalsContact CD2-C 3.44Å; F54-L99 HydrophobicContact CD2-CB 3.87Å; F54-L99 WeakPolarHBondContact CD2-O 3.36Å; F54-L99 HydrophobicContact CE1-CB 3.99Å; F54-L99 HydrophobicContact CE1-CD1 3.85Å; F54-L99 HydrophobicContact CE1-CD2 4.46Å; F54-L99 HydrophobicContact CE1-CG 4.34Å; F54-L99 HydrophobicContact CE2-CB 3.82Å; F54-L99 HydrophobicContact CE2-CD2 4.45Å; F54-L99 WeakPolarHBondContact CE2-O 3.45Å; F54-L99 HydrophobicContact CG-CB 3.97Å; F54-L99 HydrophobicContact CZ-CB 3.89Å; F54-L99 HydrophobicContact CZ-CD1 4.24Å; F54-L99 HydrophobicContact CZ-CD2 4.02Å; F54-L99 HydrophobicContact CZ-CG 4.28Å; L95-L99 HydrophobicContact CD2-CD1 3.63Å; L95-L99 HydrophobicContact CD2-CG 4.11Å; L95-L99 WeakPolarHBondContact O-CG 3.41Å; L95-L99 PolarHBondContact O-N 2.93Å; I96-L99 HydrophobicContact CD1-CD1 4.09Å; I96-L99 PolarHBondContact O-N 3.37Å; L99-N103 VanDerWaalsContact O-CB 3.23Å; L99-N103 WeakPolarHBondContact O-CB 3.46Å; L99-N103 PolarHBondContact O-N 3.41Å; L99-I136 HydrophobicContact CD2-CG2 3.6Å; L99-L137 HydrophobicContact CD2-CD2 4.19Å; L99-A140 HydrophobicContact CD2-CB 3.55Å; L99-A140 HydrophobicContact CG-CB 3.72Å
100N95.4Very high95Very high2 Ų216.4 Ų16.41%0.0118%0.076CC..Hα-helixtrans-59.5-59.9178.1-175.6-15.1000111.4Q51 F54 D55 I96 E97 L98 S102 N103 L104 S303Q51-N100 PolarHBondContact NE2-OD1 2.97Å; F54-N100 HydrophobicContact CB-CB 4.02Å; D55-N100 PolarHBondContact OD1-ND2 2.96Å; D55-N100 PolarHBondContact OD1-OD1 3.1Å; I96-N100 WeakPolarHBondContact O-CB 3.39Å; I96-N100 PolarHBondContact O-N 2.78Å; E97-N100 WeakPolarHBondContact O-CB 3.4Å; E97-N100 PolarHBondContact O-N 2.89Å; L98-N100 VanDerWaalsContact C-N 3.31Å; N100-S102 PolarHBondContact O-N 3.36Å; N100-N103 PolarHBondContact O-N 3.47Å; N100-L104 PolarHBondContact O-N 2.94Å; N100-S303 PolarHBondContact ND2-OG 3.29Å
101V96Very high94.8Very high0 Ų016.5 Ų16.50%08%0.075CC..Hα-helixtrans-63.5-40.7-174.5175.60000112.1E97 L104 M105 P185 F264E97-V101 HydrophobicContact CG-CG2 4.4Å; E97-V101 VanDerWaalsContact O-CG2 3.31Å; E97-V101 WeakPolarHBondContact O-CG2 3.2Å; E97-V101 PolarHBondContact O-N 3.27Å; V101-L104 PolarHBondContact O-N 3.04Å; V101-M105 PolarHBondContact O-N 3.3Å; V101-P185 HydrophobicContact CG1-CB 3.49Å; V101-P185 VanDerWaalsContact CG1-CB 3.49Å; V101-P185 HydrophobicContact CG1-CG 3.5Å; V101-P185 VanDerWaalsContact CG1-CG 3.5Å; V101-F264 HydrophobicContact CB-CE2 4.1Å; V101-F264 HydrophobicContact CG1-CD2 4.4Å; V101-F264 HydrophobicContact CG1-CE2 3.5Å; V101-F264 HydrophobicContact CG1-CZ 3.59Å; V101-F264 HydrophobicContact CG2-CD2 4.02Å; V101-F264 HydrophobicContact CG2-CE2 3.43Å; V101-F264 VanDerWaalsContact CG2-CE2 3.43Å; V101-F264 HydrophobicContact CG2-CZ 4.34Å
102S97.3Very high94.6Very high0 Ų018 Ų180%08%0.081CC..Hα-helixtrans-65.6-41177.9-56.70000111.1L98 N100 M105 W106 N139L98-S102 WeakPolarHBondContact O-CB 3.36Å; L98-S102 PolarHBondContact O-N 3.48Å; L98-S102 PolarHBondContact O-OG 2.96Å; N100-S102 PolarHBondContact O-N 3.36Å; S102-M105 WeakPolarHBondContact O-CB 2.81Å; S102-M105 PolarHBondContact O-N 3.48Å; S102-W106 PolarHBondContact O-N 2.97Å; S102-N139 PolarHBondContact OG-ND2 3.26Å
103N96.9Very high94.5Very high0 Ų014.3 Ų14.30%07%0.07CC..Hα-helixtrans-64.5-41.2176.2-173.773.6000111.8L47 Q51 F54 L99 N100 M105 W106 I107 I136L47-N103 PolarHBondContact O-ND2 3.04Å; L47-N103 VanDerWaalsContact O-ND2 3.07Å; Q51-N103 WeakPolarHBondContact CA-ND2 3.2Å; Q51-N103 WeakPolarHBondContact CB-ND2 3.44Å; Q51-N103 PolarHBondContact N-ND2 3.48Å; Q51-N103 PolarHBondContact OE1-ND2 3.46Å; F54-N103 HydrophobicContact CD2-CB 3.76Å; F54-N103 HydrophobicContact CE2-CB 3.84Å; L99-N103 VanDerWaalsContact O-CB 3.23Å; L99-N103 WeakPolarHBondContact O-CB 3.46Å; L99-N103 PolarHBondContact O-N 3.41Å; N100-N103 PolarHBondContact O-N 3.47Å; N103-M105 PolarHBondContact O-N 3.29Å; N103-W106 PolarHBondContact O-N 3.07Å; N103-I107 WeakPolarHBondContact O-CG1 3.33Å; N103-I107 PolarHBondContact O-N 3.2Å; N103-I136 HydrophobicContact CB-CD1 4.04Å
104L95.4Very high94.3Very high0 Ų013.5 Ų13.50%07%0.067CC..Hα-helixtrans-60.8-43.9174.9-174.462.2000112N100 V101 W106 I107 S108 M189 I257 M260 F264N100-L104 PolarHBondContact O-N 2.94Å; V101-L104 PolarHBondContact O-N 3.04Å; L104-W106 VanDerWaalsContact C-N 3.32Å; L104-W106 PolarHBondContact O-N 3.4Å; L104-I107 WeakPolarHBondContact O-CB 3.37Å; L104-I107 PolarHBondContact O-N 3.29Å; L104-S108 PolarHBondContact O-N 2.91Å; L104-S108 PolarHBondContact O-OG 3.09Å; L104-M189 HydrophobicContact CD2-SD 3.99Å; L104-M189 HydrophobicContact CG-SD 3.79Å; L104-I257 HydrophobicContact CD1-CG2 4.38Å; L104-M260 HydrophobicContact CD1-CB 4.22Å; L104-M260 HydrophobicContact CD1-CE 3.96Å; L104-F264 HydrophobicContact CD2-CB 3.82Å; L104-F264 HydrophobicContact CD2-CG 4.16Å
105M95.8Very high93.9Very high8 Ų814.5 Ų14.54%0.0397%0.074CC..Hα-helixtrans-58.4-43.9173.4-178.6-170.569.500111.7V101 S102 N103 S108 I109 F135 I184 P185 V188 M189V101-M105 PolarHBondContact O-N 3.3Å; S102-M105 WeakPolarHBondContact O-CB 2.81Å; S102-M105 PolarHBondContact O-N 3.48Å; N103-M105 PolarHBondContact O-N 3.29Å; M105-S108 WeakPolarHBondContact O-CA 3.43Å; M105-S108 VanDerWaalsContact O-CB 3.24Å; M105-S108 WeakPolarHBondContact O-CB 3.4Å; M105-S108 PolarHBondContact O-N 3.24Å; M105-S108 VanDerWaalsContact O-N 3.08Å; M105-I109 HydrophobicContact CG-CD1 4.46Å; M105-I109 PolarHBondContact O-N 3.42Å; M105-I109 VanDerWaalsContact O-N 3.1Å; M105-F135 HydrophobicContact CE-CD1 4.23Å; M105-F135 HydrophobicContact CE-CE1 3.5Å; M105-F135 HydrophobicContact CE-CZ 4Å; M105-I184 HydrophobicContact SD-CG2 4.16Å; M105-P185 HydrophobicContact CB-CB 4.41Å; M105-V188 HydrophobicContact CG-CB 3.87Å; M105-V188 HydrophobicContact CG-CG1 3.54Å; M105-V188 HydrophobicContact SD-CB 4.04Å; M105-V188 HydrophobicContact SD-CG1 4.08Å; M105-V188 HydrophobicContact SD-CG2 4.13Å; M105-M189 HydrophobicContact CB-CG 4.44Å
106W95.8Very high93.3Very high28 Ų2820.7 Ų20.711%0.10610%0.097CC..Hα-helixtrans-69.2-30.9178.4-84.9107.2000113.5S102 N103 L104 S108 I109 D110 I131 C132 F135 I136S102-W106 PolarHBondContact O-N 2.97Å; N103-W106 PolarHBondContact O-N 3.07Å; L104-W106 VanDerWaalsContact C-N 3.32Å; L104-W106 PolarHBondContact O-N 3.4Å; W106-S108 PolarHBondContact O-N 3.33Å; W106-I109 HydrophobicContact CD2-CD1 4.06Å; W106-I109 HydrophobicContact CE3-CB 4.04Å; W106-I109 HydrophobicContact CE3-CD1 3.87Å; W106-I109 HydrophobicContact CE3-CG2 4.01Å; W106-I109 HydrophobicContact CH2-CD1 4.48Å; W106-I109 HydrophobicContact CZ3-CB 4.43Å; W106-I109 HydrophobicContact CZ3-CD1 4.1Å; W106-I109 HydrophobicContact CZ3-CG2 3.92Å; W106-I109 PolarHBondContact O-N 3.12Å; W106-D110 VanDerWaalsContact O-CB 3.25Å; W106-D110 WeakPolarHBondContact O-CB 3.43Å; W106-D110 PolarHBondContact O-N 3.39Å; W106-I131 HydrophobicContact CH2-CG2 3.98Å; W106-I131 HydrophobicContact CZ2-CG2 4.43Å; W106-C132 WeakPolarHBondContact CB-SG 3.47Å; W106-C132 HydrophobicContact CD2-CB 3.74Å; W106-C132 VanDerWaalsContact CD2-SG 3.59Å; W106-C132 HydrophobicContact CE3-CB 3.84Å; W106-C132 HydrophobicContact CG-CB 4.1Å; W106-C132 HydrophobicContact CZ3-CB 4.27Å; W106-F135 HydrophobicContact CZ2-CB 4.01Å; W106-F135 HydrophobicContact CZ2-CD1 4.45Å; W106-F135 HydrophobicContact CZ2-CG 4.19Å; W106-F135 AromaticContact NE1-CD1 3.15Å; W106-F135 AromaticContact NE1-CE1 3.91Å; W106-F135 AromaticContact NE1-CG 3.71Å; W106-I136 HydrophobicContact CG-CD1 4.39Å
107I93.6Very high92.8Very high0 Ų023.1 Ų23.10%011%0.11CC..Hα-helixtrans-57.4-41.3167.8-69.9167.4000109.7L47 F48 Q51 N103 L104 D110 R111 I257L47-I107 HydrophobicContact CB-CD1 4.38Å; L47-I107 HydrophobicContact CB-CG1 3.71Å; L47-I107 HydrophobicContact CD1-CG1 4.42Å; F48-I107 HydrophobicContact CD1-CD1 4.07Å; F48-I107 HydrophobicContact CE1-CD1 4.22Å; F48-I107 HydrophobicContact CE1-CG2 4.06Å; F48-I107 HydrophobicContact CZ-CG2 4Å; Q51-I107 HydrophobicContact CB-CD1 3.96Å; Q51-I107 HydrophobicContact CG-CD1 4.19Å; N103-I107 WeakPolarHBondContact O-CG1 3.33Å; N103-I107 PolarHBondContact O-N 3.2Å; L104-I107 WeakPolarHBondContact O-CB 3.37Å; L104-I107 PolarHBondContact O-N 3.29Å; I107-D110 PolarHBondContact O-N 3.03Å; I107-R111 VanDerWaalsContact O-CG 3.29Å; I107-R111 WeakPolarHBondContact O-CG 3.47Å; I107-R111 PolarHBondContact O-N 2.92Å; I107-I257 HydrophobicContact CG2-CD1 3.86Å; I107-I257 HydrophobicContact CG2-CG1 4.19Å; I107-I257 HydrophobicContact CG2-CG2 3.97Å
108S93Very high92.2Very high0 Ų028.2 Ų28.20%013%0.134CC..Hα-helixtrans-64.3-44.5177.2-44.40000113.4L104 M105 W106 R111 F112 M189 Y193L104-S108 PolarHBondContact O-N 2.91Å; L104-S108 PolarHBondContact O-OG 3.09Å; M105-S108 WeakPolarHBondContact O-CA 3.43Å; M105-S108 VanDerWaalsContact O-CB 3.24Å; M105-S108 WeakPolarHBondContact O-CB 3.4Å; M105-S108 PolarHBondContact O-N 3.24Å; M105-S108 VanDerWaalsContact O-N 3.08Å; W106-S108 PolarHBondContact O-N 3.33Å; S108-R111 PolarHBondContact O-N 3.45Å; S108-F112 PolarHBondContact O-N 2.84Å; S108-M189 VanDerWaalsContact OG-CG 3.28Å; S108-M189 WeakPolarHBondContact OG-CG 3.46Å; S108-Y193 WeakPolarHBondContact CA-OH 3.23Å; S108-Y193 VanDerWaalsContact CB-CZ 3.48Å; S108-Y193 WeakPolarHBondContact CB-OH 3.24Å; S108-Y193 PolarHBondContact N-OH 3.27Å; S108-Y193 WeakPolarHBondContact OG-CE2 3.17Å; S108-Y193 PolarHBondContact OG-OH 2.93Å
109I93.3Very high91.1Very high35 Ų3535.2 Ų35.218%0.17917%0.17CC..Hα-helixtrans-62.7-48.4176.3-64.3170.6000110.2M105 W106 R111 F112 C113 V188M105-I109 HydrophobicContact CG-CD1 4.46Å; M105-I109 PolarHBondContact O-N 3.42Å; M105-I109 VanDerWaalsContact O-N 3.1Å; W106-I109 HydrophobicContact CD2-CD1 4.06Å; W106-I109 HydrophobicContact CE3-CB 4.04Å; W106-I109 HydrophobicContact CE3-CD1 3.87Å; W106-I109 HydrophobicContact CE3-CG2 4.01Å; W106-I109 HydrophobicContact CH2-CD1 4.48Å; W106-I109 HydrophobicContact CZ3-CB 4.43Å; W106-I109 HydrophobicContact CZ3-CD1 4.1Å; W106-I109 HydrophobicContact CZ3-CG2 3.92Å; W106-I109 PolarHBondContact O-N 3.12Å; I109-R111 VanDerWaalsContact C-N 3.27Å; I109-R111 PolarHBondContact O-N 3.44Å; I109-F112 WeakPolarHBondContact O-CB 3.48Å; I109-F112 PolarHBondContact O-N 3.34Å; I109-F112 VanDerWaalsContact O-N 3.07Å; I109-C113 WeakPolarHBondContact O-CB 3.42Å; I109-C113 PolarHBondContact O-N 3.44Å; I109-C113 PolarHBondContact O-SG 2.81Å; I109-C113 VanDerWaalsContact O-SG 3.37Å; I109-V188 HydrophobicContact CD1-CG1 3.92Å; I109-V188 HydrophobicContact CG1-CG1 3.75Å
110D91.7Very high90.3Very high1 Ų142.1 Ų42.11%0.00520%0.199CC..Hα-helixtrans-57.1-40.1178.8162.178.5000111.4S43 L47 W106 I107 A114 Y121 E128S43-D110 PolarHBondContact OG-OD1 2.97Å; L47-D110 HydrophobicContact CD1-CB 3.7Å; W106-D110 VanDerWaalsContact O-CB 3.25Å; W106-D110 WeakPolarHBondContact O-CB 3.43Å; W106-D110 PolarHBondContact O-N 3.39Å; I107-D110 PolarHBondContact O-N 3.03Å; D110-A114 VanDerWaalsContact O-CB 3.26Å; D110-A114 WeakPolarHBondContact O-CB 3.42Å; D110-A114 PolarHBondContact O-N 2.93Å; D110-Y121 PolarHBondContact OD1-OH 2.75Å; D110-E128 WeakPolarHBondContact CA-OE1 3.08Å
111R88.7Confident89.5Confident39 Ų3942.8 Ų42.815%0.14720%0.201CC..Hα-helixtrans-69-41.7174.1-66.6-53.682.6-156.1-7.3113.1I107 S108 I109 A114 V115 I257I107-R111 VanDerWaalsContact O-CG 3.29Å; I107-R111 WeakPolarHBondContact O-CG 3.47Å; I107-R111 PolarHBondContact O-N 2.92Å; S108-R111 PolarHBondContact O-N 3.45Å; I109-R111 VanDerWaalsContact C-N 3.27Å; I109-R111 PolarHBondContact O-N 3.44Å; R111-A114 PolarHBondContact O-N 2.98Å; R111-V115 WeakPolarHBondContact O-CG2 3.24Å; R111-V115 PolarHBondContact O-N 2.93Å; R111-V115 VanDerWaalsContact O-N 3.12Å; R111-I257 HydrophobicContact CG-CD1 3.44Å; R111-I257 VanDerWaalsContact CG-CD1 3.44Å
112F90.5Very high88.8Confident54 Ų5450.8 Ų50.824%0.23724%0.236CC..Hα-helixtrans-59.3-49.7174.7172.1-98.7000110.9S108 I109 A114 V115 Y116 C192 R195 V196S108-F112 PolarHBondContact O-N 2.84Å; I109-F112 WeakPolarHBondContact O-CB 3.48Å; I109-F112 PolarHBondContact O-N 3.34Å; I109-F112 VanDerWaalsContact O-N 3.07Å; F112-A114 PolarHBondContact O-N 2.83Å; F112-V115 PolarHBondContact O-N 2.71Å; F112-Y116 HydrophobicContact CE1-CD1 4.38Å; F112-Y116 HydrophobicContact CE1-CG 4.44Å; F112-Y116 HydrophobicContact CE2-CG 4.4Å; F112-Y116 HydrophobicContact CZ-CD1 4.22Å; F112-Y116 HydrophobicContact CZ-CD2 4.41Å; F112-Y116 AromaticContact CZ-CG 3.98Å; F112-Y116 HydrophobicContact CZ-CG 3.98Å; F112-Y116 VanDerWaalsContact O-CB 3.24Å; F112-Y116 WeakPolarHBondContact O-CB 3.25Å; F112-Y116 PolarHBondContact O-N 2.93Å; F112-C192 HydrophobicContact CB-CB 4.01Å; F112-R195 HydrophobicContact CD2-CB 4.05Å; F112-R195 HydrophobicContact CE2-CB 3.81Å; F112-R195 HydrophobicContact CE2-CG 4.4Å; F112-V196 HydrophobicContact CB-CG2 4.03Å; F112-V196 HydrophobicContact CD2-CG2 4.15Å
113C90.3Very high88.1Confident14 Ų1454.3 Ų54.310%0.09527%0.265CS..Hα-helixtrans-59.4-44.8176.5-70.90000112I109 V115 L117 Y121I109-C113 WeakPolarHBondContact O-CB 3.42Å; I109-C113 PolarHBondContact O-N 3.44Å; I109-C113 PolarHBondContact O-SG 2.81Å; I109-C113 VanDerWaalsContact O-SG 3.37Å; C113-V115 VanDerWaalsContact C-N 3.29Å; C113-V115 PolarHBondContact O-N 2.96Å; C113-L117 HydrophobicContact CB-CD1 4.23Å; C113-L117 WeakPolarHBondContact O-CA 3.3Å; C113-L117 VanDerWaalsContact O-CB 3.27Å; C113-L117 WeakPolarHBondContact O-CB 3.33Å; C113-L117 PolarHBondContact O-N 3.37Å; C113-Y121 HydrophobicContact CB-CD2 3.89Å; C113-Y121 HydrophobicContact CB-CE2 4.18Å
114A87.9Confident87.4Confident25 Ų2557.8 Ų57.821%0.20728%0.28CS..Hα-helixtrans-60.9-36.5178.800000113D110 R111 F112 Y121D110-A114 VanDerWaalsContact O-CB 3.26Å; D110-A114 WeakPolarHBondContact O-CB 3.42Å; D110-A114 PolarHBondContact O-N 2.93Å; R111-A114 PolarHBondContact O-N 2.98Å; F112-A114 PolarHBondContact O-N 2.83Å; A114-Y121 HydrophobicContact CB-CD1 4.38Å; A114-Y121 HydrophobicContact CB-CD2 4.41Å; A114-Y121 HydrophobicContact CB-CE1 4.2Å; A114-Y121 HydrophobicContact CB-CE2 4.21Å; A114-Y121 HydrophobicContact CB-CG 4.48Å
115V86.2Confident86.8Confident30 Ų3060 Ų6018%0.18229%0.291CS..Hα-helixtrans-83.4-42.7-179.6173.30000112R111 F112 C113 Q118 V196 I199R111-V115 WeakPolarHBondContact O-CG2 3.24Å; R111-V115 PolarHBondContact O-N 2.93Å; R111-V115 VanDerWaalsContact O-N 3.12Å; F112-V115 PolarHBondContact O-N 2.71Å; C113-V115 VanDerWaalsContact C-N 3.29Å; C113-V115 PolarHBondContact O-N 2.96Å; V115-Q118 VanDerWaalsContact O-CG 3.28Å; V115-Q118 WeakPolarHBondContact O-CG 3.48Å; V115-V196 HydrophobicContact CB-CG2 4.46Å; V115-V196 HydrophobicContact CG2-CG1 4.14Å; V115-I199 HydrophobicContact CG1-CB 4.22Å; V115-I199 HydrophobicContact CG1-CD1 4.45Å; V115-I199 HydrophobicContact CG1-CG2 3.72Å
116Y86.6Confident86Confident149 Ų14967.4 Ų67.458%0.58432%0.323SS*.Hα-helixtrans-80.5-46-174.8-177.4-103.2000112.6F112 I199F112-Y116 HydrophobicContact CE1-CD1 4.38Å; F112-Y116 HydrophobicContact CE1-CG 4.44Å; F112-Y116 HydrophobicContact CE2-CG 4.4Å; F112-Y116 HydrophobicContact CZ-CD1 4.22Å; F112-Y116 HydrophobicContact CZ-CD2 4.41Å; F112-Y116 AromaticContact CZ-CG 3.98Å; F112-Y116 HydrophobicContact CZ-CG 3.98Å; F112-Y116 VanDerWaalsContact O-CB 3.24Å; F112-Y116 WeakPolarHBondContact O-CB 3.25Å; F112-Y116 PolarHBondContact O-N 2.93Å; Y116-I199 HydrophobicContact CD2-CD1 4.06Å
117L85.6Confident85.7Confident58 Ų5872.8 Ų72.830%0.30434%0.344SS..THydrogen-bonded Turntrans-87.4-16.5-174.6-61.3177000113.6C113 I119 K120C113-L117 HydrophobicContact CB-CD1 4.23Å; C113-L117 WeakPolarHBondContact O-CA 3.3Å; C113-L117 VanDerWaalsContact O-CB 3.27Å; C113-L117 WeakPolarHBondContact O-CB 3.33Å; C113-L117 PolarHBondContact O-N 3.37Å; L117-I119 PolarHBondContact O-N 3.48Å; L117-K120 HydrophobicContact CB-CB 4.25Å; L117-K120 PolarHBondContact O-N 3.34Å
118Q81.8Confident85.5Confident134 Ų13472.9 Ų72.963%0.62634%0.344SS*.THydrogen-bonded Turntrans40.2-91177-58.8-176.15.500114.7V115 Y121V115-Q118 VanDerWaalsContact O-CG 3.28Å; V115-Q118 WeakPolarHBondContact O-CG 3.48Å; Q118-Y121 WeakPolarHBondContact O-CB 3.26Å
119I73.6Confident85.4Confident147 Ų14774.5 Ų74.575%0.75435%0.353SS*.THydrogen-bonded Turntrans-69.5-43.7-178.6-59.5172.9000111.2L117 Y121 K122L117-I119 PolarHBondContact O-N 3.48Å; I119-Y121 PolarHBondContact O-N 3.25Å; I119-K122 PolarHBondContact O-N 2.91Å
120K80.5Confident85.5Confident161 Ų16179.9 Ų79.970%0.738%0.375SS*.THydrogen-bonded Turntrans-66.1-24.6-179.4-68-176.6179.1-178.50112.3L117 K122 A123 F124L117-K120 HydrophobicContact CB-CB 4.25Å; L117-K120 PolarHBondContact O-N 3.34Å; K120-K122 VanDerWaalsContact C-N 3.28Å; K120-K122 PolarHBondContact O-N 3.32Å; K120-A123 PolarHBondContact O-N 3.41Å; K120-F124 PolarHBondContact O-N 3.34Å
121Y79.6Confident85.6Confident15 Ų1583.6 Ų83.66%0.05939%0.394CS..Hα-helixtrans-58.8-36.1177.9175.7-103000112.4S41 D110 C113 A114 Q118 I119 A123 F124 Q125 E128S41-Y121 PolarHBondContact OG-OH 2.97Å; D110-Y121 PolarHBondContact OD1-OH 2.75Å; C113-Y121 HydrophobicContact CB-CD2 3.89Å; C113-Y121 HydrophobicContact CB-CE2 4.18Å; A114-Y121 HydrophobicContact CB-CD1 4.38Å; A114-Y121 HydrophobicContact CB-CD2 4.41Å; A114-Y121 HydrophobicContact CB-CE1 4.2Å; A114-Y121 HydrophobicContact CB-CE2 4.21Å; A114-Y121 HydrophobicContact CB-CG 4.48Å; Q118-Y121 WeakPolarHBondContact O-CB 3.26Å; I119-Y121 PolarHBondContact O-N 3.25Å; Y121-A123 VanDerWaalsContact C-N 3.32Å; Y121-A123 PolarHBondContact O-N 2.97Å; Y121-F124 PolarHBondContact O-N 2.92Å; Y121-Q125 HydrophobicContact CE1-CG 4.32Å; Y121-Q125 WeakPolarHBondContact O-CB 3.33Å; Y121-Q125 PolarHBondContact O-N 3.38Å; Y121-E128 WeakPolarHBondContact CE2-OE2 3.09Å
122K80.2Confident85.9Confident169 Ų16981.8 Ų81.874%0.73539%0.388SS*.Hα-helixtrans-61.7-37.1179.8-71.8-174.2178.7179.20113.5I119 K120I119-K122 PolarHBondContact O-N 2.91Å; K120-K122 VanDerWaalsContact C-N 3.28Å; K120-K122 PolarHBondContact O-N 3.32Å
123A82.4Confident86.2Confident74 Ų7481.8 Ų81.861%0.61239%0.387SS*.Hα-helixtrans-73.4-40.6176.700000111.1K120 Y121K120-A123 PolarHBondContact O-N 3.41Å; Y121-A123 VanDerWaalsContact C-N 3.32Å; Y121-A123 PolarHBondContact O-N 2.97Å
124F82.5Confident86.6Confident72 Ų7284.1 Ų84.132%0.31640%0.4SS..Hα-helixtrans-67.6-33.4178.7-175.8-108.1000113K120 Y121 K126 Y127 E128 I131K120-F124 PolarHBondContact O-N 3.34Å; Y121-F124 PolarHBondContact O-N 2.92Å; F124-K126 PolarHBondContact O-N 2.95Å; F124-Y127 PolarHBondContact O-N 3.23Å; F124-E128 HydrophobicContact CD1-CB 3.73Å; F124-E128 HydrophobicContact CD1-CG 4.1Å; F124-E128 HydrophobicContact CE1-CB 3.55Å; F124-E128 HydrophobicContact CE1-CG 3.62Å; F124-E128 HydrophobicContact CZ-CB 4.22Å; F124-E128 HydrophobicContact CZ-CG 4.47Å; F124-E128 WeakPolarHBondContact O-CB 3.34Å; F124-E128 PolarHBondContact O-N 2.96Å; F124-I131 HydrophobicContact CE2-CD1 4.3Å; F124-I131 HydrophobicContact CZ-CD1 4.49Å
125Q83.8Confident87Confident46 Ų4686.6 Ų86.622%0.21541%0.406CS..Hα-helixtrans-54.9-27.6-175.6-160-168.5-23.200113.5S43 Y121S43-Q125 VanDerWaalsContact N-NE2 3.14Å; Y121-Q125 HydrophobicContact CE1-CG 4.32Å; Y121-Q125 WeakPolarHBondContact O-CB 3.33Å; Y121-Q125 PolarHBondContact O-N 3.38Å
126K79.2Confident87.6Confident164 Ų16485.1 Ų85.171%0.71340%0.398SS*.Hα-helixtrans-66.7-37.5177.1-172.3-179.3178-173.10112.3F124F124-K126 PolarHBondContact O-N 2.95Å
127Y88.7Confident88.1Confident141 Ų14182.3 Ų82.355%0.55339%0.392SS*.Hα-helixtrans-99.2-23.3-176.9-58.1-73.7000112.6F124 L129 F130 I131F124-Y127 PolarHBondContact O-N 3.23Å; Y127-L129 PolarHBondContact O-N 2.91Å; Y127-F130 WeakPolarHBondContact O-CB 3.38Å; Y127-F130 PolarHBondContact O-N 3.4Å; Y127-F130 VanDerWaalsContact O-N 3.1Å; Y127-I131 WeakPolarHBondContact O-CG1 3.21Å; Y127-I131 PolarHBondContact O-N 2.58Å
128E89.1Confident88.7Confident2 Ų282.7 Ų82.71%0.00940%0.399CS..Hα-helixtrans-51.3-51.2179.4-180175.4-145.900112.4D110 Y121 F124 F130 I131 C132D110-E128 WeakPolarHBondContact CA-OE1 3.08Å; Y121-E128 WeakPolarHBondContact CE2-OE2 3.09Å; F124-E128 HydrophobicContact CD1-CB 3.73Å; F124-E128 HydrophobicContact CD1-CG 4.1Å; F124-E128 HydrophobicContact CE1-CB 3.55Å; F124-E128 HydrophobicContact CE1-CG 3.62Å; F124-E128 HydrophobicContact CZ-CB 4.22Å; F124-E128 HydrophobicContact CZ-CG 4.47Å; F124-E128 WeakPolarHBondContact O-CB 3.34Å; F124-E128 PolarHBondContact O-N 2.96Å; E128-F130 VanDerWaalsContact C-N 3.3Å; E128-F130 PolarHBondContact O-N 3.32Å; E128-I131 PolarHBondContact O-N 3.12Å; E128-C132 WeakPolarHBondContact O-CB 3.44Å; E128-C132 PolarHBondContact O-N 2.96Å
129L91.8Very high89.5Confident34 Ų3477 Ų7718%0.17837%0.373CS..Hα-helixtrans-62.8-38.2-179.6-70.2176.4000111.9S43 I46 L47 Y127 Y133S43-L129 WeakPolarHBondContact OG-CD2 3.34Å; I46-L129 HydrophobicContact CD1-CD1 3.79Å; I46-L129 HydrophobicContact CG2-CD2 4.39Å; L47-L129 HydrophobicContact CD2-CD2 4.38Å; L47-L129 HydrophobicContact CG-CD2 4.26Å; Y127-L129 PolarHBondContact O-N 2.91Å; L129-Y133 HydrophobicContact CB-CD2 4.41Å; L129-Y133 HydrophobicContact CD2-CE2 4.06Å; L129-Y133 WeakPolarHBondContact O-CB 3.25Å; L129-Y133 WeakPolarHBondContact O-CD2 3.42Å; L129-Y133 PolarHBondContact O-N 3.48Å
130F94.2Very high90.6Very high149 Ų14970 Ų7065%0.65434%0.337SS*.Hα-helixtrans-65.3-47.4178.1177.6-99.2000111.4Y127 E128 T134Y127-F130 WeakPolarHBondContact O-CB 3.38Å; Y127-F130 PolarHBondContact O-N 3.4Å; Y127-F130 VanDerWaalsContact O-N 3.1Å; E128-F130 VanDerWaalsContact C-N 3.3Å; E128-F130 PolarHBondContact O-N 3.32Å; F130-T134 VanDerWaalsContact O-CB 3.29Å; F130-T134 WeakPolarHBondContact O-CB 3.27Å; F130-T134 PolarHBondContact O-N 3.1Å; F130-T134 PolarHBondContact O-OG1 3.45Å
131I94.9Very high91.5Very high78 Ų7866.1 Ų66.140%0.432%0.323SS..Hα-helixtrans-61.9-47.2177.3-64.6167.2000110.2W106 F124 Y127 E128 T134 F135W106-I131 HydrophobicContact CH2-CG2 3.98Å; W106-I131 HydrophobicContact CZ2-CG2 4.43Å; F124-I131 HydrophobicContact CE2-CD1 4.3Å; F124-I131 HydrophobicContact CZ-CD1 4.49Å; Y127-I131 WeakPolarHBondContact O-CG1 3.21Å; Y127-I131 PolarHBondContact O-N 2.58Å; E128-I131 PolarHBondContact O-N 3.12Å; I131-T134 PolarHBondContact O-N 2.83Å; I131-F135 WeakPolarHBondContact O-CB 3.26Å; I131-F135 PolarHBondContact O-N 3.07Å
132C95.5Very high92.3Very high2 Ų270.4 Ų70.41%0.01435%0.347CS..Hα-helixtrans-56.4-55.8179.1170.50000111.7W106 E128 T134 F135 I136W106-C132 WeakPolarHBondContact CB-SG 3.47Å; W106-C132 HydrophobicContact CD2-CB 3.74Å; W106-C132 VanDerWaalsContact CD2-SG 3.59Å; W106-C132 HydrophobicContact CE3-CB 3.84Å; W106-C132 HydrophobicContact CG-CB 4.1Å; W106-C132 HydrophobicContact CZ3-CB 4.27Å; E128-C132 WeakPolarHBondContact O-CB 3.44Å; E128-C132 PolarHBondContact O-N 2.96Å; C132-T134 PolarHBondContact O-N 3.21Å; C132-F135 PolarHBondContact O-N 3.28Å; C132-I136 VanDerWaalsContact O-CG1 3.26Å; C132-I136 WeakPolarHBondContact O-CG1 3.06Å; C132-I136 PolarHBondContact O-N 3.18Å; C132-I136 WeakPolarHBondContact SG-CD1 3.35Å
133Y96.5Very high93.2Very high54 Ų5462.9 Ų62.921%0.21232%0.315CS..Hα-helixtrans-70.5-31.6-177.9-75.4-61.8000113.5I46 T50 L129 I136 L137I46-Y133 HydrophobicContact CG2-CE2 4.17Å; I46-Y133 WeakPolarHBondContact CG2-OH 3.44Å; T50-Y133 WeakPolarHBondContact CB-OH 3.3Å; T50-Y133 HydrophobicContact CG2-CE1 3.96Å; T50-Y133 PolarHBondContact OG1-OH 2.89Å; L129-Y133 HydrophobicContact CB-CD2 4.41Å; L129-Y133 HydrophobicContact CD2-CE2 4.06Å; L129-Y133 WeakPolarHBondContact O-CB 3.25Å; L129-Y133 WeakPolarHBondContact O-CD2 3.42Å; L129-Y133 PolarHBondContact O-N 3.48Å; Y133-I136 HydrophobicContact CD1-CD1 4.04Å; Y133-I136 HydrophobicContact CE1-CD1 4.22Å; Y133-I136 PolarHBondContact O-N 3.36Å; Y133-L137 WeakPolarHBondContact O-CB 3.34Å; Y133-L137 VanDerWaalsContact O-CG 3.25Å; Y133-L137 WeakPolarHBondContact O-CG 3.22Å; Y133-L137 PolarHBondContact O-N 3.23Å
134T97.5Very high93.9Very high62 Ų6259.4 Ų59.438%0.3829%0.286SS..Hα-helixtrans-60.9-48171.7-57.40000110F130 I131 C132 C138F130-T134 VanDerWaalsContact O-CB 3.29Å; F130-T134 WeakPolarHBondContact O-CB 3.27Å; F130-T134 PolarHBondContact O-N 3.1Å; F130-T134 PolarHBondContact O-OG1 3.45Å; I131-T134 PolarHBondContact O-N 2.83Å; C132-T134 PolarHBondContact O-N 3.21Å; T134-C138 WeakPolarHBondContact O-CB 3.43Å; T134-C138 PolarHBondContact O-N 3.41Å; T134-C138 PolarHBondContact O-SG 2.94Å
135F97.5Very high94.6Very high77 Ų7758.7 Ų58.734%0.33829%0.285SS..Hα-helixtrans-61.3-49.2175.6176.2-84.7000112.1M105 W106 I131 C132 L137 C138 N139M105-F135 HydrophobicContact CE-CD1 4.23Å; M105-F135 HydrophobicContact CE-CE1 3.5Å; M105-F135 HydrophobicContact CE-CZ 4Å; W106-F135 HydrophobicContact CZ2-CB 4.01Å; W106-F135 HydrophobicContact CZ2-CD1 4.45Å; W106-F135 HydrophobicContact CZ2-CG 4.19Å; W106-F135 AromaticContact NE1-CD1 3.15Å; W106-F135 AromaticContact NE1-CE1 3.91Å; W106-F135 AromaticContact NE1-CG 3.71Å; I131-F135 WeakPolarHBondContact O-CB 3.26Å; I131-F135 PolarHBondContact O-N 3.07Å; C132-F135 PolarHBondContact O-N 3.28Å; F135-L137 VanDerWaalsContact C-N 3.31Å; F135-L137 PolarHBondContact O-N 3.25Å; F135-C138 PolarHBondContact O-N 3.45Å; F135-N139 HydrophobicContact CD1-CB 4.38Å; F135-N139 HydrophobicContact CE1-CB 4.02Å; F135-N139 HydrophobicContact CZ-CB 4.22Å; F135-N139 WeakPolarHBondContact O-CB 3.31Å; F135-N139 PolarHBondContact O-N 3.36Å
136I97.9Very high95.2Very high0 Ų057.3 Ų57.30%028%0.28CS..Hα-helixtrans-56.4-48.4-178.4-71.6167.6000110F54 L99 N103 W106 C132 Y133 A140F54-I136 HydrophobicContact CE2-CG2 4.37Å; L99-I136 HydrophobicContact CD2-CG2 3.6Å; N103-I136 HydrophobicContact CB-CD1 4.04Å; W106-I136 HydrophobicContact CG-CD1 4.39Å; C132-I136 VanDerWaalsContact O-CG1 3.26Å; C132-I136 WeakPolarHBondContact O-CG1 3.06Å; C132-I136 PolarHBondContact O-N 3.18Å; C132-I136 WeakPolarHBondContact SG-CD1 3.35Å; Y133-I136 HydrophobicContact CD1-CD1 4.04Å; Y133-I136 HydrophobicContact CE1-CD1 4.22Å; Y133-I136 PolarHBondContact O-N 3.36Å; I136-A140 WeakPolarHBondContact O-CB 3.3Å; I136-A140 PolarHBondContact O-N 2.83Å
137L97.9Very high95.9Very high90 Ų9050.2 Ų50.247%0.47125%0.249SC..Hα-helixtrans-67.2-46.7-179.6-69.8172.1000111.7L99 Y133 F135 N139 A140 I141L99-L137 HydrophobicContact CD2-CD2 4.19Å; Y133-L137 WeakPolarHBondContact O-CB 3.34Å; Y133-L137 VanDerWaalsContact O-CG 3.25Å; Y133-L137 WeakPolarHBondContact O-CG 3.22Å; Y133-L137 PolarHBondContact O-N 3.23Å; F135-L137 VanDerWaalsContact C-N 3.31Å; F135-L137 PolarHBondContact O-N 3.25Å; L137-N139 PolarHBondContact O-N 3.19Å; L137-A140 PolarHBondContact O-N 3.07Å; L137-I141 VanDerWaalsContact O-CB 3.28Å; L137-I141 WeakPolarHBondContact O-CB 3.31Å; L137-I141 WeakPolarHBondContact O-CG1 3.29Å; L137-I141 PolarHBondContact O-N 2.88Å
138C98.1Very high96.3Very high65 Ų6544.9 Ų44.944%0.43923%0.23SC..Hα-helixtrans-60.6-46.5177.5-71.10000111.7T134 F135 I141 L142T134-C138 WeakPolarHBondContact O-CB 3.43Å; T134-C138 PolarHBondContact O-N 3.41Å; T134-C138 PolarHBondContact O-SG 2.94Å; F135-C138 PolarHBondContact O-N 3.45Å; C138-I141 PolarHBondContact O-N 2.89Å; C138-L142 HydrophobicContact CB-CD1 4.44Å; C138-L142 WeakPolarHBondContact O-CB 3.46Å; C138-L142 WeakPolarHBondContact O-CG 3.38Å; C138-L142 PolarHBondContact O-N 2.88Å
139N97.8Very high96.6Very high15 Ų1549.8 Ų49.88%0.0825%0.251CS..Hα-helixtrans-64.1-45.4179-172.338.8000111.4L98 S102 F135 L137 I141 T143L98-N139 VanDerWaalsContact CD1-ND2 3.29Å; L98-N139 WeakPolarHBondContact CD1-ND2 3.39Å; S102-N139 PolarHBondContact OG-ND2 3.26Å; F135-N139 HydrophobicContact CD1-CB 4.38Å; F135-N139 HydrophobicContact CE1-CB 4.02Å; F135-N139 HydrophobicContact CZ-CB 4.22Å; F135-N139 WeakPolarHBondContact O-CB 3.31Å; F135-N139 PolarHBondContact O-N 3.36Å; L137-N139 PolarHBondContact O-N 3.19Å; N139-I141 PolarHBondContact O-N 3.01Å; N139-T143 WeakPolarHBondContact O-CB 3.18Å; N139-T143 PolarHBondContact O-N 3.39Å; N139-T143 VanDerWaalsContact O-N 3.11Å; N139-T143 PolarHBondContact O-OG1 2.88Å; N139-T143 PolarHBondContact OD1-OG1 3.46Å
140A98Very high96.7Very high1 Ų149.1 Ų49.11%0.00825%0.249CC..Hα-helixtrans-70.7-30-179.300000113.7L95 L98 L99 I136 L137 P144L95-A140 HydrophobicContact CG-CB 4.45Å; L98-A140 HydrophobicContact CB-CB 3.88Å; L99-A140 HydrophobicContact CD2-CB 3.55Å; L99-A140 HydrophobicContact CG-CB 3.72Å; I136-A140 WeakPolarHBondContact O-CB 3.3Å; I136-A140 PolarHBondContact O-N 2.83Å; L137-A140 PolarHBondContact O-N 3.07Å; A140-P144 WeakPolarHBondContact O-CD 3.2Å; A140-P144 WeakPolarHBondContact O-CG 3.46Å
141I97.8Very high96.7Very high78 Ų7842.5 Ų42.540%0.422%0.22SC..Hα-helixtrans-80.7-48.1177.6-68.7168.3000110.7Y91 L95 L137 C138 N139 I145Y91-I141 PolarHBondContact OH-O 3.26Å; L95-I141 HydrophobicContact CD1-CG1 4.41Å; L137-I141 VanDerWaalsContact O-CB 3.28Å; L137-I141 WeakPolarHBondContact O-CB 3.31Å; L137-I141 WeakPolarHBondContact O-CG1 3.29Å; L137-I141 PolarHBondContact O-N 2.88Å; C138-I141 PolarHBondContact O-N 2.89Å; N139-I141 PolarHBondContact O-N 3.01Å; I141-I145 WeakPolarHBondContact O-CG1 3.39Å
142L97.8Very high96.7Very high106 Ų10644.2 Ų44.256%0.55523%0.225SC*.Hα-helixtrans-79.9-43.4-169.4-62.8175.8000113C138 I145C138-L142 HydrophobicContact CB-CD1 4.44Å; C138-L142 WeakPolarHBondContact O-CB 3.46Å; C138-L142 WeakPolarHBondContact O-CG 3.38Å; C138-L142 PolarHBondContact O-N 2.88Å; L142-I145 HydrophobicContact CD2-CD1 3.77Å; L142-I145 WeakPolarHBondContact O-CB 3.28Å; L142-I145 WeakPolarHBondContact O-CG1 3.4Å; L142-I145 PolarHBondContact O-N 3.18Å; L142-I145 VanDerWaalsContact O-N 3.13Å
143T97.7Very high96.6Very high11 Ų1145.4 Ų45.47%0.06723%0.23CC..THydrogen-bonded Turntrans-60.4-40-174.2-62.10000113.1L98 N139 P146 N176 W177 F180L98-T143 HydrophobicContact CD1-CG2 4.43Å; N139-T143 WeakPolarHBondContact O-CB 3.18Å; N139-T143 PolarHBondContact O-N 3.39Å; N139-T143 VanDerWaalsContact O-N 3.11Å; N139-T143 PolarHBondContact O-OG1 2.88Å; N139-T143 PolarHBondContact OD1-OG1 3.46Å; T143-P146 WeakPolarHBondContact O-CD 3.49Å; T143-N176 PolarHBondContact O-ND2 3.33Å; T143-W177 HydrophobicContact CG2-CE3 4.05Å; T143-W177 HydrophobicContact CG2-CZ3 4.22Å; T143-F180 HydrophobicContact CG2-CB 3.72Å; T143-F180 HydrophobicContact CG2-CD2 4.4Å; T143-F180 HydrophobicContact CG2-CG 4.31Å
144P97.2Very high96.3Very high0 Ų046.4 Ų46.40%024%0.239CC..THydrogen-bonded Turntrans-81.1-9177.1-8.724.7000115.2Y91 K94 A140 P146 F147 W177Y91-P144 HydrophobicContact CD2-CB 3.73Å; Y91-P144 WeakPolarHBondContact CD2-O 3.42Å; Y91-P144 HydrophobicContact CE2-CB 3.85Å; Y91-P144 HydrophobicContact CE2-CG 4.45Å; K94-P144 HydrophobicContact CB-CB 3.94Å; K94-P144 HydrophobicContact CB-CG 4.25Å; A140-P144 WeakPolarHBondContact O-CD 3.2Å; A140-P144 WeakPolarHBondContact O-CG 3.46Å; P144-P146 VanDerWaalsContact C-N 3.29Å; P144-P146 VanDerWaalsContact O-N 3.16Å; P144-F147 HydrophobicContact CB-CD2 4.29Å; P144-F147 WeakPolarHBondContact O-CB 3.28Å; P144-F147 WeakPolarHBondContact O-CD2 3.45Å; P144-F147 PolarHBondContact O-N 3.45Å; P144-W177 HydrophobicContact CB-CZ3 4.21Å; P144-W177 HydrophobicContact CG-CZ3 3.98Å
145I97.3Very high95.8Very high58 Ų5850 Ų5030%0.29726%0.256SS..G310 helixtrans-48.3-45.2-176.6-70.5178.5000112.9Y91 I141 L142 F147 I148 F149Y91-I145 HydrophobicContact CE2-CG1 4.12Å; I141-I145 WeakPolarHBondContact O-CG1 3.39Å; L142-I145 HydrophobicContact CD2-CD1 3.77Å; L142-I145 WeakPolarHBondContact O-CB 3.28Å; L142-I145 WeakPolarHBondContact O-CG1 3.4Å; L142-I145 PolarHBondContact O-N 3.18Å; L142-I145 VanDerWaalsContact O-N 3.13Å; I145-F147 PolarHBondContact O-N 2.99Å; I145-F147 VanDerWaalsContact O-N 3.07Å; I145-I148 VanDerWaalsContact O-CB 3.28Å; I145-I148 WeakPolarHBondContact O-CB 3.15Å; I145-I148 WeakPolarHBondContact O-CG1 3.34Å; I145-I148 PolarHBondContact O-N 2.9Å; I145-F149 HydrophobicContact CG2-CE2 3.89Å
146P96.3Very high95.3Very high16 Ų1650.7 Ų50.710%0.10426%0.263CS..G310 helixtrans-53.8-30.3179.2-31.440.5000114.5T143 P144 I148 F149 F169 F172 L173T143-P146 WeakPolarHBondContact O-CD 3.49Å; P144-P146 VanDerWaalsContact C-N 3.29Å; P144-P146 VanDerWaalsContact O-N 3.16Å; P146-I148 PolarHBondContact O-N 3.38Å; P146-F149 PolarHBondContact O-N 3.25Å; P146-F149 VanDerWaalsContact O-N 3.11Å; P146-F169 HydrophobicContact CB-CE2 4.47Å; P146-F169 HydrophobicContact CB-CZ 4.47Å; P146-F169 WeakPolarHBondContact O-CZ 3.07Å; P146-F172 HydrophobicContact CB-CE1 4.02Å; P146-F172 HydrophobicContact CG-CE1 3.61Å; P146-F172 HydrophobicContact CG-CZ 4.33Å; P146-L173 HydrophobicContact CB-CD2 3.29Å; P146-L173 HydrophobicContact CG-CD2 4.5Å
147F94.6Very high95Very high15 Ų1553.8 Ų53.87%0.06628%0.282CS..G310 helixtrans-64.5-26.2177.4-68.8-72.5000113S89 K94 P144 I145 F149 T150 L173 W177S89-F147 WeakPolarHBondContact CB-O 3.22Å; K94-F147 HydrophobicContact CD-CD1 4.24Å; K94-F147 HydrophobicContact CD-CD2 3.47Å; K94-F147 VanDerWaalsContact CD-CD2 3.47Å; K94-F147 HydrophobicContact CD-CE1 4.3Å; K94-F147 HydrophobicContact CD-CE2 3.53Å; K94-F147 HydrophobicContact CD-CG 3.85Å; K94-F147 HydrophobicContact CD-CZ 3.96Å; P144-F147 HydrophobicContact CB-CD2 4.29Å; P144-F147 WeakPolarHBondContact O-CB 3.28Å; P144-F147 WeakPolarHBondContact O-CD2 3.45Å; P144-F147 PolarHBondContact O-N 3.45Å; I145-F147 PolarHBondContact O-N 2.99Å; I145-F147 VanDerWaalsContact O-N 3.07Å; F147-F149 PolarHBondContact O-N 3.43Å; F147-F149 VanDerWaalsContact O-N 3.14Å; F147-T150 HydrophobicContact CD1-CG2 4.38Å; F147-T150 PolarHBondContact O-N 3.48Å; F147-T150 VanDerWaalsContact O-N 3.12Å; F147-T150 PolarHBondContact O-OG1 3.25Å; F147-L173 HydrophobicContact CD1-CD1 4.42Å; F147-L173 HydrophobicContact CD1-CD2 4.18Å; F147-L173 HydrophobicContact CE1-CB 4.34Å; F147-L173 HydrophobicContact CE1-CD1 4.25Å; F147-L173 HydrophobicContact CE1-CD2 4.06Å; F147-L173 HydrophobicContact CE1-CG 4.48Å; F147-L173 HydrophobicContact CG-CD2 4.44Å; F147-L173 HydrophobicContact CZ-CB 4.46Å; F147-L173 HydrophobicContact CZ-CD2 4.24Å; F147-W177 HydrophobicContact CE2-CD2 4.23Å; F147-W177 AromaticContact CE2-CE3 3.74Å; F147-W177 HydrophobicContact CE2-CE3 3.74Å; F147-W177 HydrophobicContact CE2-CZ3 4.24Å; F147-W177 HydrophobicContact CZ-CB 4.44Å; F147-W177 HydrophobicContact CZ-CE3 4.47Å
148I96.2Very high94.8Very high29 Ų2950.9 Ų50.915%0.14927%0.269CS..G310 helixtrans-59-29.2175.4-63.4174.3000111.6R85 I86 Y91 I145 P146R85-I148 HydrophobicContact CB-CG2 3.97Å; R85-I148 HydrophobicContact CG-CG2 4.23Å; R85-I148 PolarHBondContact NH1-O 3.08Å; I86-I148 HydrophobicContact CD1-CD1 4.1Å; I86-I148 HydrophobicContact CD1-CG1 4.47Å; Y91-I148 HydrophobicContact CD2-CD1 3.63Å; Y91-I148 HydrophobicContact CD2-CG1 3.58Å; Y91-I148 HydrophobicContact CE2-CD1 3.86Å; Y91-I148 HydrophobicContact CE2-CG1 4.3Å; Y91-I148 HydrophobicContact CG-CD1 3.99Å; Y91-I148 HydrophobicContact CG-CG1 3.82Å; I145-I148 VanDerWaalsContact O-CB 3.28Å; I145-I148 WeakPolarHBondContact O-CB 3.15Å; I145-I148 WeakPolarHBondContact O-CG1 3.34Å; I145-I148 PolarHBondContact O-N 2.9Å; P146-I148 PolarHBondContact O-N 3.38Å
149F95.6Very high94.5Very high105 Ų10551 Ų5146%0.46127%0.265SS..G310 helixtrans-90-2.2-177.1-54.6-69.2000113.8I145 P146 F147 V151 T161 L163 F169I145-F149 HydrophobicContact CG2-CE2 3.89Å; P146-F149 PolarHBondContact O-N 3.25Å; P146-F149 VanDerWaalsContact O-N 3.11Å; F147-F149 PolarHBondContact O-N 3.43Å; F147-F149 VanDerWaalsContact O-N 3.14Å; F149-V151 PolarHBondContact O-N 3.3Å; F149-T161 PolarHBondContact O-OG1 3.46Å; F149-L163 HydrophobicContact CB-CD2 4.14Å; F149-F169 HydrophobicContact CB-CZ 4.22Å
150T93.8Very high94.2Very high21 Ų2154.4 Ų54.413%0.12928%0.283CS..G310 helixtrans-75.4-14.4174.761.70000112.6F147 I160 T161 A164 F169 L173F147-T150 HydrophobicContact CD1-CG2 4.38Å; F147-T150 PolarHBondContact O-N 3.48Å; F147-T150 VanDerWaalsContact O-N 3.12Å; F147-T150 PolarHBondContact O-OG1 3.25Å; T150-I160 WeakPolarHBondContact O-CA 3.21Å; T150-T161 PolarHBondContact O-N 3.36Å; T150-T161 PolarHBondContact O-OG1 3.49Å; T150-A164 HydrophobicContact CG2-CB 4.45Å; T150-F169 HydrophobicContact CG2-CE1 3.93Å; T150-L173 HydrophobicContact CG2-CD1 3.56Å
151V94.5Very high93.9Very high9 Ų955.6 Ų55.66%0.05529%0.29CS..EExtended strand (participates in β ladder)trans-130.5150.2-176.4-62.30000111.7C84 R85 F149 N159C84-V151 VanDerWaalsContact O-CG2 3.28Å; C84-V151 WeakPolarHBondContact O-CG2 3.45Å; R85-V151 PolarHBondContact NH1-O 2.84Å; F149-V151 PolarHBondContact O-N 3.3Å; V151-N159 CarbonylContact C-O 3.57Å; V151-N159 VanDerWaalsContact CA-O 3.3Å; V151-N159 WeakPolarHBondContact CA-O 3.08Å
152K94.5Very high93.4Very high115 Ų11558.8 Ų58.850%0.531%0.308SS..EExtended strand (participates in β ladder)trans-137.2138.6176.1177.9-177.8174.3-165.10109.7N159 T161K152-N159 PolarHBondContact N-O 3.1Å; K152-N159 PolarHBondContact O-N 2.68Å; K152-T161 HydrophobicContact CB-CG2 3.55Å
153H93.2Very high93Very high26 Ų2657.5 Ų57.512%0.1230%0.301CS..EExtended strand (participates in β ladder)trans-78.6126.6169.7-176.8-114.8000109.6D77 V81 C84 T157D77-H153 IonicContact OD1-CE1 3.92Å; D77-H153 PolarHBondContact OD1-CE1 2.87Å; D77-H153 IonicContact OD1-ND1 2.66Å; V81-H153 HydrophobicContact CG2-CB 3.9Å; V81-H153 WeakPolarHBondContact CG2-ND1 3.24Å; C84-H153 HydrophobicContact CB-CB 4.34Å; H153-T157 WeakPolarHBondContact CA-O 2.95Å; H153-T157 PolarHBondContact CD2-O 3.28Å
154D91.4Very high92.4Very high76 Ų7658.2 Ų58.241%0.40631%0.308SS..EExtended strand (participates in β ladder)trans-144.7117.9176.9-172.123.1000109.8D156 T157D154-D156 PolarHBondContact O-N 3.43Å; D154-T157 PolarHBondContact N-O 3.44Å; D154-T157 PolarHBondContact O-N 2.91Å; D154-T157 PolarHBondContact O-OG1 3.36Å
155N87.4Confident91.9Very high136 Ų13666.4 Ų66.473%0.72734%0.34SS*.THydrogen-bonded Turntrans40.663.2177.3-59.9-38.3000113.7T157N155-T157 PolarHBondContact O-N 2.8Å; N155-T157 VanDerWaalsContact O-N 3.11Å
156D87.3Confident91.7Very high93 Ų9366.8 Ų66.850%0.49734%0.343SS..THydrogen-bonded Turntrans66.85.4179-55.8-43.9000116.1D154D154-D156 PolarHBondContact O-N 3.43Å
157T91.5Very high91.5Very high64 Ų6469.7 Ų69.739%0.39336%0.364SS..EExtended strand (participates in β ladder)trans-112.9153.117568.70000111.4H153 D154 N155 N159H153-T157 WeakPolarHBondContact CA-O 2.95Å; H153-T157 PolarHBondContact CD2-O 3.28Å; D154-T157 PolarHBondContact N-O 3.44Å; D154-T157 PolarHBondContact O-N 2.91Å; D154-T157 PolarHBondContact O-OG1 3.36Å; N155-T157 PolarHBondContact O-N 2.8Å; N155-T157 VanDerWaalsContact O-N 3.11Å; T157-N159 PolarHBondContact OG1-ND2 2.97Å
158C92.2Very high91.5Very high29 Ų2976.1 Ų76.120%0.19639%0.394CS..EExtended strand (participates in β ladder)trans-114.8104172.1-175.70000108.6I72 C84I72-C158 HydrophobicContact CD1-CB 3.26Å; C84-C158 WeakPolarHBondContact CA-SG 3.46Å; C84-C158 HydrophobicContact CB-CB 3.69Å; C84-C158 WeakPolarHBondContact CB-SG 3.22Å; C84-C158 WeakPolarHBondContact SG-CB 3.25Å; C84-C158 CovalentContact SG-SG 2.04Å; C84-C158 PolarHBondContact SG-SG 3.45Å
159N92.5Very high91.4Very high67 Ų6776.1 Ų76.136%0.35839%0.393SS..EExtended strand (participates in β ladder)trans-105.6150.8-173.6-62.9-33.6000110.3V151 K152 T157V151-N159 CarbonylContact C-O 3.57Å; V151-N159 VanDerWaalsContact CA-O 3.3Å; V151-N159 WeakPolarHBondContact CA-O 3.08Å; K152-N159 PolarHBondContact N-O 3.1Å; K152-N159 PolarHBondContact O-N 2.68Å; T157-N159 PolarHBondContact OG1-ND2 2.97Å
160I90.9Very high91.3Very high87 Ų8772.4 Ų72.445%0.44638%0.381SS..EExtended strand (participates in β ladder)trans-67.8132.5171.3-61.3174.1000108T150 A164 Y165T150-I160 WeakPolarHBondContact O-CA 3.21Å; I160-A164 HydrophobicContact CG2-CB 3.5Å; I160-Y165 HydrophobicContact CB-CE2 4.49Å; I160-Y165 HydrophobicContact CG2-CE2 3.85Å
161T91.5Very high91.3Very high27 Ų2774.4 Ų74.417%0.16639%0.391CS..  trans-78.3153.917956.50000112.1F149 T150 K152 L163 A164F149-T161 PolarHBondContact O-OG1 3.46Å; T150-T161 PolarHBondContact O-N 3.36Å; T150-T161 PolarHBondContact O-OG1 3.49Å; K152-T161 HydrophobicContact CB-CG2 3.55Å; T161-L163 PolarHBondContact O-N 2.97Å; T161-L163 VanDerWaalsContact O-N 3.11Å; T161-A164 VanDerWaalsContact O-CB 3.29Å; T161-A164 WeakPolarHBondContact O-CB 3.28Å; T161-A164 PolarHBondContact O-N 2.96Å
162D88.4Confident91.5Very high145 Ų14579 Ų7978%0.77541%0.411SS*.Hα-helixtrans-53.9-32.1170.6-60.3-31.6000113A164 Y165 D166D162-A164 PolarHBondContact O-N 3.43Å; D162-Y165 WeakPolarHBondContact O-CB 3.09Å; D162-Y165 PolarHBondContact O-N 3.29Å; D162-D166 PolarHBondContact O-N 3.04Å
163L89.1Confident91.5Very high79 Ų7974.3 Ų74.341%0.41439%0.391SS..Hα-helixtrans-58.6-31.6175.7-17562.9000112.4F149 T161 Y165 D166 F169F149-L163 HydrophobicContact CB-CD2 4.14Å; T161-L163 PolarHBondContact O-N 2.97Å; T161-L163 VanDerWaalsContact O-N 3.11Å; L163-Y165 PolarHBondContact O-N 3.38Å; L163-D166 HydrophobicContact CD1-CB 4.44Å; L163-D166 WeakPolarHBondContact O-CB 3.18Å; L163-D166 PolarHBondContact O-N 2.93Å; L163-F169 HydrophobicContact CD1-CB 3.87Å; L163-F169 HydrophobicContact CD1-CD1 4.32Å; L163-F169 HydrophobicContact CD1-CD2 4.05Å; L163-F169 HydrophobicContact CD1-CG 3.83Å; L163-F169 HydrophobicContact CD2-CD1 4.33Å; L163-F169 HydrophobicContact CD2-CD2 4.04Å; L163-F169 HydrophobicContact CD2-CE1 4.09Å; L163-F169 HydrophobicContact CD2-CE2 3.85Å; L163-F169 HydrophobicContact CD2-CG 4.26Å; L163-F169 HydrophobicContact CD2-CZ 3.86Å; L163-F169 HydrophobicContact CG-CB 4.18Å; L163-F169 HydrophobicContact CG-CD1 3.68Å; L163-F169 HydrophobicContact CG-CD2 3.93Å; L163-F169 HydrophobicContact CG-CE1 3.88Å; L163-F169 HydrophobicContact CG-CE2 4.18Å; L163-F169 HydrophobicContact CG-CG 3.66Å; L163-F169 HydrophobicContact CG-CZ 4.13Å; L163-F169 WeakPolarHBondContact O-CB 3.16Å; L163-F169 WeakPolarHBondContact O-CD1 3.28Å
164A86Confident91.6Very high25 Ų2574.5 Ų74.521%0.20739%0.394CS..Hα-helixtrans-69.4-22.8176.800000112.8T150 I160 T161 D162T150-A164 HydrophobicContact CG2-CB 4.45Å; I160-A164 HydrophobicContact CG2-CB 3.5Å; T161-A164 VanDerWaalsContact O-CB 3.29Å; T161-A164 WeakPolarHBondContact O-CB 3.28Å; T161-A164 PolarHBondContact O-N 2.96Å; D162-A164 PolarHBondContact O-N 3.43Å
165Y86.2Confident91.9Very high172 Ų17275 Ų7568%0.67539%0.392SS*.Hα-helixtrans-90.9-11.1174.6-62-73.1000112.8I160 D162 L163 S167I160-Y165 HydrophobicContact CB-CE2 4.49Å; I160-Y165 HydrophobicContact CG2-CE2 3.85Å; D162-Y165 WeakPolarHBondContact O-CB 3.09Å; D162-Y165 PolarHBondContact O-N 3.29Å; L163-Y165 PolarHBondContact O-N 3.38Å; Y165-S167 PolarHBondContact O-N 2.85Å
166D92.3Very high92.3Very high67 Ų6769.7 Ų69.736%0.35836%0.364SS..  trans-65.1123.4171.7177.571000110.3D162 L163 Q168 F169 A170D162-D166 PolarHBondContact O-N 3.04Å; L163-D166 HydrophobicContact CD1-CB 4.44Å; L163-D166 WeakPolarHBondContact O-CB 3.18Å; L163-D166 PolarHBondContact O-N 2.93Å; D166-Q168 VanDerWaalsContact C-N 3.27Å; D166-Q168 PolarHBondContact O-N 3.34Å; D166-Q168 WeakPolarHBondContact OD2-CA 3.12Å; D166-Q168 VanDerWaalsContact OD2-CB 3.32Å; D166-Q168 WeakPolarHBondContact OD2-CB 3.29Å; D166-Q168 PolarHBondContact OD2-N 3.24Å; D166-F169 HydrophobicContact CB-CB 4.15Å; D166-F169 PolarHBondContact O-N 2.94Å; D166-F169 PolarHBondContact OD2-N 3.15Å; D166-A170 WeakPolarHBondContact O-CB 3.21Å; D166-A170 PolarHBondContact O-N 3.5Å
167S91.6Very high92.8Very high77 Ų7765.3 Ų65.354%0.53834%0.341SS..Hα-helixtrans-60.7-34.6-176.164.10000113.1Y165 N171Y165-S167 PolarHBondContact O-N 2.85Å; S167-N171 VanDerWaalsContact O-CB 3.25Å; S167-N171 WeakPolarHBondContact O-CB 3.22Å; S167-N171 PolarHBondContact O-N 3.38Å; S167-N171 PolarHBondContact O-ND2 3.25Å
168Q95.1Very high93Very high150 Ų15064.3 Ų64.370%0.70133%0.331SS*.Hα-helixtrans-72.6-43.1-179.3-58-175.20.700110.6D166 N171 F172D166-Q168 VanDerWaalsContact C-N 3.27Å; D166-Q168 PolarHBondContact O-N 3.34Å; D166-Q168 WeakPolarHBondContact OD2-CA 3.12Å; D166-Q168 VanDerWaalsContact OD2-CB 3.32Å; D166-Q168 WeakPolarHBondContact OD2-CB 3.29Å; D166-Q168 PolarHBondContact OD2-N 3.24Å; Q168-N171 PolarHBondContact O-N 3.41Å; Q168-F172 WeakPolarHBondContact O-CB 3.2Å; Q168-F172 PolarHBondContact O-N 2.85Å
169F95Very high93.3Very high29 Ų2965.5 Ų65.513%0.12734%0.337CS..Hα-helixtrans-65.9-44.3176.2-174-106.1000112.1P146 F149 T150 L163 D166 N171 F172 L173P146-F169 HydrophobicContact CB-CE2 4.47Å; P146-F169 HydrophobicContact CB-CZ 4.47Å; P146-F169 WeakPolarHBondContact O-CZ 3.07Å; F149-F169 HydrophobicContact CB-CZ 4.22Å; T150-F169 HydrophobicContact CG2-CE1 3.93Å; L163-F169 HydrophobicContact CD1-CB 3.87Å; L163-F169 HydrophobicContact CD1-CD1 4.32Å; L163-F169 HydrophobicContact CD1-CD2 4.05Å; L163-F169 HydrophobicContact CD1-CG 3.83Å; L163-F169 HydrophobicContact CD2-CD1 4.33Å; L163-F169 HydrophobicContact CD2-CD2 4.04Å; L163-F169 HydrophobicContact CD2-CE1 4.09Å; L163-F169 HydrophobicContact CD2-CE2 3.85Å; L163-F169 HydrophobicContact CD2-CG 4.26Å; L163-F169 HydrophobicContact CD2-CZ 3.86Å; L163-F169 HydrophobicContact CG-CB 4.18Å; L163-F169 HydrophobicContact CG-CD1 3.68Å; L163-F169 HydrophobicContact CG-CD2 3.93Å; L163-F169 HydrophobicContact CG-CE1 3.88Å; L163-F169 HydrophobicContact CG-CE2 4.18Å; L163-F169 HydrophobicContact CG-CG 3.66Å; L163-F169 HydrophobicContact CG-CZ 4.13Å; L163-F169 WeakPolarHBondContact O-CB 3.16Å; L163-F169 WeakPolarHBondContact O-CD1 3.28Å; D166-F169 HydrophobicContact CB-CB 4.15Å; D166-F169 PolarHBondContact O-N 2.94Å; D166-F169 PolarHBondContact OD2-N 3.15Å; F169-N171 PolarHBondContact O-N 2.81Å; F169-F172 WeakPolarHBondContact O-CB 3.36Å; F169-F172 PolarHBondContact O-N 3.07Å; F169-L173 HydrophobicContact CD1-CD1 3.81Å; F169-L173 HydrophobicContact CD1-CG 4.18Å; F169-L173 HydrophobicContact CE1-CD1 3.46Å; F169-L173 VanDerWaalsContact CE1-CD1 3.46Å; F169-L173 HydrophobicContact CE1-CD2 4.34Å; F169-L173 HydrophobicContact CE1-CG 3.95Å; F169-L173 HydrophobicContact CZ-CD1 4.08Å; F169-L173 HydrophobicContact CZ-CD2 4.12Å; F169-L173 HydrophobicContact CZ-CG 4.16Å; F169-L173 WeakPolarHBondContact O-CG 3.19Å; F169-L173 PolarHBondContact O-N 3.41Å
170A92.5Very high93.5Very high26 Ų2666.1 Ų66.122%0.21534%0.337CS..Hα-helixtrans-59.7-45.817500000111.8D166 F172 L173 V174 L279D166-A170 WeakPolarHBondContact O-CB 3.21Å; D166-A170 PolarHBondContact O-N 3.5Å; A170-F172 VanDerWaalsContact C-N 3.35Å; A170-F172 PolarHBondContact O-N 3.35Å; A170-L173 PolarHBondContact O-N 2.98Å; A170-V174 WeakPolarHBondContact O-CG2 3.2Å; A170-V174 PolarHBondContact O-N 3.04Å; A170-L279 HydrophobicContact CB-CD1 4.43Å
171N95.1Very high93.8Very high63 Ų6362 Ų6234%0.33732%0.316SS..Hα-helixtrans-56.3-49.6172.9-78.1-32.5000111S167 Q168 F169 L173 V174 F175 L279S167-N171 VanDerWaalsContact O-CB 3.25Å; S167-N171 WeakPolarHBondContact O-CB 3.22Å; S167-N171 PolarHBondContact O-N 3.38Å; S167-N171 PolarHBondContact O-ND2 3.25Å; Q168-N171 PolarHBondContact O-N 3.41Å; F169-N171 PolarHBondContact O-N 2.81Å; N171-L173 PolarHBondContact O-N 2.84Å; N171-V174 PolarHBondContact O-N 2.99Å; N171-F175 HydrophobicContact CB-CD2 4.3Å; N171-F175 HydrophobicContact CB-CE2 4.43Å; N171-F175 WeakPolarHBondContact O-CB 3.33Å; N171-F175 WeakPolarHBondContact O-CD2 3.23Å; N171-F175 PolarHBondContact O-N 3.02Å; N171-L279 VanDerWaalsContact OD1-CD1 3.22Å; N171-L279 WeakPolarHBondContact OD1-CD1 3.28Å; N171-L279 VanDerWaalsContact OD1-CD2 3.29Å; N171-L279 WeakPolarHBondContact OD1-CD2 3.35Å; N171-L279 VanDerWaalsContact OD1-CG 3.29Å; N171-L279 WeakPolarHBondContact OD1-CG 3.48Å
172F97Very high94Very high107 Ų10762.4 Ų62.447%0.46931%0.314SS..Hα-helixtrans-58.3-46.9179.3173-106000111.7P146 Q168 F169 A170 V174 N176P146-F172 HydrophobicContact CB-CE1 4.02Å; P146-F172 HydrophobicContact CG-CE1 3.61Å; P146-F172 HydrophobicContact CG-CZ 4.33Å; Q168-F172 WeakPolarHBondContact O-CB 3.2Å; Q168-F172 PolarHBondContact O-N 2.85Å; F169-F172 WeakPolarHBondContact O-CB 3.36Å; F169-F172 PolarHBondContact O-N 3.07Å; A170-F172 VanDerWaalsContact C-N 3.35Å; A170-F172 PolarHBondContact O-N 3.35Å; F172-V174 PolarHBondContact O-N 3.4Å; F172-N176 HydrophobicContact CE2-CB 4.3Å; F172-N176 HydrophobicContact CZ-CB 4.38Å; F172-N176 WeakPolarHBondContact O-CB 3.45Å; F172-N176 PolarHBondContact O-N 3.38Å
173L95Very high94.5Very high15 Ų1558.4 Ų58.48%0.07929%0.292CS..Hα-helixtrans-57.8-50.3177.6-72.9179.7000112.4P146 F147 T150 F169 A170 N171 W177P146-L173 HydrophobicContact CB-CD2 3.29Å; P146-L173 HydrophobicContact CG-CD2 4.5Å; F147-L173 HydrophobicContact CD1-CD1 4.42Å; F147-L173 HydrophobicContact CD1-CD2 4.18Å; F147-L173 HydrophobicContact CE1-CB 4.34Å; F147-L173 HydrophobicContact CE1-CD1 4.25Å; F147-L173 HydrophobicContact CE1-CD2 4.06Å; F147-L173 HydrophobicContact CE1-CG 4.48Å; F147-L173 HydrophobicContact CG-CD2 4.44Å; F147-L173 HydrophobicContact CZ-CB 4.46Å; F147-L173 HydrophobicContact CZ-CD2 4.24Å; T150-L173 HydrophobicContact CG2-CD1 3.56Å; F169-L173 HydrophobicContact CD1-CD1 3.81Å; F169-L173 HydrophobicContact CD1-CG 4.18Å; F169-L173 HydrophobicContact CE1-CD1 3.46Å; F169-L173 VanDerWaalsContact CE1-CD1 3.46Å; F169-L173 HydrophobicContact CE1-CD2 4.34Å; F169-L173 HydrophobicContact CE1-CG 3.95Å; F169-L173 HydrophobicContact CZ-CD1 4.08Å; F169-L173 HydrophobicContact CZ-CD2 4.12Å; F169-L173 HydrophobicContact CZ-CG 4.16Å; F169-L173 WeakPolarHBondContact O-CG 3.19Å; F169-L173 PolarHBondContact O-N 3.41Å; A170-L173 PolarHBondContact O-N 2.98Å; N171-L173 PolarHBondContact O-N 2.84Å; L173-W177 VanDerWaalsContact O-CB 3.3Å; L173-W177 WeakPolarHBondContact O-CB 3.44Å; L173-W177 PolarHBondContact O-N 3.22Å
174V95.1Very high94.9Very high30 Ų3057.6 Ų57.618%0.18229%0.288CS..Hα-helixtrans-65.7-47.5-176.9173.90000110.7A170 N171 F172 F178 L276 L279A170-V174 WeakPolarHBondContact O-CG2 3.2Å; A170-V174 PolarHBondContact O-N 3.04Å; N171-V174 PolarHBondContact O-N 2.99Å; F172-V174 PolarHBondContact O-N 3.4Å; V174-F178 WeakPolarHBondContact O-CB 3.47Å; V174-F178 PolarHBondContact O-N 3.3Å; V174-L276 HydrophobicContact CG1-CD2 3.98Å; V174-L276 HydrophobicContact CG1-CG 4.41Å; V174-L279 HydrophobicContact CB-CD1 4.29Å; V174-L279 HydrophobicContact CB-CD2 4.05Å; V174-L279 HydrophobicContact CG1-CB 4.44Å; V174-L279 HydrophobicContact CG1-CD2 3.97Å; V174-L279 HydrophobicContact CG2-CD1 4Å
175F97.4Very high95.4Very high87 Ų8756.5 Ų56.538%0.38228%0.278SS..Hα-helixtrans-70.2-41.7-179.5-74.4-61.3000112.9N171 W177 F178 V179 L276 L279 F280N171-F175 HydrophobicContact CB-CD2 4.3Å; N171-F175 HydrophobicContact CB-CE2 4.43Å; N171-F175 WeakPolarHBondContact O-CB 3.33Å; N171-F175 WeakPolarHBondContact O-CD2 3.23Å; N171-F175 PolarHBondContact O-N 3.02Å; F175-W177 VanDerWaalsContact C-N 3.33Å; F175-W177 PolarHBondContact O-N 3.49Å; F175-F178 PolarHBondContact O-N 2.91Å; F175-V179 WeakPolarHBondContact O-CB 3.17Å; F175-V179 VanDerWaalsContact O-CG2 3.27Å; F175-V179 WeakPolarHBondContact O-CG2 3.42Å; F175-V179 PolarHBondContact O-N 3.11Å; F175-L276 HydrophobicContact CD1-CD2 4.41Å; F175-L276 HydrophobicContact CE1-CD2 3.92Å; F175-L279 HydrophobicContact CD2-CD2 4.23Å; F175-L279 HydrophobicContact CE2-CD2 3.64Å; F175-L279 HydrophobicContact CZ-CD2 3.93Å; F175-F280 HydrophobicContact CZ-CZ 4.18Å
176N97Very high95.9Very high24 Ų2448.6 Ų48.613%0.12825%0.249CC..Hα-helixtrans-57-49.2175.6177.765.2000110.5T143 F172 V179 F180T143-N176 PolarHBondContact O-ND2 3.33Å; F172-N176 HydrophobicContact CE2-CB 4.3Å; F172-N176 HydrophobicContact CZ-CB 4.38Å; F172-N176 WeakPolarHBondContact O-CB 3.45Å; F172-N176 PolarHBondContact O-N 3.38Å; N176-V179 PolarHBondContact O-N 2.87Å; N176-F180 WeakPolarHBondContact O-CD2 3.46Å; N176-F180 PolarHBondContact O-N 2.87Å; N176-F180 VanDerWaalsContact OD1-CD2 3.3Å; N176-F180 WeakPolarHBondContact OD1-CD2 3.27Å; N176-F180 WeakPolarHBondContact OD1-CE2 2.99Å
177W96.5Very high96.2Very high2 Ų249.2 Ų49.21%0.00825%0.254CS..Hα-helixtrans-65-45177.8-165.5-103.7000112.3K94 E97 L98 T143 P144 F147 L173 F175 V179 A181 Y271 H272K94-W177 HydrophobicContact CB-CH2 3.31Å; K94-W177 HydrophobicContact CB-CZ2 4.01Å; K94-W177 HydrophobicContact CB-CZ3 3.88Å; K94-W177 HydrophobicContact CD-CH2 4.05Å; K94-W177 HydrophobicContact CD-CZ2 4.25Å; K94-W177 HydrophobicContact CD-CZ3 4.25Å; K94-W177 HydrophobicContact CG-CH2 3.61Å; K94-W177 HydrophobicContact CG-CZ2 3.82Å; K94-W177 HydrophobicContact CG-CZ3 4.26Å; K94-W177 WeakPolarHBondContact O-CH2 3.31Å; E97-W177 HydrophobicContact CG-CZ2 4.48Å; L98-W177 HydrophobicContact CD2-CE3 4.33Å; L98-W177 HydrophobicContact CD2-CH2 3.05Å; L98-W177 HydrophobicContact CD2-CZ2 3.46Å; L98-W177 VanDerWaalsContact CD2-CZ2 3.46Å; L98-W177 HydrophobicContact CD2-CZ3 3.55Å; L98-W177 HydrophobicContact CG-CH2 3.84Å; L98-W177 HydrophobicContact CG-CZ3 3.97Å; T143-W177 HydrophobicContact CG2-CE3 4.05Å; T143-W177 HydrophobicContact CG2-CZ3 4.22Å; P144-W177 HydrophobicContact CB-CZ3 4.21Å; P144-W177 HydrophobicContact CG-CZ3 3.98Å; F147-W177 HydrophobicContact CE2-CD2 4.23Å; F147-W177 AromaticContact CE2-CE3 3.74Å; F147-W177 HydrophobicContact CE2-CE3 3.74Å; F147-W177 HydrophobicContact CE2-CZ3 4.24Å; F147-W177 HydrophobicContact CZ-CB 4.44Å; F147-W177 HydrophobicContact CZ-CE3 4.47Å; L173-W177 VanDerWaalsContact O-CB 3.3Å; L173-W177 WeakPolarHBondContact O-CB 3.44Å; L173-W177 PolarHBondContact O-N 3.22Å; F175-W177 VanDerWaalsContact C-N 3.33Å; F175-W177 PolarHBondContact O-N 3.49Å; W177-V179 VanDerWaalsContact C-N 3.3Å; W177-V179 PolarHBondContact O-N 2.89Å; W177-A181 HydrophobicContact CD2-CB 3.86Å; W177-A181 HydrophobicContact CE3-CB 4.4Å; W177-A181 HydrophobicContact CG-CB 4.15Å; W177-A181 HydrophobicContact CZ2-CB 4.06Å; W177-A181 WeakPolarHBondContact O-CA 3.29Å; W177-A181 WeakPolarHBondContact O-CB 3.38Å; W177-A181 PolarHBondContact O-N 3.5Å; W177-Y271 AromaticContact CD1-CE1 3.43Å; W177-Y271 VanDerWaalsContact CD1-CE1 3.43Å; W177-Y271 AromaticContact NE1-CE1 3.59Å; W177-H272 AromaticContact CD1-CE1 3.26Å; W177-H272 AromaticContact CD1-ND1 3.97Å; W177-H272 AromaticContact NE1-CE1 3.7Å
178F97.3Very high96.4Very high43 Ų4347.4 Ų47.419%0.18924%0.24CC..Iπ-helixtrans-58.3-41177.6179.3-122.2000112.8V174 F175 Y182 I183 H272 L276V174-F178 WeakPolarHBondContact O-CB 3.47Å; V174-F178 PolarHBondContact O-N 3.3Å; F175-F178 PolarHBondContact O-N 2.91Å; F178-Y182 AromaticContact CD2-CD1 3.88Å; F178-Y182 HydrophobicContact CD2-CD1 3.88Å; F178-Y182 AromaticContact CE2-CD1 3.5Å; F178-Y182 HydrophobicContact CE2-CD1 3.5Å; F178-Y182 AromaticContact CE2-CE1 3.94Å; F178-Y182 HydrophobicContact CE2-CE1 3.94Å; F178-Y182 HydrophobicContact CZ-CD1 4.42Å; F178-Y182 WeakPolarHBondContact O-CB 3.49Å; F178-Y182 PolarHBondContact O-N 3.49Å; F178-I183 HydrophobicContact CD1-CG1 3.97Å; F178-I183 HydrophobicContact CD2-CG1 4.28Å; F178-I183 HydrophobicContact CE1-CD1 3.95Å; F178-I183 HydrophobicContact CE1-CG1 3.59Å; F178-I183 HydrophobicContact CE2-CD1 3.99Å; F178-I183 HydrophobicContact CE2-CG1 3.95Å; F178-I183 HydrophobicContact CG-CG1 4.32Å; F178-I183 HydrophobicContact CZ-CD1 3.52Å; F178-I183 HydrophobicContact CZ-CG1 3.6Å; F178-I183 PolarHBondContact O-N 3.28Å; F178-H272 HydrophobicContact CD2-CB 3.74Å; F178-H272 AromaticContact CD2-CG 3.86Å; F178-H272 AromaticContact CD2-ND1 3.74Å; F178-H272 HydrophobicContact CE2-CB 4.04Å; F178-L276 HydrophobicContact CD1-CD1 4.34Å; F178-L276 HydrophobicContact CD2-CD1 4.07Å; F178-L276 HydrophobicContact CE1-CD1 4.09Å; F178-L276 HydrophobicContact CE2-CD1 3.79Å; F178-L276 HydrophobicContact CG-CD1 4.32Å; F178-L276 HydrophobicContact CZ-CD1 3.78Å
179V97.8Very high96.4Very high54 Ų5440.3 Ų40.333%0.32721%0.207SC..Iπ-helixtrans-71.4-54.4-179.61710000111.3F175 N176 W177 I183 I184F175-V179 WeakPolarHBondContact O-CB 3.17Å; F175-V179 VanDerWaalsContact O-CG2 3.27Å; F175-V179 WeakPolarHBondContact O-CG2 3.42Å; F175-V179 PolarHBondContact O-N 3.11Å; N176-V179 PolarHBondContact O-N 2.87Å; W177-V179 VanDerWaalsContact C-N 3.3Å; W177-V179 PolarHBondContact O-N 2.89Å; V179-I183 PolarHBondContact O-N 2.74Å; V179-I184 HydrophobicContact CG1-CD1 3.68Å; V179-I184 HydrophobicContact CG1-CG1 4.06Å; V179-I184 WeakPolarHBondContact O-CB 3.43Å; V179-I184 WeakPolarHBondContact O-CG1 3.31Å; V179-I184 PolarHBondContact O-N 3.12Å
180F97.1Very high96.4Very high80 Ų8043.3 Ų43.335%0.35122%0.224SC..Iπ-helixtrans-82.5-30.7-171-73.6-74.1000114.2T143 N176 I184 P185T143-F180 HydrophobicContact CG2-CB 3.72Å; T143-F180 HydrophobicContact CG2-CD2 4.4Å; T143-F180 HydrophobicContact CG2-CG 4.31Å; N176-F180 WeakPolarHBondContact O-CD2 3.46Å; N176-F180 PolarHBondContact O-N 2.87Å; N176-F180 VanDerWaalsContact OD1-CD2 3.3Å; N176-F180 WeakPolarHBondContact OD1-CD2 3.27Å; N176-F180 WeakPolarHBondContact OD1-CE2 2.99Å; F180-I184 HydrophobicContact CD1-CD1 3.9Å; F180-I184 HydrophobicContact CE1-CD1 4Å; F180-P185 WeakPolarHBondContact O-CD 3.34Å; F180-P185 WeakPolarHBondContact O-CG 3.36Å
181A96.3Very high96.5Very high0 Ų045.4 Ų45.40%023%0.234CC..Iπ-helixtrans-91.1-18179.800000113.1L98 W177L98-A181 HydrophobicContact CD1-CB 4.45Å; L98-A181 HydrophobicContact CD2-CB 3.55Å; W177-A181 HydrophobicContact CD2-CB 3.86Å; W177-A181 HydrophobicContact CE3-CB 4.4Å; W177-A181 HydrophobicContact CG-CB 4.15Å; W177-A181 HydrophobicContact CZ2-CB 4.06Å; W177-A181 WeakPolarHBondContact O-CA 3.29Å; W177-A181 WeakPolarHBondContact O-CB 3.38Å; W177-A181 PolarHBondContact O-N 3.5Å
182Y97.1Very high96.4Very high35 Ų3543.1 Ų43.114%0.13722%0.222CC..Iπ-helixtrans-133.9-59.4-173.7-178-104.4000115.4F178 S186 F264 H268 S269 H272F178-Y182 AromaticContact CD2-CD1 3.88Å; F178-Y182 HydrophobicContact CD2-CD1 3.88Å; F178-Y182 AromaticContact CE2-CD1 3.5Å; F178-Y182 HydrophobicContact CE2-CD1 3.5Å; F178-Y182 AromaticContact CE2-CE1 3.94Å; F178-Y182 HydrophobicContact CE2-CE1 3.94Å; F178-Y182 HydrophobicContact CZ-CD1 4.42Å; F178-Y182 WeakPolarHBondContact O-CB 3.49Å; F178-Y182 PolarHBondContact O-N 3.49Å; Y182-S186 WeakPolarHBondContact O-CB 3.24Å; Y182-S186 PolarHBondContact O-N 3.2Å; Y182-S186 PolarHBondContact O-OG 3Å; Y182-F264 HydrophobicContact CD2-CZ 4.31Å; Y182-H268 HydrophobicContact CD2-CB 3.97Å; Y182-H268 HydrophobicContact CE2-CB 4.29Å; Y182-S269 WeakPolarHBondContact OH-CB 3.38Å; Y182-H272 VanDerWaalsContact CB-CD2 3.43Å; Y182-H272 WeakPolarHBondContact CB-CD2 3.37Å; Y182-H272 VanDerWaalsContact CB-NE2 3.31Å; Y182-H272 WeakPolarHBondContact CB-NE2 3.32Å; Y182-H272 AromaticContact CD2-CD2 3.71Å; Y182-H272 AromaticContact CG-CD2 3.55Å; Y182-H272 AromaticContact CG-NE2 3.97Å
183I97.6Very high96Very high62 Ų6238.7 Ų38.732%0.31820%0.202SC..Iπ-helixtrans-64.3-53.3-173.8-68.7-63.6000111.6F178 V179 S186 V187F178-I183 HydrophobicContact CD1-CG1 3.97Å; F178-I183 HydrophobicContact CD2-CG1 4.28Å; F178-I183 HydrophobicContact CE1-CD1 3.95Å; F178-I183 HydrophobicContact CE1-CG1 3.59Å; F178-I183 HydrophobicContact CE2-CD1 3.99Å; F178-I183 HydrophobicContact CE2-CG1 3.95Å; F178-I183 HydrophobicContact CG-CG1 4.32Å; F178-I183 HydrophobicContact CZ-CD1 3.52Å; F178-I183 HydrophobicContact CZ-CG1 3.6Å; F178-I183 PolarHBondContact O-N 3.28Å; V179-I183 PolarHBondContact O-N 2.74Å; I183-S186 PolarHBondContact O-N 3.05Å; I183-V187 HydrophobicContact CG2-CG2 4.2Å; I183-V187 WeakPolarHBondContact O-CB 3.38Å; I183-V187 VanDerWaalsContact O-CG2 3.26Å; I183-V187 WeakPolarHBondContact O-CG2 3.44Å; I183-V187 PolarHBondContact O-N 3Å
184I97.3Very high95.8Very high61 Ų6141 Ų4131%0.31322%0.22SC..Hα-helixtrans-59.4-53.7-179.5-70171.2000110.5M105 V179 F180 S186 V187 V188M105-I184 HydrophobicContact SD-CG2 4.16Å; V179-I184 HydrophobicContact CG1-CD1 3.68Å; V179-I184 HydrophobicContact CG1-CG1 4.06Å; V179-I184 WeakPolarHBondContact O-CB 3.43Å; V179-I184 WeakPolarHBondContact O-CG1 3.31Å; V179-I184 PolarHBondContact O-N 3.12Å; F180-I184 HydrophobicContact CD1-CD1 3.9Å; F180-I184 HydrophobicContact CE1-CD1 4Å; I184-S186 PolarHBondContact O-N 3.38Å; I184-V187 PolarHBondContact O-N 3.19Å; I184-V188 HydrophobicContact CG2-CG2 4.34Å; I184-V188 WeakPolarHBondContact O-CB 3.49Å; I184-V188 VanDerWaalsContact O-CG2 3.22Å; I184-V188 WeakPolarHBondContact O-CG2 3.37Å; I184-V188 PolarHBondContact O-N 3.34Å
185P97.4Very high95.7Very high2 Ų247.4 Ų47.41%0.01324%0.241CC..Hα-helixtrans-54.9-49.9175.9-27.435.4000112.8V101 M105 F180 V187 V188 M189 F264V101-P185 HydrophobicContact CG1-CB 3.49Å; V101-P185 VanDerWaalsContact CG1-CB 3.49Å; V101-P185 HydrophobicContact CG1-CG 3.5Å; V101-P185 VanDerWaalsContact CG1-CG 3.5Å; M105-P185 HydrophobicContact CB-CB 4.41Å; F180-P185 WeakPolarHBondContact O-CD 3.34Å; F180-P185 WeakPolarHBondContact O-CG 3.36Å; P185-V187 PolarHBondContact O-N 3.03Å; P185-V188 PolarHBondContact O-N 3.07Å; P185-M189 HydrophobicContact CB-CE 3.8Å; P185-M189 WeakPolarHBondContact O-CB 3.39Å; P185-M189 WeakPolarHBondContact O-CE 3.47Å; P185-M189 WeakPolarHBondContact O-CG 3.29Å; P185-M189 PolarHBondContact O-N 2.74Å; P185-F264 HydrophobicContact CB-CE1 4.22Å; P185-F264 HydrophobicContact CB-CZ 4.07Å
186S96.8Very high95.3Very high7 Ų743.4 Ų43.45%0.04922%0.224CC..Hα-helixtrans-60.4-49.5-177.5-61.40000112.1Y182 I183 I184 V188 M189 I190 F264Y182-S186 WeakPolarHBondContact O-CB 3.24Å; Y182-S186 PolarHBondContact O-N 3.2Å; Y182-S186 PolarHBondContact O-OG 3Å; I183-S186 PolarHBondContact O-N 3.05Å; I184-S186 PolarHBondContact O-N 3.38Å; S186-V188 PolarHBondContact O-N 3.34Å; S186-M189 PolarHBondContact O-N 3.35Å; S186-I190 WeakPolarHBondContact O-CB 3.32Å; S186-I190 WeakPolarHBondContact O-CD1 3.42Å; S186-I190 WeakPolarHBondContact O-CG1 3.49Å; S186-I190 PolarHBondContact O-N 2.82Å; S186-F264 WeakPolarHBondContact OG-CE1 3.19Å
187V97.4Very high94.9Very high79 Ų7948.9 Ų48.948%0.47924%0.244SC..Hα-helixtrans-63.9-43.6-178.4171.10000110.7I183 I184 P185 T191I183-V187 HydrophobicContact CG2-CG2 4.2Å; I183-V187 WeakPolarHBondContact O-CB 3.38Å; I183-V187 VanDerWaalsContact O-CG2 3.26Å; I183-V187 WeakPolarHBondContact O-CG2 3.44Å; I183-V187 PolarHBondContact O-N 3Å; I184-V187 PolarHBondContact O-N 3.19Å; P185-V187 PolarHBondContact O-N 3.03Å; V187-T191 WeakPolarHBondContact O-CB 3.31Å; V187-T191 PolarHBondContact O-N 2.99Å; V187-T191 PolarHBondContact O-OG1 3.47Å
188V96.4Very high94.6Very high40 Ų4052.6 Ų52.624%0.24227%0.269CS..Hα-helixtrans-62.5-48.2177.4170.10000110.7M105 I109 I184 P185 S186 T191 C192M105-V188 HydrophobicContact CG-CB 3.87Å; M105-V188 HydrophobicContact CG-CG1 3.54Å; M105-V188 HydrophobicContact SD-CB 4.04Å; M105-V188 HydrophobicContact SD-CG1 4.08Å; M105-V188 HydrophobicContact SD-CG2 4.13Å; I109-V188 HydrophobicContact CD1-CG1 3.92Å; I109-V188 HydrophobicContact CG1-CG1 3.75Å; I184-V188 HydrophobicContact CG2-CG2 4.34Å; I184-V188 WeakPolarHBondContact O-CB 3.49Å; I184-V188 VanDerWaalsContact O-CG2 3.22Å; I184-V188 WeakPolarHBondContact O-CG2 3.37Å; I184-V188 PolarHBondContact O-N 3.34Å; P185-V188 PolarHBondContact O-N 3.07Å; S186-V188 PolarHBondContact O-N 3.34Å; V188-T191 PolarHBondContact O-N 3.34Å; V188-C192 VanDerWaalsContact O-CB 3.28Å; V188-C192 WeakPolarHBondContact O-CB 3.4Å; V188-C192 PolarHBondContact O-N 3.23Å; V188-C192 PolarHBondContact O-SG 2.88Å
189M95.1Very high94.2Very high0 Ų053 Ų530%027%0.272CS..Hα-helixtrans-60.6-53.3179.1-70.2-168.5-86.700111.4L104 M105 S108 P185 S186 T191 C192 Y193 C261 F264L104-M189 HydrophobicContact CD2-SD 3.99Å; L104-M189 HydrophobicContact CG-SD 3.79Å; M105-M189 HydrophobicContact CB-CG 4.44Å; S108-M189 VanDerWaalsContact OG-CG 3.28Å; S108-M189 WeakPolarHBondContact OG-CG 3.46Å; P185-M189 HydrophobicContact CB-CE 3.8Å; P185-M189 WeakPolarHBondContact O-CB 3.39Å; P185-M189 WeakPolarHBondContact O-CE 3.47Å; P185-M189 WeakPolarHBondContact O-CG 3.29Å; P185-M189 PolarHBondContact O-N 2.74Å; S186-M189 PolarHBondContact O-N 3.35Å; M189-T191 VanDerWaalsContact C-N 3.3Å; M189-T191 PolarHBondContact O-N 3.16Å; M189-C192 PolarHBondContact O-N 3.43Å; M189-Y193 HydrophobicContact CB-CD2 4.38Å; M189-Y193 HydrophobicContact CB-CE2 4.16Å; M189-Y193 WeakPolarHBondContact O-CD2 3.46Å; M189-Y193 PolarHBondContact O-N 3.26Å; M189-C261 HydrophobicContact CB-CB 4.4Å; M189-C261 HydrophobicContact SD-CB 4.05Å; M189-C261 PolarHBondContact SD-SG 3.13Å; M189-F264 HydrophobicContact CE-CD1 3.12Å; M189-F264 HydrophobicContact CE-CE1 3.17Å; M189-F264 HydrophobicContact CE-CG 3.9Å; M189-F264 HydrophobicContact CE-CZ 4.01Å; M189-F264 HydrophobicContact SD-CD1 4.4Å
190I94.8Very high93.7Very high93 Ų9351 Ų5148%0.47726%0.26SS..Hα-helixtrans-57.8-44.7-180-68.4166.4000110.7S186 S194S186-I190 WeakPolarHBondContact O-CB 3.32Å; S186-I190 WeakPolarHBondContact O-CD1 3.42Å; S186-I190 WeakPolarHBondContact O-CG1 3.49Å; S186-I190 PolarHBondContact O-N 2.82Å; I190-S194 VanDerWaalsContact O-CB 3.25Å; I190-S194 WeakPolarHBondContact O-CB 3.2Å; I190-S194 PolarHBondContact O-N 3.36Å; I190-S194 PolarHBondContact O-OG 3.44Å
191T94.8Very high93.3Very high70 Ų7053.1 Ų53.143%0.42927%0.269SS..Hα-helixtrans-65.3-49.7-180-58.60000111.3V187 V188 M189 Y193 S194 R195V187-T191 WeakPolarHBondContact O-CB 3.31Å; V187-T191 PolarHBondContact O-N 2.99Å; V187-T191 PolarHBondContact O-OG1 3.47Å; V188-T191 PolarHBondContact O-N 3.34Å; M189-T191 VanDerWaalsContact C-N 3.3Å; M189-T191 PolarHBondContact O-N 3.16Å; T191-Y193 VanDerWaalsContact C-N 3.32Å; T191-Y193 PolarHBondContact O-N 3.05Å; T191-S194 PolarHBondContact O-N 2.96Å; T191-R195 WeakPolarHBondContact O-CB 3.34Å; T191-R195 VanDerWaalsContact O-CG 3.23Å; T191-R195 WeakPolarHBondContact O-CG 3.41Å; T191-R195 PolarHBondContact O-N 3.35Å
192C93.3Very high92.9Very high14 Ų1459 Ų5910%0.09530%0.296CS..Hα-helixtrans-56.1-47.2178.4-72.90000111F112 V188 M189 R195 V196F112-C192 HydrophobicContact CB-CB 4.01Å; V188-C192 VanDerWaalsContact O-CB 3.28Å; V188-C192 WeakPolarHBondContact O-CB 3.4Å; V188-C192 PolarHBondContact O-N 3.23Å; V188-C192 PolarHBondContact O-SG 2.88Å; M189-C192 PolarHBondContact O-N 3.43Å; C192-R195 PolarHBondContact O-N 2.92Å; C192-V196 WeakPolarHBondContact O-CB 3.4Å; C192-V196 VanDerWaalsContact O-CG2 3.24Å; C192-V196 WeakPolarHBondContact O-CG2 3.4Å; C192-V196 PolarHBondContact O-N 2.96Å
193Y88.3Confident92.4Very high14 Ų1459.5 Ų59.56%0.05531%0.305CS..Hα-helixtrans-73.6-39.3-177.9-68.4-54.5000114.2S108 M189 T191 R195 V196 Y197 L254 I257 C261S108-Y193 WeakPolarHBondContact CA-OH 3.23Å; S108-Y193 VanDerWaalsContact CB-CZ 3.48Å; S108-Y193 WeakPolarHBondContact CB-OH 3.24Å; S108-Y193 PolarHBondContact N-OH 3.27Å; S108-Y193 WeakPolarHBondContact OG-CE2 3.17Å; S108-Y193 PolarHBondContact OG-OH 2.93Å; M189-Y193 HydrophobicContact CB-CD2 4.38Å; M189-Y193 HydrophobicContact CB-CE2 4.16Å; M189-Y193 WeakPolarHBondContact O-CD2 3.46Å; M189-Y193 PolarHBondContact O-N 3.26Å; T191-Y193 VanDerWaalsContact C-N 3.32Å; T191-Y193 PolarHBondContact O-N 3.05Å; Y193-R195 PolarHBondContact O-N 2.69Å; Y193-V196 PolarHBondContact O-N 3.19Å; Y193-Y197 WeakPolarHBondContact O-CB 3.36Å; Y193-Y197 PolarHBondContact O-N 3.37Å; Y193-L254 HydrophobicContact CD1-CD1 3.54Å; Y193-L254 HydrophobicContact CE1-CD1 4.12Å; Y193-I257 HydrophobicContact CE1-CB 4.07Å; Y193-I257 HydrophobicContact CE1-CD1 4.43Å; Y193-I257 HydrophobicContact CE1-CG2 4.27Å; Y193-I257 HydrophobicContact CE2-CG2 4.32Å; Y193-I257 WeakPolarHBondContact OH-CB 3.49Å; Y193-I257 WeakPolarHBondContact OH-CG2 3.45Å; Y193-C261 HydrophobicContact CD2-CB 4.38Å; Y193-C261 HydrophobicContact CE2-CB 4.08Å; Y193-C261 WeakPolarHBondContact CE2-SG 3.24Å
194S91.2Very high91.8Very high64 Ų6458.1 Ų58.145%0.44830%0.299SS..Hα-helixtrans-57.3-42.5174.8-600000110.1I190 T191 C198I190-S194 VanDerWaalsContact O-CB 3.25Å; I190-S194 WeakPolarHBondContact O-CB 3.2Å; I190-S194 PolarHBondContact O-N 3.36Å; I190-S194 PolarHBondContact O-OG 3.44Å; T191-S194 PolarHBondContact O-N 2.96Å; S194-C198 WeakPolarHBondContact O-CB 3.11Å; S194-C198 PolarHBondContact O-N 2.96Å; S194-C198 PolarHBondContact O-SG 3.32Å
195R92.1Very high91.4Very high164 Ų16459.1 Ų59.162%0.61931%0.308SS*.Hα-helixtrans-68.2-47.3176.6-65.3-66.1-176.6177.90.3112.6F112 T191 C192 Y193 Y197 C198 I199F112-R195 HydrophobicContact CD2-CB 4.05Å; F112-R195 HydrophobicContact CE2-CB 3.81Å; F112-R195 HydrophobicContact CE2-CG 4.4Å; T191-R195 WeakPolarHBondContact O-CB 3.34Å; T191-R195 VanDerWaalsContact O-CG 3.23Å; T191-R195 WeakPolarHBondContact O-CG 3.41Å; T191-R195 PolarHBondContact O-N 3.35Å; C192-R195 PolarHBondContact O-N 2.92Å; Y193-R195 PolarHBondContact O-N 2.69Å; R195-Y197 VanDerWaalsContact C-N 3.32Å; R195-Y197 PolarHBondContact O-N 3.22Å; R195-C198 PolarHBondContact O-N 3.38Å; R195-I199 VanDerWaalsContact O-CG1 3.3Å; R195-I199 WeakPolarHBondContact O-CG1 3.43Å; R195-I199 PolarHBondContact O-N 3.34Å
196V89.6Confident90.9Very high3 Ų363.9 Ų63.92%0.01833%0.33CS..Hα-helixtrans-59.1-44.5177.6168.90000111.2F112 V115 C192 Y193 I199 I200 L254F112-V196 HydrophobicContact CB-CG2 4.03Å; F112-V196 HydrophobicContact CD2-CG2 4.15Å; V115-V196 HydrophobicContact CB-CG2 4.46Å; V115-V196 HydrophobicContact CG2-CG1 4.14Å; C192-V196 WeakPolarHBondContact O-CB 3.4Å; C192-V196 VanDerWaalsContact O-CG2 3.24Å; C192-V196 WeakPolarHBondContact O-CG2 3.4Å; C192-V196 PolarHBondContact O-N 2.96Å; Y193-V196 PolarHBondContact O-N 3.19Å; V196-I199 PolarHBondContact O-N 2.91Å; V196-I200 HydrophobicContact CG1-CD1 3.53Å; V196-I200 HydrophobicContact CG1-CG1 4.48Å; V196-I200 WeakPolarHBondContact O-CD1 3.34Å; V196-I200 WeakPolarHBondContact O-CG1 3.26Å; V196-I200 PolarHBondContact O-N 3.49Å; V196-L254 HydrophobicContact CB-CD1 4.34Å; V196-L254 HydrophobicContact CG1-CD1 3.69Å; V196-L254 HydrophobicContact CG1-CD2 4.14Å; V196-L254 HydrophobicContact CG1-CG 4.5Å
197Y89Confident90.3Very high140 Ų14066.7 Ų66.755%0.54935%0.35SS..Hα-helixtrans-60.7-47.7177179.5-98.6000111.6Y193 R195 I199 I200 K201 L254Y193-Y197 WeakPolarHBondContact O-CB 3.36Å; Y193-Y197 PolarHBondContact O-N 3.37Å; R195-Y197 VanDerWaalsContact C-N 3.32Å; R195-Y197 PolarHBondContact O-N 3.22Å; Y197-I199 PolarHBondContact O-N 3.44Å; Y197-I200 PolarHBondContact O-N 2.88Å; Y197-K201 HydrophobicContact CE1-CD 4.31Å; Y197-K201 WeakPolarHBondContact O-CB 3.2Å; Y197-K201 PolarHBondContact O-N 2.9Å; Y197-L254 HydrophobicContact CD2-CD2 4.3Å
198C90.8Very high89.7Confident79 Ų7968.6 Ų68.653%0.53435%0.353SS..Hα-helixtrans-59.5-44.4176.8-74.10000112.4S194 R195 K201 H202S194-C198 WeakPolarHBondContact O-CB 3.11Å; S194-C198 PolarHBondContact O-N 2.96Å; S194-C198 PolarHBondContact O-SG 3.32Å; R195-C198 PolarHBondContact O-N 3.38Å; C198-K201 PolarHBondContact O-N 3.11Å; C198-H202 WeakPolarHBondContact O-CB 3.39Å; C198-H202 PolarHBondContact O-N 3.48Å
199I88.6Confident89.1Confident51 Ų5169.3 Ų69.326%0.26236%0.364SS..Hα-helixtrans-62.4-48.5178.3-67.5164.8000110.5V115 Y116 R195 V196 Y197 K201 H202 S203V115-I199 HydrophobicContact CG1-CB 4.22Å; V115-I199 HydrophobicContact CG1-CD1 4.45Å; V115-I199 HydrophobicContact CG1-CG2 3.72Å; Y116-I199 HydrophobicContact CD2-CD1 4.06Å; R195-I199 VanDerWaalsContact O-CG1 3.3Å; R195-I199 WeakPolarHBondContact O-CG1 3.43Å; R195-I199 PolarHBondContact O-N 3.34Å; V196-I199 PolarHBondContact O-N 2.91Å; Y197-I199 PolarHBondContact O-N 3.44Å; I199-K201 PolarHBondContact O-N 3.01Å; I199-H202 PolarHBondContact O-N 3.32Å; I199-S203 PolarHBondContact O-N 2.71Å; I199-S203 PolarHBondContact O-OG 3.21Å; I199-S203 VanDerWaalsContact O-OG 3.09Å
200I86.8Confident88.5Confident14 Ų1473.8 Ų73.87%0.07239%0.387CS..Hα-helixtrans-63.2-43.3-179.7-71.3161.1000111.1V196 Y197 H202 S203 V204 L247 V250 Q251 L254V196-I200 HydrophobicContact CG1-CD1 3.53Å; V196-I200 HydrophobicContact CG1-CG1 4.48Å; V196-I200 WeakPolarHBondContact O-CD1 3.34Å; V196-I200 WeakPolarHBondContact O-CG1 3.26Å; V196-I200 PolarHBondContact O-N 3.49Å; Y197-I200 PolarHBondContact O-N 2.88Å; I200-H202 VanDerWaalsContact C-N 3.34Å; I200-H202 PolarHBondContact O-N 3.49Å; I200-S203 PolarHBondContact O-N 3.42Å; I200-V204 HydrophobicContact CG2-CG2 4.33Å; I200-V204 WeakPolarHBondContact O-CG2 3.3Å; I200-V204 PolarHBondContact O-N 2.88Å; I200-L247 HydrophobicContact CG2-CD1 4.12Å; I200-V250 HydrophobicContact CD1-CG1 3.51Å; I200-V250 HydrophobicContact CG1-CG1 4.16Å; I200-Q251 HydrophobicContact CG2-CG 4.14Å; I200-L254 HydrophobicContact CD1-CD2 3.77Å
201K87.8Confident87.7Confident124 Ų12473.6 Ų73.654%0.53939%0.387SS..Hα-helixtrans-59.1-46.4176.6-176.6179.8176.3-176.30110.8Y197 C198 I199 V204 V205Y197-K201 HydrophobicContact CE1-CD 4.31Å; Y197-K201 WeakPolarHBondContact O-CB 3.2Å; Y197-K201 PolarHBondContact O-N 2.9Å; C198-K201 PolarHBondContact O-N 3.11Å; I199-K201 PolarHBondContact O-N 3.01Å; K201-V204 PolarHBondContact O-N 3.43Å; K201-V205 WeakPolarHBondContact O-CG2 3.47Å; K201-V205 PolarHBondContact O-N 2.89Å
202H88.2Confident86.7Confident122 Ų12274.4 Ų74.457%0.56540%0.396SS*.Hα-helixtrans-61.1-45.1177-174.7-87.7000111.9C198 I199 I200 V204 V205 Q206C198-H202 WeakPolarHBondContact O-CB 3.39Å; C198-H202 PolarHBondContact O-N 3.48Å; I199-H202 PolarHBondContact O-N 3.32Å; I200-H202 VanDerWaalsContact C-N 3.34Å; I200-H202 PolarHBondContact O-N 3.49Å; H202-V204 VanDerWaalsContact C-N 3.3Å; H202-V204 PolarHBondContact O-N 2.94Å; H202-V205 PolarHBondContact O-N 3.06Å; H202-Q206 WeakPolarHBondContact O-CB 3.46Å; H202-Q206 PolarHBondContact O-N 2.95Å
203S86.6Confident85.4Confident47 Ų4776.9 Ų76.933%0.32941%0.413SS..Hα-helixtrans-61.7-35.7176.9-59.10000113.1I199 I200 S207I199-S203 PolarHBondContact O-N 2.71Å; I199-S203 PolarHBondContact O-OG 3.21Å; I199-S203 VanDerWaalsContact O-OG 3.09Å; I200-S203 PolarHBondContact O-N 3.42Å; S203-S207 WeakPolarHBondContact O-CB 3.35Å; S203-S207 PolarHBondContact O-N 3.48Å; S203-S207 VanDerWaalsContact O-N 3.09Å; S203-S207 PolarHBondContact O-OG 3.1Å
204V86Confident84Confident33 Ų3379.4 Ų79.420%0.243%0.433CS..Hα-helixtrans-67.2-48.9175.7177.30000110.7I200 K201 H202 Q206 S207 Q208 L247I200-V204 HydrophobicContact CG2-CG2 4.33Å; I200-V204 WeakPolarHBondContact O-CG2 3.3Å; I200-V204 PolarHBondContact O-N 2.88Å; K201-V204 PolarHBondContact O-N 3.43Å; H202-V204 VanDerWaalsContact C-N 3.3Å; H202-V204 PolarHBondContact O-N 2.94Å; V204-Q206 PolarHBondContact O-N 3.37Å; V204-S207 PolarHBondContact O-N 3.33Å; V204-Q208 WeakPolarHBondContact O-CG 3.49Å; V204-Q208 PolarHBondContact O-N 2.78Å; V204-L247 HydrophobicContact CG2-CD1 4.25Å; V204-L247 HydrophobicContact CG2-CD2 3.8Å; V204-L247 HydrophobicContact CG2-CG 4.47Å
205V88.6Confident82.3Confident82 Ų8285.3 Ų85.350%0.49745%0.451SS..Hα-helixtrans-61.6-44.7-179.6172.40000110.8K201 H202 S207 Q208 A209K201-V205 WeakPolarHBondContact O-CG2 3.47Å; K201-V205 PolarHBondContact O-N 2.89Å; H202-V205 PolarHBondContact O-N 3.06Å; V205-S207 VanDerWaalsContact C-N 3.34Å; V205-S207 PolarHBondContact O-N 2.95Å; V205-Q208 PolarHBondContact O-N 3.43Å; V205-A209 PolarHBondContact O-N 2.91Å
206Q87.1Confident80.3Confident101 Ų10183.1 Ų83.147%0.47246%0.456SS..Hα-helixtrans-63.7-38.8177.9-169.8176.116.200112.3H202 V204 Q208 A209 N210H202-Q206 WeakPolarHBondContact O-CB 3.46Å; H202-Q206 PolarHBondContact O-N 2.95Å; V204-Q206 PolarHBondContact O-N 3.37Å; Q206-Q208 VanDerWaalsContact C-N 3.31Å; Q206-Q208 PolarHBondContact O-N 3.41Å; Q206-A209 PolarHBondContact O-N 3.15Å; Q206-N210 PolarHBondContact O-N 3.08Å; Q206-N210 VanDerWaalsContact O-N 3.1Å
207S83.7Confident78.5Confident66 Ų6689 Ų8946%0.46249%0.492SS..Hα-helixtrans-65.6-35176-59.30000112.2S203 V204 V205 N211S203-S207 WeakPolarHBondContact O-CB 3.35Å; S203-S207 PolarHBondContact O-N 3.48Å; S203-S207 VanDerWaalsContact O-N 3.09Å; S203-S207 PolarHBondContact O-OG 3.1Å; V204-S207 PolarHBondContact O-N 3.33Å; V205-S207 VanDerWaalsContact C-N 3.34Å; V205-S207 PolarHBondContact O-N 2.95Å; S207-N211 PolarHBondContact O-N 2.96Å; S207-N211 PolarHBondContact O-ND2 3.36Å
208Q84.5Confident76.5Confident120 Ų12091.6 Ų91.656%0.56151%0.509SS*.Hα-helixtrans-72-42.7175.9-71.7176.2-11.500111.8V204 V205 Q206 N210 N211 S212V204-Q208 WeakPolarHBondContact O-CG 3.49Å; V204-Q208 PolarHBondContact O-N 2.78Å; V205-Q208 PolarHBondContact O-N 3.43Å; Q206-Q208 VanDerWaalsContact C-N 3.31Å; Q206-Q208 PolarHBondContact O-N 3.41Å; Q208-N210 PolarHBondContact O-N 3.28Å; Q208-N211 PolarHBondContact O-N 3.21Å; Q208-S212 PolarHBondContact O-N 2.72Å; Q208-S212 VanDerWaalsContact O-N 3.17Å; Q208-S212 PolarHBondContact O-OG 3.31Å
209A84.7Confident74.2Confident55 Ų5593.5 Ų93.546%0.45552%0.522SS..Hα-helixtrans-61-43.7178.100000112.5V205 Q206 N211 S212 S213V205-A209 PolarHBondContact O-N 2.91Å; Q206-A209 PolarHBondContact O-N 3.15Å; A209-N211 VanDerWaalsContact C-N 3.27Å; A209-N211 PolarHBondContact O-N 2.83Å; A209-S212 PolarHBondContact O-N 2.79Å; A209-S213 PolarHBondContact O-N 3.24Å; A209-S213 VanDerWaalsContact O-N 3.12Å; A209-S213 PolarHBondContact O-OG 3.3Å
210N81.9Confident71.9Confident93 Ų9396.2 Ų96.250%0.49755%0.546SS..Hα-helixtrans-66.4-27.7178.3-71.4-5.4000113.4Q206 Q208 S213 S214Q206-N210 PolarHBondContact O-N 3.08Å; Q206-N210 VanDerWaalsContact O-N 3.1Å; Q208-N210 PolarHBondContact O-N 3.28Å; N210-S213 PolarHBondContact O-OG 3.26Å; N210-S214 PolarHBondContact O-OG 2.96Å; N210-S214 VanDerWaalsContact O-OG 3.06Å
211N77.4Confident69.6Low89 Ų89101.8 Ų101.848%0.47658%0.58SS.*Hα-helixtrans-74.9-36.9175.1-77.1-12.4000111.6S207 Q208 A209 S241S207-N211 PolarHBondContact O-N 2.96Å; S207-N211 PolarHBondContact O-ND2 3.36Å; Q208-N211 PolarHBondContact O-N 3.21Å; A209-N211 VanDerWaalsContact C-N 3.27Å; A209-N211 PolarHBondContact O-N 2.83Å; N211-S241 PolarHBondContact ND2-OG 3.42Å
212S74.9Confident67.4Low87 Ų87105.2 Ų105.261%0.60860%0.598SS**Hα-helixtrans-70.9-37.1177.7-60.30000112.9Q208 A209 S214 F215Q208-S212 PolarHBondContact O-N 2.72Å; Q208-S212 VanDerWaalsContact O-N 3.17Å; Q208-S212 PolarHBondContact O-OG 3.31Å; A209-S212 PolarHBondContact O-N 2.79Å; S212-S214 VanDerWaalsContact C-N 3.3Å; S212-S214 PolarHBondContact O-N 2.82Å; S212-F215 PolarHBondContact O-N 3.36Å
213S66.5Low65.1Low66 Ų66107.6 Ų107.646%0.46261%0.613SS.*Hα-helixtrans-71-23.4178.357.70000113.8A209 N210 F215A209-S213 PolarHBondContact O-N 3.24Å; A209-S213 VanDerWaalsContact O-N 3.12Å; A209-S213 PolarHBondContact O-OG 3.3Å; N210-S213 PolarHBondContact O-OG 3.26Å; S213-F215 PolarHBondContact O-N 3.47Å
214S58.6Low62.8Low67 Ų67108.5 Ų108.547%0.46963%0.63SS.*THydrogen-bonded Turntrans-72.1-9174.7-63.60000113.7N210 S212N210-S214 PolarHBondContact O-OG 2.96Å; N210-S214 VanDerWaalsContact O-OG 3.06Å; S212-S214 VanDerWaalsContact C-N 3.3Å; S212-S214 PolarHBondContact O-N 2.82Å
215F54Low60.7Low189 Ų189114 Ų11483%0.82966%0.658SS**THydrogen-bonded Turntrans-99.6-12.8-175.6-154-95.3000113.8S212 S213S212-F215 PolarHBondContact O-N 3.36Å; S213-F215 PolarHBondContact O-N 3.47Å
216T51.8Low58.2Low117 Ų117116 Ų11672%0.71867%0.67SS**SBendtrans-100.65.1-176.3290000115.3
217T51.1Low55.9Low126 Ų126115.9 Ų115.977%0.77368%0.681SS**THydrogen-bonded Turntrans-102.250.9175.8-36.90000112.6
218E47.4Very low53.5Low195 Ų195118.9 Ų118.991%0.91170%0.697SS**THydrogen-bonded Turntrans-134.817.9168.2-101-175.6-166.500114.2
219C42.7Very low51.2Low120 Ų120122.6 Ų122.681%0.81171%0.712SS**  trans-136.580.7169.4-167.90000111.6
220S40.4Very low48.7Very low108 Ų108124.4 Ų124.476%0.75572%0.721SS**  trans-16197.7152.9-78.10000108.6
221T38.5Very low46.4Very low130 Ų130128.4 Ų128.480%0.79874%0.736SS**  trans42.3111.5135.116.10000118.9
222Q41.2Very low44.4Very low197 Ų197131.4 Ų131.492%0.92175%0.751SS**  -165.3119.1115.7-106.4-178.44.700113
223I39.2Very low42.4Very low172 Ų172136.2 Ų136.288%0.88276%0.764SS**  trans-70.6123.5161.8-67.1162000106.6
224G39.4Very low40.7Very low65 Ų65138.1 Ų138.167%0.6777%0.774SS**  trans168.177.8176.500000116.4
225N41Very low39.6Very low148 Ų148140 Ų14079%0.79179%0.786SS**  trans47.7108.3137-60.3-3.9000121.5
226T35.8Very low38.6Very low124 Ų124136.5 Ų136.576%0.76178%0.781SS**  77.4125.3119.2-35.70000120.8
227S39.2Very low37.9Very low99 Ų99138.8 Ų138.869%0.69278%0.783SS**  trans81.2101.5151.751.90000120.7
228T33.3Very low37.2Very low129 Ų129140.7 Ų140.779%0.79178%0.78SS**  70.383.1121.4-27.70000118.2
229F37.2Very low36.7Very low199 Ų199136 Ų13687%0.87377%0.769SS**  trans-148.1117135.1-151.3-102.5000111
230S31.1Very low36.8Very low92 Ų92134.9 Ų134.964%0.64377%0.769SS**  trans-57.5130.1172.6-46.60000111.1
231Q34.5Very low37Very low177 Ų177133.2 Ų133.283%0.82776%0.757SS**  169.8138.3123.5-95.3176-13.200112.7
232L34.8Very low37.3Very low152 Ų152135.6 Ų135.680%0.79676%0.756SS**  trans78.682.8154.8-130.573.7000118.3T234L232-T234 PolarHBondContact O-N 2.99Å; L232-T234 VanDerWaalsContact O-N 3.13Å
233Q32.1Very low37.7Very low188 Ų188129.2 Ų129.288%0.87973%0.732SS**  trans-48.1108141.7-69.6172.2-22.200110.6
234T30.5Very low38.6Very low107 Ų107124.1 Ų124.166%0.65671%0.712SS**  trans-137.582.7137.839.80000107.3L232 T236L232-T234 PolarHBondContact O-N 2.99Å; L232-T234 VanDerWaalsContact O-N 3.13Å; T234-T236 PolarHBondContact O-N 2.79Å; T234-T236 PolarHBondContact O-OG1 2.93Å
235S35.9Very low40Very low105 Ų105126 Ų12673%0.73472%0.715SS**  trans-55.490.3158.337.30000107.5H237S235-H237 PolarHBondContact O-N 2.93Å
236T34.6Very low41.4Very low116 Ų116122.1 Ų122.171%0.71270%0.699SS**  trans-71.688.7171.3-430000104.9T234 K238T234-T236 PolarHBondContact O-N 2.79Å; T234-T236 PolarHBondContact O-OG1 2.93Å; T236-K238 PolarHBondContact O-N 3.32Å
237H36.2Very low43.4Very low166 Ų166117.8 Ų117.877%0.76967%0.671SS**  trans-52.393.6161-98.5-81.2000106.5S235 S239S235-H237 PolarHBondContact O-N 2.93Å; H237-S239 PolarHBondContact O-N 3.18Å
238K37Very low45.2Very low165 Ų165118.4 Ų118.472%0.71766%0.658SS**  trans-66.374.2164.9-78.8-176.4178.1176.40106.4T236 A240T236-K238 PolarHBondContact O-N 3.32Å; K238-A240 PolarHBondContact O-N 3.35Å
239S36.3Very low47.3Very low96 Ų96115.4 Ų115.467%0.67164%0.635SS**  trans-52.2125.5165-70.70000106.7H237 S241H237-S239 PolarHBondContact O-N 3.18Å; S239-S241 PolarHBondContact O-N 3.04Å
240A45.7Very low49.2Very low97 Ų97108.7 Ų108.780%0.80261%0.611SS**  trans-38.110717400000109.2K238 K242K238-A240 PolarHBondContact O-N 3.35Å; A240-K242 VanDerWaalsContact C-N 3.34Å; A240-K242 PolarHBondContact O-N 3.22Å
241S43.9Very low51.6Low74 Ų74108.3 Ų108.352%0.51760%0.598SS.*  trans-66.897.8-173.149.50000107.2N211 S239N211-S241 PolarHBondContact ND2-OG 3.42Å; S239-S241 PolarHBondContact O-N 3.04Å
242K44.4Very low53.9Low179 Ų179100.1 Ų100.178%0.77856%0.561SS**  trans-46.4130.7164-73.6177.4-179.9170.80105.8A240 S244A240-K242 VanDerWaalsContact C-N 3.34Å; A240-K242 PolarHBondContact O-N 3.22Å; K242-S244 PolarHBondContact O-N 3Å
243P49Very low56.1Low64 Ų6493.7 Ų93.742%0.41653%0.528SS..  trans-48.9126.3-178.817.3-30.3000108.1S245 L247P243-S245 PolarHBondContact O-N 2.96Å; P243-L247 HydrophobicContact CB-CD2 4.4Å
244S59.4Low58.5Low65 Ų6585.5 Ų85.546%0.45549%0.49SS..  trans-45.9134.3-172.255.60000109.2K242 S246 L247 R248K242-S244 PolarHBondContact O-N 3Å; S244-S246 PolarHBondContact O-N 3.48Å; S244-S246 PolarHBondContact OG-OG 3.38Å; S244-S246 VanDerWaalsContact OG-OG 3.1Å; S244-L247 PolarHBondContact O-N 3.05Å; S244-R248 PolarHBondContact O-N 3.49Å
245S68Low61.2Low104 Ų10484.9 Ų84.973%0.72748%0.482SS*.Hα-helixtrans-50.8-27.7-179.551.20000112.7P243 Q249P243-S245 PolarHBondContact O-N 2.96Å; S245-Q249 PolarHBondContact O-N 3.46Å
246S71Confident63.7Low66 Ų6679.9 Ų79.946%0.46245%0.447SS..Hα-helixtrans-63.1-46.2172.9560000113.3S244 R248 Q249 V250S244-S246 PolarHBondContact O-N 3.48Å; S244-S246 PolarHBondContact OG-OG 3.38Å; S244-S246 VanDerWaalsContact OG-OG 3.1Å; S246-R248 PolarHBondContact O-N 3.32Å; S246-Q249 WeakPolarHBondContact O-CB 3.31Å; S246-Q249 PolarHBondContact O-N 2.88Å; S246-Q249 VanDerWaalsContact O-N 3.16Å; S246-V250 WeakPolarHBondContact O-CG2 3.47Å; S246-V250 PolarHBondContact O-N 2.93Å
247L77.3Confident66Low34 Ų3474.4 Ų74.418%0.17841%0.413CS..Hα-helixtrans-63-43-179.6-177.764.9000111.6I200 V204 P243 S244 Q249 V250 Q251I200-L247 HydrophobicContact CG2-CD1 4.12Å; V204-L247 HydrophobicContact CG2-CD1 4.25Å; V204-L247 HydrophobicContact CG2-CD2 3.8Å; V204-L247 HydrophobicContact CG2-CG 4.47Å; P243-L247 HydrophobicContact CB-CD2 4.4Å; S244-L247 PolarHBondContact O-N 3.05Å; L247-Q249 VanDerWaalsContact C-N 3.29Å; L247-Q249 PolarHBondContact O-N 2.89Å; L247-V250 PolarHBondContact O-N 3.1Å; L247-Q251 WeakPolarHBondContact O-CG 3.33Å; L247-Q251 PolarHBondContact O-N 2.88Å
248R77.5Confident68.6Low112 Ų11269 Ų6942%0.42339%0.393SS..Hα-helixtrans-62.5-37.2175.3-71.4-175.5176.6-175.60.7112.2S244 S246 S252S244-R248 PolarHBondContact O-N 3.49Å; S246-R248 PolarHBondContact O-N 3.32Å; R248-S252 WeakPolarHBondContact O-CB 3.25Å; R248-S252 PolarHBondContact O-N 3.08Å
249Q75.9Confident71.2Confident65 Ų6565 Ų6530%0.30438%0.378SS..Hα-helixtrans-64.9-47.2175.1-176.6179-10.700110.8L39 S245 S246 L247 Q251 S252 V253L39-Q249 PolarHBondContact O-NE2 3.43Å; S245-Q249 PolarHBondContact O-N 3.46Å; S246-Q249 WeakPolarHBondContact O-CB 3.31Å; S246-Q249 PolarHBondContact O-N 2.88Å; S246-Q249 VanDerWaalsContact O-N 3.16Å; L247-Q249 VanDerWaalsContact C-N 3.29Å; L247-Q249 PolarHBondContact O-N 2.89Å; Q249-Q251 PolarHBondContact O-N 3.03Å; Q249-S252 PolarHBondContact O-N 3.25Å; Q249-S252 PolarHBondContact O-OG 3.16Å; Q249-V253 WeakPolarHBondContact O-CG2 3.37Å; Q249-V253 PolarHBondContact O-N 3.07Å
250V77.8Confident73.8Confident59 Ų5960.4 Ų60.436%0.35835%0.346SS..Hα-helixtrans-58.8-46.7177.4173.30000111.1I200 S246 L247 S252 V253 L254I200-V250 HydrophobicContact CD1-CG1 3.51Å; I200-V250 HydrophobicContact CG1-CG1 4.16Å; S246-V250 WeakPolarHBondContact O-CG2 3.47Å; S246-V250 PolarHBondContact O-N 2.93Å; L247-V250 PolarHBondContact O-N 3.1Å; V250-S252 VanDerWaalsContact C-N 3.32Å; V250-S252 PolarHBondContact O-N 3.39Å; V250-V253 PolarHBondContact O-N 2.85Å; V250-L254 WeakPolarHBondContact O-CB 3.06Å; V250-L254 PolarHBondContact O-N 3.38Å
251Q82.9Confident75.9Confident83 Ų8356.2 Ų56.239%0.38831%0.311SS..Hα-helixtrans-59.8-40.5176.1-73.5175.5-23.300112.6I200 L247 Q249 L254 L255I200-Q251 HydrophobicContact CG2-CG 4.14Å; L247-Q251 WeakPolarHBondContact O-CG 3.33Å; L247-Q251 PolarHBondContact O-N 2.88Å; Q249-Q251 PolarHBondContact O-N 3.03Å; Q251-L254 PolarHBondContact O-N 3.19Å; Q251-L255 PolarHBondContact O-N 3.33Å
252S82.6Confident78.3Confident6 Ų655.5 Ų55.54%0.04231%0.306CS..Hα-helixtrans-67.8-38.1179.876.90000113.1R248 Q249 V250 S256 S313 Q315R248-S252 WeakPolarHBondContact O-CB 3.25Å; R248-S252 PolarHBondContact O-N 3.08Å; Q249-S252 PolarHBondContact O-N 3.25Å; Q249-S252 PolarHBondContact O-OG 3.16Å; V250-S252 VanDerWaalsContact C-N 3.32Å; V250-S252 PolarHBondContact O-N 3.39Å; S252-S256 PolarHBondContact O-N 2.94Å; S252-S313 WeakPolarHBondContact CB-O 3.42Å; S252-Q315 PolarHBondContact OG-N 2.86Å
253V79.8Confident80.7Confident16 Ų1648.6 Ų48.610%0.09728%0.278CS..Hα-helixtrans-70-41.3175173.30000110F48 Q249 V250 L255 S256 I257F48-V253 HydrophobicContact CZ-CG1 4.47Å; Q249-V253 WeakPolarHBondContact O-CG2 3.37Å; Q249-V253 PolarHBondContact O-N 3.07Å; V250-V253 PolarHBondContact O-N 2.85Å; V253-L255 VanDerWaalsContact C-N 3.34Å; V253-L255 PolarHBondContact O-N 3.44Å; V253-S256 VanDerWaalsContact O-CB 3.31Å; V253-S256 WeakPolarHBondContact O-CB 3.31Å; V253-S256 PolarHBondContact O-N 2.94Å; V253-I257 HydrophobicContact CG1-CD1 3.79Å; V253-I257 HydrophobicContact CG1-CG1 4.47Å; V253-I257 VanDerWaalsContact O-CG1 3.31Å; V253-I257 WeakPolarHBondContact O-CG1 3.45Å; V253-I257 PolarHBondContact O-N 2.96Å
254L83.3Confident82.8Confident17 Ų1745.6 Ų45.69%0.08926%0.258CS..Hα-helixtrans-58.8-46.1175.5-177.463.1000111.4Y193 V196 Y197 I200 V250 Q251 S256 I257 T258Y193-L254 HydrophobicContact CD1-CD1 3.54Å; Y193-L254 HydrophobicContact CE1-CD1 4.12Å; V196-L254 HydrophobicContact CB-CD1 4.34Å; V196-L254 HydrophobicContact CG1-CD1 3.69Å; V196-L254 HydrophobicContact CG1-CD2 4.14Å; V196-L254 HydrophobicContact CG1-CG 4.5Å; Y197-L254 HydrophobicContact CD2-CD2 4.3Å; I200-L254 HydrophobicContact CD1-CD2 3.77Å; V250-L254 WeakPolarHBondContact O-CB 3.06Å; V250-L254 PolarHBondContact O-N 3.38Å; Q251-L254 PolarHBondContact O-N 3.19Å; L254-S256 VanDerWaalsContact C-N 3.34Å; L254-S256 PolarHBondContact O-N 2.88Å; L254-I257 PolarHBondContact O-N 2.86Å; L254-T258 WeakPolarHBondContact O-CB 3.48Å; L254-T258 PolarHBondContact O-N 3.34Å; L254-T258 PolarHBondContact O-OG1 2.97Å
255L88Confident84.5Confident94 Ų9444.2 Ų44.249%0.49225%0.247SC..Hα-helixtrans-56.8-46.8176.5178.164.8000111.8Q251 V253 I257 L259Q251-L255 PolarHBondContact O-N 3.33Å; V253-L255 VanDerWaalsContact C-N 3.34Å; V253-L255 PolarHBondContact O-N 3.44Å; L255-I257 VanDerWaalsContact C-N 3.3Å; L255-I257 PolarHBondContact O-N 3.4Å; L255-L259 HydrophobicContact CD1-CD1 4.13Å; L255-L259 HydrophobicContact CD1-CG 4.28Å; L255-L259 HydrophobicContact CG-CD1 4.14Å; L255-L259 VanDerWaalsContact O-CG 3.29Å; L255-L259 WeakPolarHBondContact O-CG 3.05Å; L255-L259 PolarHBondContact O-N 3Å; L255-L259 VanDerWaalsContact O-N 3.07Å
256S86.5Confident85.8Confident0 Ų045.1 Ų45.10%024%0.243CC..Hα-helixtrans-51-53.2176.7-170.60000111.3S252 V253 L254 L259 M260 I309 L310 S313S252-S256 PolarHBondContact O-N 2.94Å; V253-S256 VanDerWaalsContact O-CB 3.31Å; V253-S256 WeakPolarHBondContact O-CB 3.31Å; V253-S256 PolarHBondContact O-N 2.94Å; L254-S256 VanDerWaalsContact C-N 3.34Å; L254-S256 PolarHBondContact O-N 2.88Å; S256-L259 PolarHBondContact O-N 3.49Å; S256-M260 VanDerWaalsContact O-CG 3.31Å; S256-M260 WeakPolarHBondContact O-CG 3.47Å; S256-M260 PolarHBondContact O-N 3.4Å; S256-I309 WeakPolarHBondContact O-CG2 3.15Å; S256-L310 WeakPolarHBondContact OG-CA 3.4Å; S256-L310 WeakPolarHBondContact OG-CD1 3.47Å; S256-S313 WeakPolarHBondContact CA-OG 3.34Å; S256-S313 WeakPolarHBondContact CB-OG 3.5Å; S256-S313 PolarHBondContact OG-OG 3.45Å; S256-S313 VanDerWaalsContact OG-OG 3.12Å
257I84.5Confident86.9Confident0 Ų042.3 Ų42.30%022%0.223CC..Hα-helixtrans-81.6-32.8-167.5-41.1153.1000110.5F48 L104 I107 R111 Y193 V253 L254 L255 L259 M260 C261F48-I257 HydrophobicContact CE1-CG1 4.16Å; F48-I257 HydrophobicContact CZ-CD1 3.92Å; F48-I257 HydrophobicContact CZ-CG1 3.83Å; L104-I257 HydrophobicContact CD1-CG2 4.38Å; I107-I257 HydrophobicContact CG2-CD1 3.86Å; I107-I257 HydrophobicContact CG2-CG1 4.19Å; I107-I257 HydrophobicContact CG2-CG2 3.97Å; R111-I257 HydrophobicContact CG-CD1 3.44Å; R111-I257 VanDerWaalsContact CG-CD1 3.44Å; Y193-I257 HydrophobicContact CE1-CB 4.07Å; Y193-I257 HydrophobicContact CE1-CD1 4.43Å; Y193-I257 HydrophobicContact CE1-CG2 4.27Å; Y193-I257 HydrophobicContact CE2-CG2 4.32Å; Y193-I257 WeakPolarHBondContact OH-CB 3.49Å; Y193-I257 WeakPolarHBondContact OH-CG2 3.45Å; V253-I257 HydrophobicContact CG1-CD1 3.79Å; V253-I257 HydrophobicContact CG1-CG1 4.47Å; V253-I257 VanDerWaalsContact O-CG1 3.31Å; V253-I257 WeakPolarHBondContact O-CG1 3.45Å; V253-I257 PolarHBondContact O-N 2.96Å; L254-I257 PolarHBondContact O-N 2.86Å; L255-I257 VanDerWaalsContact C-N 3.3Å; L255-I257 PolarHBondContact O-N 3.4Å; I257-L259 PolarHBondContact O-N 3.47Å; I257-M260 PolarHBondContact O-N 3.36Å; I257-C261 WeakPolarHBondContact O-CB 3.36Å; I257-C261 PolarHBondContact O-N 2.87Å; I257-C261 PolarHBondContact O-SG 2.88Å
258T89.3Confident87.8Confident54 Ų5440.8 Ų40.833%0.33122%0.215SC..Hα-helixtrans-55.2-43.7168.5-60.20000111L254 C261 S262L254-T258 WeakPolarHBondContact O-CB 3.48Å; L254-T258 PolarHBondContact O-N 3.34Å; L254-T258 PolarHBondContact O-OG1 2.97Å; T258-C261 PolarHBondContact O-N 2.92Å; T258-S262 WeakPolarHBondContact O-CB 3.36Å; T258-S262 PolarHBondContact O-N 2.61Å; T258-S262 PolarHBondContact O-OG 3.06Å; T258-S262 VanDerWaalsContact O-OG 3.05Å
259L92.5Very high88.6Confident79 Ų7936.6 Ų36.641%0.41420%0.203SC..Hα-helixtrans-64.4-44.7175.8-70.3172.4000112.4L255 S256 I257 C261 S262 L263 I309L255-L259 HydrophobicContact CD1-CD1 4.13Å; L255-L259 HydrophobicContact CD1-CG 4.28Å; L255-L259 HydrophobicContact CG-CD1 4.14Å; L255-L259 VanDerWaalsContact O-CG 3.29Å; L255-L259 WeakPolarHBondContact O-CG 3.05Å; L255-L259 PolarHBondContact O-N 3Å; L255-L259 VanDerWaalsContact O-N 3.07Å; S256-L259 PolarHBondContact O-N 3.49Å; I257-L259 PolarHBondContact O-N 3.47Å; L259-C261 VanDerWaalsContact C-N 3.34Å; L259-C261 PolarHBondContact O-N 3.45Å; L259-S262 PolarHBondContact O-N 2.89Å; L259-L263 WeakPolarHBondContact O-CB 3.37Å; L259-L263 PolarHBondContact O-N 3.34Å; L259-I309 HydrophobicContact CB-CD1 4.3Å; L259-I309 HydrophobicContact CB-CG2 3.6Å; L259-I309 HydrophobicContact CD1-CG2 4.09Å
260M90.9Very high89.5Confident1 Ų136.9 Ų36.91%0.00520%0.202CC..Hα-helixtrans-60.4-42.4176-65.5169.372.800111.7Q51 L104 S256 I257 L263 F264 N306 I309Q51-M260 HydrophobicContact CG-CE 3.98Å; L104-M260 HydrophobicContact CD1-CB 4.22Å; L104-M260 HydrophobicContact CD1-CE 3.96Å; S256-M260 VanDerWaalsContact O-CG 3.31Å; S256-M260 WeakPolarHBondContact O-CG 3.47Å; S256-M260 PolarHBondContact O-N 3.4Å; I257-M260 PolarHBondContact O-N 3.36Å; M260-L263 PolarHBondContact O-N 3.4Å; M260-F264 WeakPolarHBondContact O-CB 3.16Å; M260-F264 PolarHBondContact O-N 2.93Å; M260-N306 HydrophobicContact CE-CB 3.84Å; M260-N306 WeakPolarHBondContact CG-OD1 3.3Å; M260-I309 HydrophobicContact CG-CB 4.3Å; M260-I309 HydrophobicContact CG-CD1 4.44Å; M260-I309 HydrophobicContact CG-CG2 3.86Å
261C90.7Very high90.2Very high8 Ų835.6 Ų35.65%0.05419%0.191CC..Hα-helixtrans-73.1-39-179.3-63.70000112.6M189 Y193 I257 T258 L259 L263 F264 V265M189-C261 HydrophobicContact CB-CB 4.4Å; M189-C261 HydrophobicContact SD-CB 4.05Å; M189-C261 PolarHBondContact SD-SG 3.13Å; Y193-C261 HydrophobicContact CD2-CB 4.38Å; Y193-C261 HydrophobicContact CE2-CB 4.08Å; Y193-C261 WeakPolarHBondContact CE2-SG 3.24Å; I257-C261 WeakPolarHBondContact O-CB 3.36Å; I257-C261 PolarHBondContact O-N 2.87Å; I257-C261 PolarHBondContact O-SG 2.88Å; T258-C261 PolarHBondContact O-N 2.92Å; L259-C261 VanDerWaalsContact C-N 3.34Å; L259-C261 PolarHBondContact O-N 3.45Å; C261-L263 VanDerWaalsContact C-N 3.28Å; C261-L263 PolarHBondContact O-N 3.41Å; C261-F264 PolarHBondContact O-N 2.97Å; C261-V265 WeakPolarHBondContact O-CG2 3.39Å; C261-V265 PolarHBondContact O-N 2.73Å
262S93Very high90.8Very high60 Ų6031.8 Ų31.842%0.4217%0.173SC..Hα-helixtrans-60.4-42.6171.4-67.30000110.9T258 L259 V265 L266T258-S262 WeakPolarHBondContact O-CB 3.36Å; T258-S262 PolarHBondContact O-N 2.61Å; T258-S262 PolarHBondContact O-OG 3.06Å; T258-S262 VanDerWaalsContact O-OG 3.05Å; L259-S262 PolarHBondContact O-N 2.89Å; S262-V265 PolarHBondContact O-N 3.15Å; S262-L266 WeakPolarHBondContact O-CB 3.25Å; S262-L266 VanDerWaalsContact O-CG 3.25Å; S262-L266 WeakPolarHBondContact O-CG 3.38Å; S262-L266 PolarHBondContact O-N 3.16Å
263L94.4Very high91.3Very high34 Ų3436 Ų3618%0.17819%0.194CC..Hα-helixtrans-64-42.5176.3-173.761000111.7L259 M260 C261 L266 S267 N302 L305 I309L259-L263 WeakPolarHBondContact O-CB 3.37Å; L259-L263 PolarHBondContact O-N 3.34Å; M260-L263 PolarHBondContact O-N 3.4Å; C261-L263 VanDerWaalsContact C-N 3.28Å; C261-L263 PolarHBondContact O-N 3.41Å; L263-L266 PolarHBondContact O-N 3.41Å; L263-S267 VanDerWaalsContact O-CB 3.24Å; L263-S267 WeakPolarHBondContact O-CB 3.42Å; L263-S267 PolarHBondContact O-N 3.4Å; L263-S267 PolarHBondContact O-OG 2.83Å; L263-N302 HydrophobicContact CD2-CB 4.39Å; L263-N302 HydrophobicContact CG-CB 4.17Å; L263-N302 VanDerWaalsContact CG-OD1 3.31Å; L263-N302 WeakPolarHBondContact CG-OD1 3.04Å; L263-L305 HydrophobicContact CD1-CD1 4.42Å; L263-L305 HydrophobicContact CD2-CB 3.63Å; L263-L305 HydrophobicContact CD2-CD1 3.87Å; L263-L305 HydrophobicContact CD2-CG 4.35Å; L263-I309 HydrophobicContact CD2-CD1 3.92Å
264F94.4Very high91.9Very high1 Ų135.9 Ų35.90%0.00419%0.192CC..Hα-helixtrans-56.9-54.2173.4162.4-95.8000111.9V101 L104 Y182 P185 S186 M189 M260 C261 L266 S267 H268 N302V101-F264 HydrophobicContact CB-CE2 4.1Å; V101-F264 HydrophobicContact CG1-CD2 4.4Å; V101-F264 HydrophobicContact CG1-CE2 3.5Å; V101-F264 HydrophobicContact CG1-CZ 3.59Å; V101-F264 HydrophobicContact CG2-CD2 4.02Å; V101-F264 HydrophobicContact CG2-CE2 3.43Å; V101-F264 VanDerWaalsContact CG2-CE2 3.43Å; V101-F264 HydrophobicContact CG2-CZ 4.34Å; L104-F264 HydrophobicContact CD2-CB 3.82Å; L104-F264 HydrophobicContact CD2-CG 4.16Å; Y182-F264 HydrophobicContact CD2-CZ 4.31Å; P185-F264 HydrophobicContact CB-CE1 4.22Å; P185-F264 HydrophobicContact CB-CZ 4.07Å; S186-F264 WeakPolarHBondContact OG-CE1 3.19Å; M189-F264 HydrophobicContact CE-CD1 3.12Å; M189-F264 HydrophobicContact CE-CE1 3.17Å; M189-F264 HydrophobicContact CE-CG 3.9Å; M189-F264 HydrophobicContact CE-CZ 4.01Å; M189-F264 HydrophobicContact SD-CD1 4.4Å; M260-F264 WeakPolarHBondContact O-CB 3.16Å; M260-F264 PolarHBondContact O-N 2.93Å; C261-F264 PolarHBondContact O-N 2.97Å; F264-L266 VanDerWaalsContact C-N 3.27Å; F264-L266 PolarHBondContact O-N 3.16Å; F264-S267 PolarHBondContact O-N 3.4Å; F264-S267 PolarHBondContact O-OG 3.24Å; F264-S267 VanDerWaalsContact O-OG 3.13Å; F264-H268 HydrophobicContact CD2-CB 4.41Å; F264-H268 AromaticContact CD2-CD2 3.24Å; F264-H268 WeakPolarHBondContact CD2-CD2 3.45Å; F264-H268 AromaticContact CD2-CG 3.78Å; F264-H268 AromaticContact CD2-NE2 3.54Å; F264-H268 HydrophobicContact CE2-CB 4.03Å; F264-H268 AromaticContact CE2-CD2 3.49Å; F264-H268 VanDerWaalsContact CE2-CD2 3.49Å; F264-H268 WeakPolarHBondContact CE2-CD2 3.47Å; F264-H268 AromaticContact CE2-CE1 3.94Å; F264-H268 AromaticContact CE2-CG 3.51Å; F264-H268 AromaticContact CE2-ND1 3.81Å; F264-H268 AromaticContact CE2-NE2 3.76Å; F264-H268 HydrophobicContact CZ-CB 4.46Å; F264-H268 WeakPolarHBondContact O-CB 3.49Å; F264-H268 PolarHBondContact O-CD2 3.3Å; F264-H268 PolarHBondContact O-N 2.89Å; F264-N302 PolarHBondContact N-OD1 2.77Å
265V94.9Very high92.3Very high35 Ų3535.4 Ų35.421%0.21219%0.19CC..Hα-helixtrans-58.1-44.9-177.3171.80000110C261 S262 S269C261-V265 WeakPolarHBondContact O-CG2 3.39Å; C261-V265 PolarHBondContact O-N 2.73Å; S262-V265 PolarHBondContact O-N 3.15Å; V265-S269 WeakPolarHBondContact O-CB 3.45Å; V265-S269 PolarHBondContact O-N 2.8Å; V265-S269 VanDerWaalsContact O-N 3.17Å; V265-S269 PolarHBondContact O-OG 2.85Å
266L95.1Very high92.7Very high123 Ų12332.4 Ų32.464%0.64417%0.174SC*.Hα-helixtrans-67.4-50.3-179.8-68.2172.3000112.2S262 L263 F264 S269S262-L266 WeakPolarHBondContact O-CB 3.25Å; S262-L266 VanDerWaalsContact O-CG 3.25Å; S262-L266 WeakPolarHBondContact O-CG 3.38Å; S262-L266 PolarHBondContact O-N 3.16Å; L263-L266 PolarHBondContact O-N 3.41Å; F264-L266 VanDerWaalsContact C-N 3.27Å; F264-L266 PolarHBondContact O-N 3.16Å; L266-S269 PolarHBondContact O-N 2.9Å; L266-S269 PolarHBondContact O-OG 3.2Å
267S94.7Very high93Very high8 Ų836 Ų366%0.05619%0.193CC..Hα-helixtrans-65.5-45.8-175.953.60000112.9L263 F264 F298 N302L263-S267 VanDerWaalsContact O-CB 3.24Å; L263-S267 WeakPolarHBondContact O-CB 3.42Å; L263-S267 PolarHBondContact O-N 3.4Å; L263-S267 PolarHBondContact O-OG 2.83Å; F264-S267 PolarHBondContact O-N 3.4Å; F264-S267 PolarHBondContact O-OG 3.24Å; F264-S267 VanDerWaalsContact O-OG 3.13Å; S267-F298 WeakPolarHBondContact CB-O 3.45Å; S267-N302 WeakPolarHBondContact OG-CB 3.06Å
268H94.6Very high93.3Very high1 Ų136.9 Ų36.91%0.00520%0.199CC..Hα-helixtrans-75.1-26.6-178.7-74.8-107.6000112.4E97 Y182 F264 Y270 Y271 H272E97-H268 IonicContact OE1-CE1 3.15Å; E97-H268 PolarHBondContact OE1-CE1 3.28Å; E97-H268 IonicContact OE1-ND1 2.61Å; E97-H268 PolarHBondContact OE1-ND1 3.35Å; Y182-H268 HydrophobicContact CD2-CB 3.97Å; Y182-H268 HydrophobicContact CE2-CB 4.29Å; F264-H268 HydrophobicContact CD2-CB 4.41Å; F264-H268 AromaticContact CD2-CD2 3.24Å; F264-H268 WeakPolarHBondContact CD2-CD2 3.45Å; F264-H268 AromaticContact CD2-CG 3.78Å; F264-H268 AromaticContact CD2-NE2 3.54Å; F264-H268 HydrophobicContact CE2-CB 4.03Å; F264-H268 AromaticContact CE2-CD2 3.49Å; F264-H268 VanDerWaalsContact CE2-CD2 3.49Å; F264-H268 WeakPolarHBondContact CE2-CD2 3.47Å; F264-H268 AromaticContact CE2-CE1 3.94Å; F264-H268 AromaticContact CE2-CG 3.51Å; F264-H268 AromaticContact CE2-ND1 3.81Å; F264-H268 AromaticContact CE2-NE2 3.76Å; F264-H268 HydrophobicContact CZ-CB 4.46Å; F264-H268 WeakPolarHBondContact O-CB 3.49Å; F264-H268 PolarHBondContact O-CD2 3.3Å; F264-H268 PolarHBondContact O-N 2.89Å; H268-Y270 PolarHBondContact O-N 3.12Å; H268-Y270 VanDerWaalsContact O-N 3.08Å; H268-Y271 PolarHBondContact O-N 3.3Å; H268-H272 PolarHBondContact O-CD2 3.34Å; H268-H272 PolarHBondContact O-N 2.94Å
269S95Very high93.4Very high25 Ų2536.3 Ų36.318%0.17519%0.194CC..Hα-helixtrans-53.8-34.9179.969.10000112.9Y182 V265 L266 Y271 H272 I273Y182-S269 WeakPolarHBondContact OH-CB 3.38Å; V265-S269 WeakPolarHBondContact O-CB 3.45Å; V265-S269 PolarHBondContact O-N 2.8Å; V265-S269 VanDerWaalsContact O-N 3.17Å; V265-S269 PolarHBondContact O-OG 2.85Å; L266-S269 PolarHBondContact O-N 2.9Å; L266-S269 PolarHBondContact O-OG 3.2Å; S269-Y271 PolarHBondContact O-N 3.13Å; S269-H272 PolarHBondContact O-N 3.13Å; S269-I273 WeakPolarHBondContact O-CB 3.49Å; S269-I273 WeakPolarHBondContact O-CG1 3.27Å; S269-I273 PolarHBondContact O-N 3.45Å
270Y94.7Very high93.5Very high70 Ų7039.5 Ų39.528%0.27521%0.205SC..Hα-helixtrans-59.1-49.6-179179-92.9000112.3H268 H272 Y274 Q291 L294 S295 F298H268-Y270 PolarHBondContact O-N 3.12Å; H268-Y270 VanDerWaalsContact O-N 3.08Å; Y270-H272 VanDerWaalsContact C-N 3.32Å; Y270-H272 PolarHBondContact O-N 3.39Å; Y270-Y274 VanDerWaalsContact O-CB 3.29Å; Y270-Y274 WeakPolarHBondContact O-CB 3.38Å; Y270-Y274 PolarHBondContact O-N 2.9Å; Y270-Q291 WeakPolarHBondContact CE1-O 3.4Å; Y270-Q291 WeakPolarHBondContact OH-CA 3.3Å; Y270-L294 HydrophobicContact CE1-CB 3.83Å; Y270-S295 WeakPolarHBondContact CD1-OG 3.39Å; Y270-S295 WeakPolarHBondContact CE1-OG 3.47Å; Y270-F298 AromaticContact CD1-CD2 3.86Å; Y270-F298 HydrophobicContact CD1-CD2 3.86Å; Y270-F298 HydrophobicContact CD1-CE2 4.05Å; Y270-F298 HydrophobicContact CD2-CD2 4.41Å; Y270-F298 AromaticContact CD2-CE2 3.96Å; Y270-F298 HydrophobicContact CD2-CE2 3.96Å; Y270-F298 HydrophobicContact CE1-CE2 4.45Å; Y270-F298 HydrophobicContact CE2-CE2 4.34Å; Y270-F298 AromaticContact CG-CD2 3.79Å; Y270-F298 HydrophobicContact CG-CD2 3.79Å; Y270-F298 AromaticContact CG-CE2 3.8Å; Y270-F298 HydrophobicContact CG-CE2 3.8Å
271Y92.8Very high93.5Very high32 Ų3242.5 Ų42.513%0.12524%0.236CC..Hα-helixtrans-59.9-44.1178.3176.7-99.3000111.8W177 H268 S269 Y274 S275W177-Y271 AromaticContact CD1-CE1 3.43Å; W177-Y271 VanDerWaalsContact CD1-CE1 3.43Å; W177-Y271 AromaticContact NE1-CE1 3.59Å; H268-Y271 PolarHBondContact O-N 3.3Å; S269-Y271 PolarHBondContact O-N 3.13Å; Y271-Y274 PolarHBondContact O-N 3.25Å; Y271-S275 WeakPolarHBondContact CE1-OG 3.45Å; Y271-S275 WeakPolarHBondContact O-CB 3.35Å; Y271-S275 PolarHBondContact O-N 3.15Å; Y271-S275 PolarHBondContact O-OG 3.44Å
272H94.6Very high93.6Very high3 Ų345.4 Ų45.41%0.01426%0.26CS..Hα-helixtrans-72.5-40.3-175.2-70.7-70000112.5W177 F178 Y182 H268 S269 Y270 S275 L276W177-H272 AromaticContact CD1-CE1 3.26Å; W177-H272 AromaticContact CD1-ND1 3.97Å; W177-H272 AromaticContact NE1-CE1 3.7Å; F178-H272 HydrophobicContact CD2-CB 3.74Å; F178-H272 AromaticContact CD2-CG 3.86Å; F178-H272 AromaticContact CD2-ND1 3.74Å; F178-H272 HydrophobicContact CE2-CB 4.04Å; Y182-H272 VanDerWaalsContact CB-CD2 3.43Å; Y182-H272 WeakPolarHBondContact CB-CD2 3.37Å; Y182-H272 VanDerWaalsContact CB-NE2 3.31Å; Y182-H272 WeakPolarHBondContact CB-NE2 3.32Å; Y182-H272 AromaticContact CD2-CD2 3.71Å; Y182-H272 AromaticContact CG-CD2 3.55Å; Y182-H272 AromaticContact CG-NE2 3.97Å; H268-H272 PolarHBondContact O-CD2 3.34Å; H268-H272 PolarHBondContact O-N 2.94Å; S269-H272 PolarHBondContact O-N 3.13Å; Y270-H272 VanDerWaalsContact C-N 3.32Å; Y270-H272 PolarHBondContact O-N 3.39Å; H272-S275 PolarHBondContact O-N 3.17Å; H272-L276 WeakPolarHBondContact O-CB 3.48Å; H272-L276 VanDerWaalsContact O-CG 3.28Å; H272-L276 WeakPolarHBondContact O-CG 3.28Å; H272-L276 PolarHBondContact O-N 2.65Å
273I94.6Very high93.4Very high95 Ų9545.6 Ų45.649%0.48726%0.256SS..Hα-helixtrans-62.3-46.6172.8-68166.1000109.7S269 S275 L276 L277S269-I273 WeakPolarHBondContact O-CB 3.49Å; S269-I273 WeakPolarHBondContact O-CG1 3.27Å; S269-I273 PolarHBondContact O-N 3.45Å; I273-S275 PolarHBondContact O-N 3.45Å; I273-L276 PolarHBondContact O-N 2.85Å; I273-L277 HydrophobicContact CG2-CD1 3.75Å; I273-L277 HydrophobicContact CG2-CG 4.2Å; I273-L277 WeakPolarHBondContact O-CB 3.39Å; I273-L277 VanDerWaalsContact O-CG 3.26Å; I273-L277 WeakPolarHBondContact O-CG 3.31Å; I273-L277 PolarHBondContact O-N 3.3Å
274Y92.3Very high92.9Very high14 Ų1450.9 Ų50.96%0.05528%0.28CS..Hα-helixtrans-57.8-48.2176.4176.2-105.1000111.8Y270 Y271 L276 L277 S278 I283 E284 Y285 Q286 Q291Y270-Y274 VanDerWaalsContact O-CB 3.29Å; Y270-Y274 WeakPolarHBondContact O-CB 3.38Å; Y270-Y274 PolarHBondContact O-N 2.9Å; Y271-Y274 PolarHBondContact O-N 3.25Å; Y274-L276 PolarHBondContact O-N 3.45Å; Y274-L277 PolarHBondContact O-N 3.07Å; Y274-S278 WeakPolarHBondContact O-CB 3.43Å; Y274-S278 PolarHBondContact O-N 3.49Å; Y274-I283 HydrophobicContact CD2-CD1 3.26Å; Y274-I283 HydrophobicContact CD2-CG1 4.46Å; Y274-I283 HydrophobicContact CE2-CD1 3.47Å; Y274-I283 VanDerWaalsContact CE2-CD1 3.47Å; Y274-I283 HydrophobicContact CE2-CG1 4.31Å; Y274-I283 HydrophobicContact CG-CD1 4.2Å; Y274-E284 PolarHBondContact OH-O 3.3Å; Y274-Y285 AromaticContact CE1-CD2 3.86Å; Y274-Y285 HydrophobicContact CE1-CD2 3.86Å; Y274-Y285 AromaticContact CE1-CE2 3.94Å; Y274-Y285 HydrophobicContact CE1-CE2 3.94Å; Y274-Q286 PolarHBondContact OH-N 3.41Å; Y274-Q291 HydrophobicContact CD2-CB 3.92Å; Y274-Q291 HydrophobicContact CD2-CG 4.2Å; Y274-Q291 HydrophobicContact CE1-CB 4.32Å; Y274-Q291 HydrophobicContact CE2-CB 3.57Å; Y274-Q291 HydrophobicContact CE2-CG 3.78Å; Y274-Q291 HydrophobicContact CG-CB 4.48Å
275S92Very high92.1Very high6 Ų655.7 Ų55.74%0.04230%0.299CS..Hα-helixtrans-64.1-41.3-179.5-57.60000112.4Y271 H272 I273 S278 L279Y271-S275 WeakPolarHBondContact CE1-OG 3.45Å; Y271-S275 WeakPolarHBondContact O-CB 3.35Å; Y271-S275 PolarHBondContact O-N 3.15Å; Y271-S275 PolarHBondContact O-OG 3.44Å; H272-S275 PolarHBondContact O-N 3.17Å; I273-S275 PolarHBondContact O-N 3.45Å; S275-S278 PolarHBondContact O-N 2.87Å; S275-L279 WeakPolarHBondContact O-CB 3.37Å; S275-L279 PolarHBondContact O-N 2.95Å
276L94.8Very high91.2Very high31 Ų3158.1 Ų58.116%0.16231%0.308CS..Hα-helixtrans-68.5-47.1177.5-74.4168.6000112.1V174 F175 F178 H272 I273 Y274 S278 L279 F280V174-L276 HydrophobicContact CG1-CD2 3.98Å; V174-L276 HydrophobicContact CG1-CG 4.41Å; F175-L276 HydrophobicContact CD1-CD2 4.41Å; F175-L276 HydrophobicContact CE1-CD2 3.92Å; F178-L276 HydrophobicContact CD1-CD1 4.34Å; F178-L276 HydrophobicContact CD2-CD1 4.07Å; F178-L276 HydrophobicContact CE1-CD1 4.09Å; F178-L276 HydrophobicContact CE2-CD1 3.79Å; F178-L276 HydrophobicContact CG-CD1 4.32Å; F178-L276 HydrophobicContact CZ-CD1 3.78Å; H272-L276 WeakPolarHBondContact O-CB 3.48Å; H272-L276 VanDerWaalsContact O-CG 3.28Å; H272-L276 WeakPolarHBondContact O-CG 3.28Å; H272-L276 PolarHBondContact O-N 2.65Å; I273-L276 PolarHBondContact O-N 2.85Å; Y274-L276 PolarHBondContact O-N 3.45Å; L276-S278 PolarHBondContact O-N 3.4Å; L276-L279 WeakPolarHBondContact O-CB 3.46Å; L276-L279 PolarHBondContact O-N 3.4Å; L276-L279 VanDerWaalsContact O-N 3.17Å; L276-F280 HydrophobicContact CD2-CE2 4.3Å; L276-F280 WeakPolarHBondContact O-CD2 3.44Å; L276-F280 PolarHBondContact O-N 2.84Å
277L94.3Very high89.9Confident77 Ų7754.1 Ų54.140%0.40329%0.292SS..Hα-helixtrans-57.8-37.3176.2-74.1175.9000111.1I273 Y274 G281 A282 I283I273-L277 HydrophobicContact CG2-CD1 3.75Å; I273-L277 HydrophobicContact CG2-CG 4.2Å; I273-L277 WeakPolarHBondContact O-CB 3.39Å; I273-L277 VanDerWaalsContact O-CG 3.26Å; I273-L277 WeakPolarHBondContact O-CG 3.31Å; I273-L277 PolarHBondContact O-N 3.3Å; Y274-L277 PolarHBondContact O-N 3.07Å; L277-G281 PolarHBondContact O-N 3.46Å; L277-A282 HydrophobicContact CB-CB 4.27Å; L277-A282 HydrophobicContact CD2-CB 4.04Å; L277-A282 WeakPolarHBondContact O-CB 3.35Å; L277-A282 PolarHBondContact O-N 2.92Å; L277-I283 HydrophobicContact CB-CD1 3.69Å; L277-I283 HydrophobicContact CB-CG1 3.86Å; L277-I283 HydrophobicContact CD1-CD1 4.36Å
278S90.9Very high88.6Confident17 Ų1758.6 Ų58.612%0.11931%0.314CS..Hα-helixtrans-71.3-40.7177.5-1640000113.3Y274 S275 L276 F280 G281 I283 Y285Y274-S278 WeakPolarHBondContact O-CB 3.43Å; Y274-S278 PolarHBondContact O-N 3.49Å; S275-S278 PolarHBondContact O-N 2.87Å; L276-S278 PolarHBondContact O-N 3.4Å; S278-F280 PolarHBondContact O-N 3.24Å; S278-G281 PolarHBondContact O-N 3.4Å; S278-I283 VanDerWaalsContact CA-O 3.24Å; S278-I283 WeakPolarHBondContact CA-O 3.28Å; S278-I283 PolarHBondContact OG-O 2.99Å; S278-Y285 VanDerWaalsContact OG-CA 3.28Å; S278-Y285 WeakPolarHBondContact OG-CA 3.35Å; S278-Y285 WeakPolarHBondContact OG-CB 3.37Å; S278-Y285 PolarHBondContact OG-N 2.84Å
279L91.5Very high87.7Confident42 Ų4258.6 Ų58.622%0.2232%0.315CS..Hα-helixtrans-58.4-37.9174.3-168.575.2000112.4A170 N171 V174 F175 S275 L276 G281A170-L279 HydrophobicContact CB-CD1 4.43Å; N171-L279 VanDerWaalsContact OD1-CD1 3.22Å; N171-L279 WeakPolarHBondContact OD1-CD1 3.28Å; N171-L279 VanDerWaalsContact OD1-CD2 3.29Å; N171-L279 WeakPolarHBondContact OD1-CD2 3.35Å; N171-L279 VanDerWaalsContact OD1-CG 3.29Å; N171-L279 WeakPolarHBondContact OD1-CG 3.48Å; V174-L279 HydrophobicContact CB-CD1 4.29Å; V174-L279 HydrophobicContact CB-CD2 4.05Å; V174-L279 HydrophobicContact CG1-CB 4.44Å; V174-L279 HydrophobicContact CG1-CD2 3.97Å; V174-L279 HydrophobicContact CG2-CD1 4Å; F175-L279 HydrophobicContact CD2-CD2 4.23Å; F175-L279 HydrophobicContact CE2-CD2 3.64Å; F175-L279 HydrophobicContact CZ-CD2 3.93Å; S275-L279 WeakPolarHBondContact O-CB 3.37Å; S275-L279 PolarHBondContact O-N 2.95Å; L276-L279 WeakPolarHBondContact O-CB 3.46Å; L276-L279 PolarHBondContact O-N 3.4Å; L276-L279 VanDerWaalsContact O-N 3.17Å; L279-G281 VanDerWaalsContact C-N 3.25Å; L279-G281 PolarHBondContact O-N 3.47Å
280F94.1Very high87Confident147 Ų14760.1 Ų60.165%0.64532%0.32SS*.THydrogen-bonded Turntrans-84.27.4176.8-66.8-62.3000114F175 L276 S278 A282F175-F280 HydrophobicContact CZ-CZ 4.18Å; L276-F280 HydrophobicContact CD2-CE2 4.3Å; L276-F280 WeakPolarHBondContact O-CD2 3.44Å; L276-F280 PolarHBondContact O-N 2.84Å; S278-F280 PolarHBondContact O-N 3.24Å; F280-A282 PolarHBondContact O-N 2.91Å
281G90.3Very high86.4Confident64 Ų6460.5 Ų60.566%0.6633%0.325SS*.THydrogen-bonded Turntrans70.713.8177.200000114.8L277 S278 L279 I283L277-G281 PolarHBondContact O-N 3.46Å; S278-G281 PolarHBondContact O-N 3.4Å; L279-G281 VanDerWaalsContact C-N 3.25Å; L279-G281 PolarHBondContact O-N 3.47Å; G281-I283 VanDerWaalsContact C-N 3.31Å
282A92.8Very high85.8Confident68 Ų6862 Ų6256%0.56233%0.33SS*.SBendtrans-73.9-26.1175.900000112.1L277 F280L277-A282 HydrophobicContact CB-CB 4.27Å; L277-A282 HydrophobicContact CD2-CB 4.04Å; L277-A282 WeakPolarHBondContact O-CB 3.35Å; L277-A282 PolarHBondContact O-N 2.92Å; F280-A282 PolarHBondContact O-N 2.91Å
283I89.3Confident85.4Confident64 Ų6464.7 Ų64.733%0.32834%0.34SS..SBendtrans-144.3150.2176.361.5-175.9000110.7Y274 L277 S278 G281Y274-I283 HydrophobicContact CD2-CD1 3.26Å; Y274-I283 HydrophobicContact CD2-CG1 4.46Å; Y274-I283 HydrophobicContact CE2-CD1 3.47Å; Y274-I283 VanDerWaalsContact CE2-CD1 3.47Å; Y274-I283 HydrophobicContact CE2-CG1 4.31Å; Y274-I283 HydrophobicContact CG-CD1 4.2Å; L277-I283 HydrophobicContact CB-CD1 3.69Å; L277-I283 HydrophobicContact CB-CG1 3.86Å; L277-I283 HydrophobicContact CD1-CD1 4.36Å; S278-I283 VanDerWaalsContact CA-O 3.24Å; S278-I283 WeakPolarHBondContact CA-O 3.28Å; S278-I283 PolarHBondContact OG-O 2.99Å; G281-I283 VanDerWaalsContact C-N 3.31Å
284E84.3Confident85.1Confident145 Ų14562.4 Ų62.468%0.67833%0.329SS*.  trans-75.3131.8176.5-168.7-177-161.300111.4Y274 Q286Y274-E284 PolarHBondContact OH-O 3.3Å; E284-Q286 HydrophobicContact CG-CG 4.36Å; E284-Q286 PolarHBondContact O-N 3.17Å; E284-Q286 PolarHBondContact OE2-NE2 2.98Å
285Y77.5Confident85Confident103 Ų10362 Ų6240%0.40433%0.328SS..  trans-77.9118.2172.7-170.7-100.4000108.8Y274 S278 A287Y274-Y285 AromaticContact CE1-CD2 3.86Å; Y274-Y285 HydrophobicContact CE1-CD2 3.86Å; Y274-Y285 AromaticContact CE1-CE2 3.94Å; Y274-Y285 HydrophobicContact CE1-CE2 3.94Å; S278-Y285 VanDerWaalsContact OG-CA 3.28Å; S278-Y285 WeakPolarHBondContact OG-CA 3.35Å; S278-Y285 WeakPolarHBondContact OG-CB 3.37Å; S278-Y285 PolarHBondContact OG-N 2.84Å; Y285-A287 HydrophobicContact CE1-CB 4.46Å
286Q75.7Confident84.9Confident86 Ų8664.3 Ų64.340%0.40234%0.342SS..  trans-118.2117176-73.5-179.47.400109.3Y274 E284 I288 S289Y274-Q286 PolarHBondContact OH-N 3.41Å; E284-Q286 HydrophobicContact CG-CG 4.36Å; E284-Q286 PolarHBondContact O-N 3.17Å; E284-Q286 PolarHBondContact OE2-NE2 2.98Å; Q286-I288 VanDerWaalsContact C-N 3.25Å; Q286-I288 PolarHBondContact O-N 3.21Å; Q286-S289 WeakPolarHBondContact O-CB 3.43Å; Q286-S289 PolarHBondContact O-OG 3.02Å
287A66.5Low84.8Confident39 Ų3964.6 Ų64.632%0.32234%0.342SS..THydrogen-bonded Turntrans-63.4-31-17800000112.7Y285 R292Y285-A287 HydrophobicContact CE1-CB 4.46Å; A287-R292 VanDerWaalsContact O-CD 3.24Å; A287-R292 WeakPolarHBondContact O-CD 3.06Å; A287-R292 PolarHBondContact O-NE 3.37Å; A287-R292 PolarHBondContact O-NH1 3.48Å; A287-R292 VanDerWaalsContact O-NH1 3.16Å
288I69.1Low84.8Confident101 Ų10164.2 Ų64.252%0.51834%0.337SS..THydrogen-bonded Turntrans-112.767.2176.9-49.1174.4000108.3Q286Q286-I288 VanDerWaalsContact C-N 3.25Å; Q286-I288 PolarHBondContact O-N 3.21Å
289S74.3Confident84.8Confident2 Ų264.3 Ų64.31%0.01434%0.337CS..  trans-121.3153.6-175.966.70000113.2Q286 Q291 R292 R293Q286-S289 WeakPolarHBondContact O-CB 3.43Å; Q286-S289 PolarHBondContact O-OG 3.02Å; S289-Q291 PolarHBondContact O-N 3.12Å; S289-R292 PolarHBondContact O-N 3.16Å; S289-R292 WeakPolarHBondContact OG-CB 3.41Å; S289-R292 PolarHBondContact OG-N 3.19Å; S289-R293 PolarHBondContact O-N 2.55Å
290L80.5Confident84.9Confident56 Ų5662.5 Ų62.529%0.29333%0.327SS..Hα-helixtrans-60-37.1172179.962.9000110.7I8 Y12 R293 L294I8-L290 HydrophobicContact CG2-CD1 4.34Å; Y12-L290 HydrophobicContact CD2-CD1 4.39Å; L290-R293 CarbonylContact O-C 3.57Å; L290-R293 WeakPolarHBondContact O-CB 2.98Å; L290-R293 PolarHBondContact O-N 3.28Å; L290-L294 HydrophobicContact CD1-CG 4.44Å; L290-L294 HydrophobicContact CG-CD1 4.17Å; L290-L294 HydrophobicContact CG-CG 4.33Å; L290-L294 WeakPolarHBondContact O-CG 3.22Å; L290-L294 PolarHBondContact O-N 3.31Å
291Q81.9Confident84.9Confident79 Ų7957.8 Ų57.837%0.36931%0.308SS..Hα-helixtrans-58.6-51.3178.9-65.683.2-17.700110.4Y270 Y274 S289 R293 L294 S295Y270-Q291 WeakPolarHBondContact CE1-O 3.4Å; Y270-Q291 WeakPolarHBondContact OH-CA 3.3Å; Y274-Q291 HydrophobicContact CD2-CB 3.92Å; Y274-Q291 HydrophobicContact CD2-CG 4.2Å; Y274-Q291 HydrophobicContact CE1-CB 4.32Å; Y274-Q291 HydrophobicContact CE2-CB 3.57Å; Y274-Q291 HydrophobicContact CE2-CG 3.78Å; Y274-Q291 HydrophobicContact CG-CB 4.48Å; S289-Q291 PolarHBondContact O-N 3.12Å; Q291-R293 VanDerWaalsContact C-N 3.28Å; Q291-R293 PolarHBondContact O-N 2.95Å; Q291-L294 WeakPolarHBondContact O-CB 3.27Å; Q291-L294 PolarHBondContact O-N 3.35Å; Q291-L294 VanDerWaalsContact O-N 3.12Å; Q291-S295 PolarHBondContact O-N 2.9Å; Q291-S295 PolarHBondContact O-OG 3.33Å
292R79.6Confident85.1Confident63 Ų6354.7 Ų54.724%0.23828%0.277CS..Hα-helixtrans-61.1-38.2177-174.7-179.5131.4160.44.7112.5E90 A287 S289 S295 V296E90-R292 IonicContact OE1-CZ 3.37Å; E90-R292 IonicContact OE1-NE 2.86Å; E90-R292 IonicContact OE1-NH1 3.84Å; E90-R292 PolarHBondContact OE1-NH1 2.94Å; E90-R292 IonicContact OE1-NH2 3.97Å; E90-R292 PolarHBondContact OE1-NH2 3.43Å; E90-R292 IonicContact OE2-CZ 3.02Å; E90-R292 IonicContact OE2-NH2 3.72Å; A287-R292 VanDerWaalsContact O-CD 3.24Å; A287-R292 WeakPolarHBondContact O-CD 3.06Å; A287-R292 PolarHBondContact O-NE 3.37Å; A287-R292 PolarHBondContact O-NH1 3.48Å; A287-R292 VanDerWaalsContact O-NH1 3.16Å; S289-R292 PolarHBondContact O-N 3.16Å; S289-R292 WeakPolarHBondContact OG-CB 3.41Å; S289-R292 PolarHBondContact OG-N 3.19Å; R292-S295 VanDerWaalsContact O-CB 3.3Å; R292-S295 WeakPolarHBondContact O-CB 3.43Å; R292-S295 PolarHBondContact O-N 3.4Å; R292-V296 PolarHBondContact O-N 2.69Å
293R86.4Confident85.2Confident59 Ų5951.5 Ų51.522%0.22325%0.25CS..Hα-helixtrans-66.8-35.1175.6-79.1-168.8-175.8-121.512.6113I8 Y12 Y13 S289 L290 Q291 S295 V296 F297I8-R293 VanDerWaalsContact CD1-CD 3.4Å; Y12-R293 HydrophobicContact CE1-CB 4.08Å; Y12-R293 HydrophobicContact CE1-CG 4.43Å; Y12-R293 HydrophobicContact CE2-CB 4.21Å; Y12-R293 WeakPolarHBondContact OH-CB 3.38Å; Y12-R293 PolarHBondContact OH-O 2.89Å; Y13-R293 VanDerWaalsContact CE1-NH1 3.31Å; Y13-R293 PolarHBondContact OH-NH1 2.88Å; Y13-R293 PolarHBondContact OH-NH2 3.33Å; S289-R293 PolarHBondContact O-N 2.55Å; L290-R293 CarbonylContact O-C 3.57Å; L290-R293 WeakPolarHBondContact O-CB 2.98Å; L290-R293 PolarHBondContact O-N 3.28Å; Q291-R293 VanDerWaalsContact C-N 3.28Å; Q291-R293 PolarHBondContact O-N 2.95Å; R293-S295 VanDerWaalsContact C-N 3.33Å; R293-V296 PolarHBondContact O-N 2.94Å; R293-F297 WeakPolarHBondContact O-CB 3.34Å; R293-F297 PolarHBondContact O-N 3.11Å
294L89.9Confident85.4Confident48 Ų4848.8 Ų48.825%0.25124%0.237SC..Hα-helixtrans-65.7-37172.3-73.5171.5000111.6Y12 Y270 L290 Q291 F297 F298Y12-L294 HydrophobicContact CE2-CD2 4.45Å; Y270-L294 HydrophobicContact CE1-CB 3.83Å; L290-L294 HydrophobicContact CD1-CG 4.44Å; L290-L294 HydrophobicContact CG-CD1 4.17Å; L290-L294 HydrophobicContact CG-CG 4.33Å; L290-L294 WeakPolarHBondContact O-CG 3.22Å; L290-L294 PolarHBondContact O-N 3.31Å; Q291-L294 WeakPolarHBondContact O-CB 3.27Å; Q291-L294 PolarHBondContact O-N 3.35Å; Q291-L294 VanDerWaalsContact O-N 3.12Å; L294-F297 WeakPolarHBondContact O-CB 3.12Å; L294-F297 PolarHBondContact O-N 3.07Å; L294-F298 HydrophobicContact CB-CE2 4.27Å; L294-F298 WeakPolarHBondContact O-CD2 3.27Å; L294-F298 WeakPolarHBondContact O-CG 3.41Å; L294-F298 PolarHBondContact O-N 3.44Å
295S89Confident85.9Confident4 Ų445.1 Ų45.13%0.02822%0.222CC..Hα-helixtrans-57.7-51.4173.2-55.70000112.1Y270 Q291 R292 R293 F297 F298 T299Y270-S295 WeakPolarHBondContact CD1-OG 3.39Å; Y270-S295 WeakPolarHBondContact CE1-OG 3.47Å; Q291-S295 PolarHBondContact O-N 2.9Å; Q291-S295 PolarHBondContact O-OG 3.33Å; R292-S295 VanDerWaalsContact O-CB 3.3Å; R292-S295 WeakPolarHBondContact O-CB 3.43Å; R292-S295 PolarHBondContact O-N 3.4Å; R293-S295 VanDerWaalsContact C-N 3.33Å; S295-F297 VanDerWaalsContact C-N 3.31Å; S295-F297 PolarHBondContact O-N 3.06Å; S295-F298 PolarHBondContact O-N 3.05Å; S295-T299 PolarHBondContact O-N 3.42Å; S295-T299 VanDerWaalsContact O-N 3.12Å; S295-T299 PolarHBondContact O-OG1 3.11Å
296V89.7Confident86.6Confident56 Ų5640.3 Ų40.334%0.33920%0.203SC..Hα-helixtrans-59.4-45.1176.5177.50000110.5A62 R292 R293 F298 T299 V300A62-V296 HydrophobicContact CB-CG1 4.29Å; R292-V296 PolarHBondContact O-N 2.69Å; R293-V296 PolarHBondContact O-N 2.94Å; V296-F298 PolarHBondContact O-N 3.04Å; V296-T299 PolarHBondContact O-N 2.88Å; V296-V300 HydrophobicContact CG1-CG2 4.33Å; V296-V300 WeakPolarHBondContact O-CG2 3.36Å; V296-V300 PolarHBondContact O-N 3.35Å
297F92.6Very high87.2Confident37 Ų3736.3 Ų36.316%0.16218%0.184CC..Hα-helixtrans-58.1-44178.8178.1-107.2000112.8Y12 F15 A16 A19 R293 L294 S295 V300 I301Y12-F297 HydrophobicContact CE2-CB 4.04Å; Y12-F297 HydrophobicContact CE2-CG 4.3Å; F15-F297 HydrophobicContact CB-CE2 4.49Å; A16-F297 HydrophobicContact CB-CD2 4.11Å; A19-F297 HydrophobicContact CB-CE2 4.13Å; R293-F297 WeakPolarHBondContact O-CB 3.34Å; R293-F297 PolarHBondContact O-N 3.11Å; L294-F297 WeakPolarHBondContact O-CB 3.12Å; L294-F297 PolarHBondContact O-N 3.07Å; S295-F297 VanDerWaalsContact C-N 3.31Å; S295-F297 PolarHBondContact O-N 3.06Å; F297-V300 PolarHBondContact O-N 3.33Å; F297-I301 HydrophobicContact CD1-CD1 3.83Å; F297-I301 HydrophobicContact CE1-CD1 3.29Å; F297-I301 HydrophobicContact CE1-CG1 4.29Å; F297-I301 HydrophobicContact CE2-CD1 4.22Å; F297-I301 HydrophobicContact CE2-CG1 4.46Å; F297-I301 HydrophobicContact CZ-CD1 3.53Å; F297-I301 HydrophobicContact CZ-CG1 4.22Å; F297-I301 WeakPolarHBondContact O-CG1 3.39Å; F297-I301 PolarHBondContact O-N 3.3Å
298F94.1Very high88.4Confident69 Ų6937.1 Ų37.130%0.30318%0.183SC..Hα-helixtrans-65.5-40.2176.4-70.3-49.5000112.6S267 Y270 L294 S295 V296 V300 I301 N302S267-F298 WeakPolarHBondContact CB-O 3.45Å; Y270-F298 AromaticContact CD1-CD2 3.86Å; Y270-F298 HydrophobicContact CD1-CD2 3.86Å; Y270-F298 HydrophobicContact CD1-CE2 4.05Å; Y270-F298 HydrophobicContact CD2-CD2 4.41Å; Y270-F298 AromaticContact CD2-CE2 3.96Å; Y270-F298 HydrophobicContact CD2-CE2 3.96Å; Y270-F298 HydrophobicContact CE1-CE2 4.45Å; Y270-F298 HydrophobicContact CE2-CE2 4.34Å; Y270-F298 AromaticContact CG-CD2 3.79Å; Y270-F298 HydrophobicContact CG-CD2 3.79Å; Y270-F298 AromaticContact CG-CE2 3.8Å; Y270-F298 HydrophobicContact CG-CE2 3.8Å; L294-F298 HydrophobicContact CB-CE2 4.27Å; L294-F298 WeakPolarHBondContact O-CD2 3.27Å; L294-F298 WeakPolarHBondContact O-CG 3.41Å; L294-F298 PolarHBondContact O-N 3.44Å; S295-F298 PolarHBondContact O-N 3.05Å; V296-F298 PolarHBondContact O-N 3.04Å; F298-V300 VanDerWaalsContact C-N 3.3Å; F298-V300 PolarHBondContact O-N 3.23Å; F298-I301 HydrophobicContact CD1-CD1 4.46Å; F298-I301 PolarHBondContact O-N 3.1Å; F298-N302 PolarHBondContact O-N 3.49Å
299T91.9Very high89.5Confident18 Ų1833.6 Ų33.611%0.1117%0.165CC..Hα-helixtrans-62.3-37.3173.9-600000111.9S295 V296 N302 S303S295-T299 PolarHBondContact O-N 3.42Å; S295-T299 VanDerWaalsContact O-N 3.12Å; S295-T299 PolarHBondContact O-OG1 3.11Å; V296-T299 PolarHBondContact O-N 2.88Å; T299-N302 WeakPolarHBondContact O-CB 3.3Å; T299-N302 PolarHBondContact O-N 2.84Å; T299-S303 PolarHBondContact O-N 3.27Å; T299-S303 PolarHBondContact O-OG 2.97Å
300V93Very high90.2Very high4 Ų433.8 Ų33.82%0.02417%0.166CC..Hα-helixtrans-71.6-39.8175.4177.50000111.6D20 C59 A62 V296 F297 F298 N302 S303 S304D20-V300 HydrophobicContact CB-CG1 4.37Å; D20-V300 WeakPolarHBondContact OD1-CG1 3.42Å; C59-V300 HydrophobicContact CB-CG1 4.48Å; A62-V300 HydrophobicContact CB-CG2 3.43Å; A62-V300 VanDerWaalsContact CB-CG2 3.43Å; V296-V300 HydrophobicContact CG1-CG2 4.33Å; V296-V300 WeakPolarHBondContact O-CG2 3.36Å; V296-V300 PolarHBondContact O-N 3.35Å; F297-V300 PolarHBondContact O-N 3.33Å; F298-V300 VanDerWaalsContact C-N 3.3Å; F298-V300 PolarHBondContact O-N 3.23Å; V300-N302 VanDerWaalsContact C-N 3.26Å; V300-N302 PolarHBondContact O-N 3.49Å; V300-S303 PolarHBondContact O-N 3.19Å; V300-S304 VanDerWaalsContact O-CB 3.27Å; V300-S304 WeakPolarHBondContact O-CB 3.46Å; V300-S304 PolarHBondContact O-N 3.42Å; V300-S304 PolarHBondContact O-OG 3.12Å
301I93.9Very high90.6Very high48 Ų4831.9 Ų31.925%0.24616%0.156CC..Hα-helixtrans-56.1-45.2172.4-75.2175.3000110.2F297 F298 S304 L305F297-I301 HydrophobicContact CD1-CD1 3.83Å; F297-I301 HydrophobicContact CE1-CD1 3.29Å; F297-I301 HydrophobicContact CE1-CG1 4.29Å; F297-I301 HydrophobicContact CE2-CD1 4.22Å; F297-I301 HydrophobicContact CE2-CG1 4.46Å; F297-I301 HydrophobicContact CZ-CD1 3.53Å; F297-I301 HydrophobicContact CZ-CG1 4.22Å; F297-I301 WeakPolarHBondContact O-CG1 3.39Å; F297-I301 PolarHBondContact O-N 3.3Å; F298-I301 HydrophobicContact CD1-CD1 4.46Å; F298-I301 PolarHBondContact O-N 3.1Å; I301-S304 PolarHBondContact O-N 3.03Å; I301-L305 HydrophobicContact CG2-CD1 3.63Å; I301-L305 HydrophobicContact CG2-CG 4.19Å; I301-L305 WeakPolarHBondContact O-CB 3.36Å; I301-L305 VanDerWaalsContact O-CG 3.29Å; I301-L305 WeakPolarHBondContact O-CG 3.37Å; I301-L305 PolarHBondContact O-N 3.45Å
302N94.4Very high90.8Very high0 Ų033 Ų330%016%0.164CC..Hα-helixtrans-55.7-53175.117957.6000111.8L263 F264 S267 F298 T299 V300 S304 L305 N306L263-N302 HydrophobicContact CD2-CB 4.39Å; L263-N302 HydrophobicContact CG-CB 4.17Å; L263-N302 VanDerWaalsContact CG-OD1 3.31Å; L263-N302 WeakPolarHBondContact CG-OD1 3.04Å; F264-N302 PolarHBondContact N-OD1 2.77Å; S267-N302 WeakPolarHBondContact OG-CB 3.06Å; F298-N302 PolarHBondContact O-N 3.49Å; T299-N302 WeakPolarHBondContact O-CB 3.3Å; T299-N302 PolarHBondContact O-N 2.84Å; V300-N302 VanDerWaalsContact C-N 3.26Å; V300-N302 PolarHBondContact O-N 3.49Å; N302-S304 VanDerWaalsContact C-N 3.28Å; N302-S304 PolarHBondContact O-N 3.26Å; N302-L305 PolarHBondContact O-N 3.1Å; N302-N306 PolarHBondContact O-N 2.61Å; N302-N306 VanDerWaalsContact O-N 3.11Å; N302-N306 PolarHBondContact O-OD1 3.25Å
303S95Very high91.2Very high0 Ų030.5 Ų30.50%016%0.156CC..Hα-helixtrans-62.9-32.3-180-54.50000113.2N27 D55 N100 T299 V300 P307N27-S303 PolarHBondContact ND2-O 3.19Å; D55-S303 WeakPolarHBondContact OD1-CA 3.44Å; N100-S303 PolarHBondContact ND2-OG 3.29Å; T299-S303 PolarHBondContact O-N 3.27Å; T299-S303 PolarHBondContact O-OG 2.97Å; V300-S303 PolarHBondContact O-N 3.19Å; S303-P307 VanDerWaalsContact O-CD 3.31Å; S303-P307 WeakPolarHBondContact O-CD 3.1Å
304S94.3Very high91Very high7 Ų727.8 Ų27.85%0.04915%0.146CC..Hα-helixtrans-80.4-33.1-178.2-55.70000112.8A19 G23 V300 I301 N302A19-S304 PolarHBondContact O-OG 2.81Å; G23-S304 VanDerWaalsContact CA-OG 3.27Å; G23-S304 WeakPolarHBondContact CA-OG 3.4Å; V300-S304 VanDerWaalsContact O-CB 3.27Å; V300-S304 WeakPolarHBondContact O-CB 3.46Å; V300-S304 PolarHBondContact O-N 3.42Å; V300-S304 PolarHBondContact O-OG 3.12Å; I301-S304 PolarHBondContact O-N 3.03Å; N302-S304 VanDerWaalsContact C-N 3.28Å; N302-S304 PolarHBondContact O-N 3.26Å
305L94.4Very high90.7Very high69 Ų6928 Ų2836%0.36115%0.145SC..Hα-helixtrans-83.7-25.4179.8-69179.9000112.8L263 I301 N302 I308 I309L263-L305 HydrophobicContact CD1-CD1 4.42Å; L263-L305 HydrophobicContact CD2-CB 3.63Å; L263-L305 HydrophobicContact CD2-CD1 3.87Å; L263-L305 HydrophobicContact CD2-CG 4.35Å; I301-L305 HydrophobicContact CG2-CD1 3.63Å; I301-L305 HydrophobicContact CG2-CG 4.19Å; I301-L305 WeakPolarHBondContact O-CB 3.36Å; I301-L305 VanDerWaalsContact O-CG 3.29Å; I301-L305 WeakPolarHBondContact O-CG 3.37Å; I301-L305 PolarHBondContact O-N 3.45Å; N302-L305 PolarHBondContact O-N 3.1Å; L305-I308 HydrophobicContact CD2-CD1 4.14Å; L305-I308 WeakPolarHBondContact O-CB 3.4Å; L305-I308 PolarHBondContact O-N 3.2Å; L305-I309 HydrophobicContact CB-CD1 4.29Å; L305-I309 WeakPolarHBondContact O-CG1 3.44Å; L305-I309 PolarHBondContact O-N 3.5Å
306N92.3Very high90.3Very high2 Ų232.2 Ų32.21%0.01116%0.163CC..Hα-helixtrans-48.3-50.9178-85.3-11.3000113.8D55 M260 N302 I308 I309 L310D55-N306 PolarHBondContact OD1-ND2 3.48Å; D55-N306 VanDerWaalsContact OD2-CB 3.3Å; D55-N306 WeakPolarHBondContact OD2-CB 3.21Å; D55-N306 PolarHBondContact OD2-ND2 3.35Å; M260-N306 HydrophobicContact CE-CB 3.84Å; M260-N306 WeakPolarHBondContact CG-OD1 3.3Å; N302-N306 PolarHBondContact O-N 2.61Å; N302-N306 VanDerWaalsContact O-N 3.11Å; N302-N306 PolarHBondContact O-OD1 3.25Å; N306-I308 VanDerWaalsContact C-N 3.34Å; N306-I308 PolarHBondContact O-N 3.08Å; N306-I309 PolarHBondContact O-N 2.71Å; N306-L310 WeakPolarHBondContact O-CB 3.33Å; N306-L310 PolarHBondContact O-N 2.89Å
307P89.2Confident90Very high1 Ų129.5 Ų29.51%0.00615%0.147CC..Hα-helixtrans-58.3-41.7174.6-2835.8000114.3F26 N27 T30 S303 L310 L311F26-P307 HydrophobicContact CB-CB 4.24Å; F26-P307 HydrophobicContact CB-CG 4.45Å; N27-P307 HydrophobicContact CB-CG 4.34Å; N27-P307 VanDerWaalsContact CG-CG 3.45Å; N27-P307 WeakPolarHBondContact OD1-CG 3.17Å; T30-P307 HydrophobicContact CG2-CB 4.08Å; T30-P307 WeakPolarHBondContact OG1-CB 3.42Å; S303-P307 VanDerWaalsContact O-CD 3.31Å; S303-P307 WeakPolarHBondContact O-CD 3.1Å; P307-L310 PolarHBondContact O-N 3.27Å; P307-L311 WeakPolarHBondContact O-CB 3.33Å; P307-L311 VanDerWaalsContact O-CG 3.3Å; P307-L311 WeakPolarHBondContact O-CG 3.43Å; P307-L311 PolarHBondContact O-N 3.48Å
308I90.6Very high89.7Confident56 Ų5633 Ų3329%0.28716%0.159SC..Hα-helixtrans-65.9-47.7-178.9-61.9172.7000109.3F26 L305 N306 L310 L311 L312F26-I308 HydrophobicContact CD2-CD1 4.01Å; F26-I308 HydrophobicContact CD2-CG1 4.38Å; F26-I308 HydrophobicContact CE2-CD1 3.99Å; L305-I308 HydrophobicContact CD2-CD1 4.14Å; L305-I308 WeakPolarHBondContact O-CB 3.4Å; L305-I308 PolarHBondContact O-N 3.2Å; N306-I308 VanDerWaalsContact C-N 3.34Å; N306-I308 PolarHBondContact O-N 3.08Å; I308-L310 VanDerWaalsContact C-N 3.28Å; I308-L310 PolarHBondContact O-N 2.04Å; I308-L311 PolarHBondContact O-N 2.8Å; I308-L312 HydrophobicContact CG2-CD1 3.62Å; I308-L312 HydrophobicContact CG2-CG 4.22Å; I308-L312 WeakPolarHBondContact O-CB 3.46Å; I308-L312 VanDerWaalsContact O-CG 3.26Å; I308-L312 WeakPolarHBondContact O-CG 3.21Å; I308-L312 PolarHBondContact O-N 2.87Å
309I92.1Very high89.3Confident28 Ų2837.4 Ų37.414%0.14417%0.174CC..Hα-helixtrans-54.9-48.7175-68.8167.3000109.5S256 L259 M260 L263 L305 N306 L312 S313S256-I309 WeakPolarHBondContact O-CG2 3.15Å; L259-I309 HydrophobicContact CB-CD1 4.3Å; L259-I309 HydrophobicContact CB-CG2 3.6Å; L259-I309 HydrophobicContact CD1-CG2 4.09Å; M260-I309 HydrophobicContact CG-CB 4.3Å; M260-I309 HydrophobicContact CG-CD1 4.44Å; M260-I309 HydrophobicContact CG-CG2 3.86Å; L263-I309 HydrophobicContact CD2-CD1 3.92Å; L305-I309 HydrophobicContact CB-CD1 4.29Å; L305-I309 WeakPolarHBondContact O-CG1 3.44Å; L305-I309 PolarHBondContact O-N 3.5Å; N306-I309 PolarHBondContact O-N 2.71Å; I309-L312 PolarHBondContact O-N 3.45Å; I309-S313 VanDerWaalsContact O-CB 3.22Å; I309-S313 WeakPolarHBondContact O-CB 3.48Å; I309-S313 PolarHBondContact O-N 3.32Å; I309-S313 PolarHBondContact O-OG 3.41Å
310L89.3Confident89Confident6 Ų641.7 Ų41.73%0.03119%0.188CC..Hα-helixtrans-61.8-45.8-178.8-174.557.1000113.1T30 I34 F48 S256 N306 P307 I308 S314 L317T30-L310 HydrophobicContact CG2-CD2 4.47Å; I34-L310 HydrophobicContact CD1-CD2 3.33Å; I34-L310 HydrophobicContact CD1-CG 4.18Å; F48-L310 HydrophobicContact CB-CD2 4.4Å; F48-L310 HydrophobicContact CD1-CD1 4.02Å; F48-L310 HydrophobicContact CD1-CD2 3.79Å; F48-L310 HydrophobicContact CE1-CD1 3.83Å; F48-L310 HydrophobicContact CE1-CD2 4.37Å; F48-L310 HydrophobicContact CG-CD2 4.27Å; F48-L310 HydrophobicContact CZ-CD1 4.2Å; S256-L310 WeakPolarHBondContact OG-CA 3.4Å; S256-L310 WeakPolarHBondContact OG-CD1 3.47Å; N306-L310 WeakPolarHBondContact O-CB 3.33Å; N306-L310 PolarHBondContact O-N 2.89Å; P307-L310 PolarHBondContact O-N 3.27Å; I308-L310 VanDerWaalsContact C-N 3.28Å; I308-L310 PolarHBondContact O-N 2.04Å; L310-S314 WeakPolarHBondContact O-CB 3.29Å; L310-S314 PolarHBondContact O-N 2.66Å; L310-L317 HydrophobicContact CD1-CD1 4.23Å; L310-L317 HydrophobicContact CG-CD1 3.84Å
311L88.1Confident88.8Confident16 Ų1642.4 Ų42.48%0.08419%0.191CC..Hα-helixtrans-66.3-39.6178.9-72.7173000112.9F29 T30 F33 P307 I308 L317 L321F29-L311 HydrophobicContact CD1-CD1 4.2Å; F29-L311 HydrophobicContact CE1-CD1 3.94Å; T30-L311 HydrophobicContact CG2-CD2 4.37Å; T30-L311 HydrophobicContact CG2-CG 4.19Å; T30-L311 WeakPolarHBondContact OG1-CD1 3.24Å; F33-L311 HydrophobicContact CD1-CD2 3.59Å; F33-L311 HydrophobicContact CE1-CD2 3.81Å; P307-L311 WeakPolarHBondContact O-CB 3.33Å; P307-L311 VanDerWaalsContact O-CG 3.3Å; P307-L311 WeakPolarHBondContact O-CG 3.43Å; P307-L311 PolarHBondContact O-N 3.48Å; I308-L311 PolarHBondContact O-N 2.8Å; L311-L317 HydrophobicContact CD2-CB 4.29Å; L311-L317 HydrophobicContact CD2-CD1 4.31Å; L311-L321 HydrophobicContact CB-CD2 4.47Å
312L88.2Confident88.6Confident103 Ų10344.2 Ų44.254%0.53920%0.202SC..Hα-helixtrans-81.8-37.4-174.1-67.7-178.8000113.5I308 I309 R318I308-L312 HydrophobicContact CG2-CD1 3.62Å; I308-L312 HydrophobicContact CG2-CG 4.22Å; I308-L312 WeakPolarHBondContact O-CB 3.46Å; I308-L312 VanDerWaalsContact O-CG 3.26Å; I308-L312 WeakPolarHBondContact O-CG 3.21Å; I308-L312 PolarHBondContact O-N 2.87Å; I309-L312 PolarHBondContact O-N 3.45Å; L312-R318 PolarHBondContact O-NH1 3.28Å
313S86.8Confident88.3Confident10 Ų1051.2 Ų51.27%0.0723%0.232CC..Hα-helixtrans-82.2-35.6-177.263.10000112.5S252 S256 I309 Q315S252-S313 WeakPolarHBondContact CB-O 3.42Å; S256-S313 WeakPolarHBondContact CA-OG 3.34Å; S256-S313 WeakPolarHBondContact CB-OG 3.5Å; S256-S313 PolarHBondContact OG-OG 3.45Å; S256-S313 VanDerWaalsContact OG-OG 3.12Å; I309-S313 VanDerWaalsContact O-CB 3.22Å; I309-S313 WeakPolarHBondContact O-CB 3.48Å; I309-S313 PolarHBondContact O-N 3.32Å; I309-S313 PolarHBondContact O-OG 3.41Å; S313-Q315 PolarHBondContact O-N 2.96Å
314S83.2Confident87.9Confident2 Ų256 Ų561%0.01425%0.253CS..  trans-73114.3178.7176.30000111.4L310 K316 L317 R318L310-S314 WeakPolarHBondContact O-CB 3.29Å; L310-S314 PolarHBondContact O-N 2.66Å; S314-K316 PolarHBondContact O-N 2.88Å; S314-L317 PolarHBondContact O-N 3.44Å; S314-L317 PolarHBondContact OG-N 2.8Å; S314-R318 VanDerWaalsContact O-CB 3.3Å; S314-R318 WeakPolarHBondContact O-CB 3.35Å; S314-R318 PolarHBondContact O-N 3.14Å
315Q82.5Confident87.7Confident51 Ų5160.5 Ų60.524%0.23827%0.272CS..Hα-helixtrans-59.1-35.4179.6-72.7-179.813.500112.5S252 S313 R319S252-Q315 PolarHBondContact OG-N 2.86Å; S313-Q315 PolarHBondContact O-N 2.96Å; Q315-R319 WeakPolarHBondContact O-CB 3.28Å; Q315-R319 WeakPolarHBondContact O-CG 3.37Å; Q315-R319 PolarHBondContact O-N 2.94Å
316K79.7Confident87.5Confident93 Ų9366.7 Ų66.740%0.40429%0.29SS..Hα-helixtrans-70.5-46.3-178.8-169.1173.4-174.3174.10111N38 S314 R320N38-K316 WeakPolarHBondContact O-CD 3.37Å; N38-K316 WeakPolarHBondContact O-CE 3.26Å; N38-K316 PolarHBondContact O-NZ 3.21Å; S314-K316 PolarHBondContact O-N 2.88Å; K316-R320 PolarHBondContact O-N 2.88Å; K316-R320 VanDerWaalsContact O-N 3.15Å
317L83.4Confident87.3Confident0 Ų074.4 Ų74.40%032%0.324CS..Hα-helixtrans-64.4-49.7176.2-65.8177.8000110.5F33 I34 T37 L39 L310 L311 S314 R319 R320 L321F33-L317 HydrophobicContact CD1-CD2 3.89Å; F33-L317 HydrophobicContact CE1-CB 4.13Å; F33-L317 HydrophobicContact CE1-CD2 3.64Å; F33-L317 HydrophobicContact CE1-CG 4.45Å; I34-L317 HydrophobicContact CD1-CD1 4.4Å; I34-L317 HydrophobicContact CG1-CD1 4.28Å; I34-L317 HydrophobicContact CG1-CD2 4.17Å; T37-L317 HydrophobicContact CG2-CD2 3.89Å; T37-L317 VanDerWaalsContact OG1-CD2 3.3Å; T37-L317 WeakPolarHBondContact OG1-CD2 3.27Å; L39-L317 HydrophobicContact CD1-CD1 4.24Å; L39-L317 HydrophobicContact CD2-CD1 3.7Å; L39-L317 HydrophobicContact CD2-CD2 3.59Å; L39-L317 HydrophobicContact CD2-CG 3.43Å; L39-L317 VanDerWaalsContact CD2-CG 3.43Å; L39-L317 HydrophobicContact CG-CD1 4.5Å; L39-L317 HydrophobicContact CG-CD2 4.25Å; L39-L317 HydrophobicContact CG-CG 4.48Å; L310-L317 HydrophobicContact CD1-CD1 4.23Å; L310-L317 HydrophobicContact CG-CD1 3.84Å; L311-L317 HydrophobicContact CD2-CB 4.29Å; L311-L317 HydrophobicContact CD2-CD1 4.31Å; S314-L317 PolarHBondContact O-N 3.44Å; S314-L317 PolarHBondContact OG-N 2.8Å; L317-R319 VanDerWaalsContact C-N 3.32Å; L317-R319 PolarHBondContact O-N 3.12Å; L317-R320 CarbonylContact O-C 3.39Å; L317-R320 PolarHBondContact O-N 3.34Å; L317-L321 VanDerWaalsContact O-CB 3.31Å; L317-L321 WeakPolarHBondContact O-CB 3.37Å; L317-L321 PolarHBondContact O-N 2.83Å
318R86.8Confident87.2Confident111 Ų11179.5 Ų79.542%0.41935%0.346SS..Hα-helixtrans-55.1-44.1178.6-171.9171.567.4-164.67.7113L312 S314 R320 L321 N322L312-R318 PolarHBondContact O-NH1 3.28Å; S314-R318 VanDerWaalsContact O-CB 3.3Å; S314-R318 WeakPolarHBondContact O-CB 3.35Å; S314-R318 PolarHBondContact O-N 3.14Å; R318-R320 PolarHBondContact O-N 3.44Å; R318-L321 PolarHBondContact O-N 2.93Å; R318-N322 WeakPolarHBondContact O-CB 3.43Å; R318-N322 PolarHBondContact O-N 3.49Å; R318-N322 PolarHBondContact O-OD1 3.36Å
319R86.8Confident87Confident161 Ų16180 Ų8061%0.60835%0.354SS*.Hα-helixtrans-63.6-40.8176-76.5174.8-176.8176.14.5112.2Q315 L317 K323Q315-R319 WeakPolarHBondContact O-CB 3.28Å; Q315-R319 WeakPolarHBondContact O-CG 3.37Å; Q315-R319 PolarHBondContact O-N 2.94Å; L317-R319 VanDerWaalsContact C-N 3.32Å; L317-R319 PolarHBondContact O-N 3.12Å; R319-K323 WeakPolarHBondContact O-CG 3.29Å; R319-K323 PolarHBondContact O-N 3.06Å; R319-K323 VanDerWaalsContact O-N 3.1Å
320R85.9Confident86.8Confident108 Ų10886 Ų8641%0.40838%0.379SS..Hα-helixtrans-72.5-36179-175.3160.2170171.9-1.4111.9F33 F36 K316 L317 R318 K323 F324F33-R320 HydrophobicContact CE2-CG 4.09Å; F33-R320 HydrophobicContact CZ-CB 3.86Å; F33-R320 HydrophobicContact CZ-CG 3.74Å; F36-R320 PolarHBondContact O-NH1 3.48Å; F36-R320 PolarHBondContact O-NH2 3.19Å; K316-R320 PolarHBondContact O-N 2.88Å; K316-R320 VanDerWaalsContact O-N 3.15Å; L317-R320 CarbonylContact O-C 3.39Å; L317-R320 PolarHBondContact O-N 3.34Å; R318-R320 PolarHBondContact O-N 3.44Å; R320-K323 WeakPolarHBondContact O-CB 3.45Å; R320-K323 PolarHBondContact O-N 2.9Å; R320-F324 WeakPolarHBondContact O-CB 3.41Å; R320-F324 PolarHBondContact O-N 2.86Å
321L87.5Confident86.6Confident19 Ų1993.2 Ų93.210%0.09941%0.41CS..Hα-helixtrans-63.5-46.6175.4-173.564.8000109.9F29 F33 L311 L317 R318 K323 F324 F325F29-L321 HydrophobicContact CE1-CD1 4.25Å; F29-L321 HydrophobicContact CZ-CD1 4.01Å; F33-L321 HydrophobicContact CE2-CD1 4.43Å; F33-L321 HydrophobicContact CZ-CB 4.02Å; F33-L321 HydrophobicContact CZ-CD1 4.37Å; L311-L321 HydrophobicContact CB-CD2 4.47Å; L317-L321 VanDerWaalsContact O-CB 3.31Å; L317-L321 WeakPolarHBondContact O-CB 3.37Å; L317-L321 PolarHBondContact O-N 2.83Å; R318-L321 PolarHBondContact O-N 2.93Å; L321-K323 VanDerWaalsContact C-N 3.3Å; L321-K323 PolarHBondContact O-N 3.38Å; L321-F324 WeakPolarHBondContact O-CB 3.4Å; L321-F324 PolarHBondContact O-N 3.01Å; L321-F324 VanDerWaalsContact O-N 3.09Å; L321-F325 HydrophobicContact CD1-CD2 3.94Å; L321-F325 HydrophobicContact CD1-CE2 3.43Å; L321-F325 VanDerWaalsContact CD1-CE2 3.43Å; L321-F325 HydrophobicContact CD1-CZ 4.25Å; L321-F325 HydrophobicContact CD2-CE2 4.1Å; L321-F325 HydrophobicContact CG-CD2 3.77Å; L321-F325 HydrophobicContact CG-CE2 3.53Å; L321-F325 VanDerWaalsContact O-CD2 3.31Å; L321-F325 WeakPolarHBondContact O-CD2 3.29Å; L321-F325 PolarHBondContact O-N 3.2Å
322N89.2Confident86.3Confident86 Ų8697.5 Ų97.546%0.4643%0.431SS..Hα-helixtrans-60.2-38.8174-71.5-7.9000112.4R318 R326R318-N322 WeakPolarHBondContact O-CB 3.43Å; R318-N322 PolarHBondContact O-N 3.49Å; R318-N322 PolarHBondContact O-OD1 3.36Å; N322-R326 VanDerWaalsContact O-CB 3.31Å; N322-R326 WeakPolarHBondContact O-CB 3.22Å; N322-R326 WeakPolarHBondContact O-CG 3.29Å; N322-R326 PolarHBondContact O-N 3.31Å
323K88.9Confident85.9Confident147 Ų14799.8 Ų99.864%0.63944%0.437SS*.Hα-helixtrans-66.1-41173.7-75.3-179.5179.5-172.90112R319 R320 L321 R326 K327R319-K323 WeakPolarHBondContact O-CG 3.29Å; R319-K323 PolarHBondContact O-N 3.06Å; R319-K323 VanDerWaalsContact O-N 3.1Å; R320-K323 WeakPolarHBondContact O-CB 3.45Å; R320-K323 PolarHBondContact O-N 2.9Å; L321-K323 VanDerWaalsContact C-N 3.3Å; L321-K323 PolarHBondContact O-N 3.38Å; K323-R326 PolarHBondContact O-N 3.19Å; K323-K327 WeakPolarHBondContact O-CG 3.32Å; K323-K327 PolarHBondContact O-N 3.39Å
324F87.5Confident85.5Confident99 Ų99105.8 Ų105.843%0.43446%0.462SS..Hα-helixtrans-60.9-52.1176.8177.2-96.7000110.9R320 L321 R326 K327 F328R320-F324 WeakPolarHBondContact O-CB 3.41Å; R320-F324 PolarHBondContact O-N 2.86Å; L321-F324 WeakPolarHBondContact O-CB 3.4Å; L321-F324 PolarHBondContact O-N 3.01Å; L321-F324 VanDerWaalsContact O-N 3.09Å; F324-R326 PolarHBondContact O-N 3.39Å; F324-K327 PolarHBondContact O-N 3.22Å; F324-F328 WeakPolarHBondContact O-CB 3.37Å; F324-F328 PolarHBondContact O-N 3.33Å
325F88.3Confident85.3Confident102 Ų102108.7 Ų108.745%0.44748%0.482SS..Hα-helixtrans-62.1-41176.7-77.6-62.5000112.7L321 K327 F328 C329L321-F325 HydrophobicContact CD1-CD2 3.94Å; L321-F325 HydrophobicContact CD1-CE2 3.43Å; L321-F325 VanDerWaalsContact CD1-CE2 3.43Å; L321-F325 HydrophobicContact CD1-CZ 4.25Å; L321-F325 HydrophobicContact CD2-CE2 4.1Å; L321-F325 HydrophobicContact CG-CD2 3.77Å; L321-F325 HydrophobicContact CG-CE2 3.53Å; L321-F325 VanDerWaalsContact O-CD2 3.31Å; L321-F325 WeakPolarHBondContact O-CD2 3.29Å; L321-F325 PolarHBondContact O-N 3.2Å; F325-K327 PolarHBondContact O-N 3.39Å; F325-F328 PolarHBondContact O-N 3.16Å; F325-C329 WeakPolarHBondContact O-CB 3.44Å; F325-C329 PolarHBondContact O-N 3.19Å; F325-C329 PolarHBondContact O-SG 2.75Å
326R90.3Very high85Confident200 Ų200113.4 Ų113.476%0.75550%0.502SS*.Hα-helixtrans-59.8-44.1175.1-78.5177.8179-159.6-0.6112.3N322 K323 F324 F330N322-R326 VanDerWaalsContact O-CB 3.31Å; N322-R326 WeakPolarHBondContact O-CB 3.22Å; N322-R326 WeakPolarHBondContact O-CG 3.29Å; N322-R326 PolarHBondContact O-N 3.31Å; K323-R326 PolarHBondContact O-N 3.19Å; F324-R326 PolarHBondContact O-N 3.39Å; R326-F330 WeakPolarHBondContact O-CB 3.25Å; R326-F330 PolarHBondContact O-N 2.97Å
327K88.8Confident84.8Confident163 Ų163114.2 Ų114.271%0.70951%0.511SS*.Hα-helixtrans-64-42.6175.9-75.5-174.9176.5-167.80111.7K323 F324 F325 F330 K331K323-K327 WeakPolarHBondContact O-CG 3.32Å; K323-K327 PolarHBondContact O-N 3.39Å; F324-K327 PolarHBondContact O-N 3.22Å; F325-K327 PolarHBondContact O-N 3.39Å; K327-F330 PolarHBondContact O-N 3.42Å; K327-K331 WeakPolarHBondContact O-CB 3.16Å; K327-K331 PolarHBondContact O-N 2.97Å
328F86.7Confident84.2Confident108 Ų108116.4 Ų116.447%0.47453%0.526SS..Hα-helixtrans-63.7-48.5178.3-171.1-98000111.9F324 F325 F330 K331 M332F324-F328 WeakPolarHBondContact O-CB 3.37Å; F324-F328 PolarHBondContact O-N 3.33Å; F325-F328 PolarHBondContact O-N 3.16Å; F328-F330 VanDerWaalsContact C-N 3.32Å; F328-F330 PolarHBondContact O-N 3.11Å; F328-K331 PolarHBondContact O-N 2.69Å; F328-M332 HydrophobicContact CD1-CG 4.27Å; F328-M332 HydrophobicContact CD1-SD 4Å; F328-M332 HydrophobicContact CE1-CE 4.48Å; F328-M332 HydrophobicContact CE1-CG 3.94Å; F328-M332 HydrophobicContact CE1-SD 3.38Å; F328-M332 WeakPolarHBondContact CE1-SD 3.28Å; F328-M332 HydrophobicContact CZ-CG 4.32Å; F328-M332 HydrophobicContact CZ-SD 4.07Å; F328-M332 PolarHBondContact O-N 2.94Å
329C87.7Confident83.6Confident68 Ų68116 Ų11646%0.45953%0.532SS..Hα-helixtrans-61-39.4175.7-690000112.3F325 M332 K333F325-C329 WeakPolarHBondContact O-CB 3.44Å; F325-C329 PolarHBondContact O-N 3.19Å; F325-C329 PolarHBondContact O-SG 2.75Å; C329-M332 PolarHBondContact O-N 3.46Å; C329-K333 WeakPolarHBondContact O-CG 3.24Å; C329-K333 PolarHBondContact O-N 3.42Å
330F87Confident82.9Confident153 Ų153112.2 Ų112.267%0.67153%0.527SS*.Hα-helixtrans-63.6-43.2175.2-170.2-95.3000111.5R326 K327 F328 K333 F334R326-F330 WeakPolarHBondContact O-CB 3.25Å; R326-F330 PolarHBondContact O-N 2.97Å; K327-F330 PolarHBondContact O-N 3.42Å; F328-F330 VanDerWaalsContact C-N 3.32Å; F328-F330 PolarHBondContact O-N 3.11Å; F330-K333 PolarHBondContact O-N 2.98Å; F330-F334 PolarHBondContact O-N 3.48Å
331K85.6Confident82.3Confident158 Ų158111.3 Ų111.369%0.68753%0.533SS*.Hα-helixtrans-63.5-41175.8-168.9178179.9-177.30112.3K327 F328 F334 S335K327-K331 WeakPolarHBondContact O-CB 3.16Å; K327-K331 PolarHBondContact O-N 2.97Å; F328-K331 PolarHBondContact O-N 2.69Å; K331-F334 PolarHBondContact O-N 3.47Å; K331-S335 PolarHBondContact O-N 2.89Å
332M81.4Confident81.5Confident105 Ų105115 Ų11552%0.51755%0.552SS.*Hα-helixtrans-65.4-40.8175.4-74-168.2101.900112.5F328 C329 S335 K336F328-M332 HydrophobicContact CD1-CG 4.27Å; F328-M332 HydrophobicContact CD1-SD 4Å; F328-M332 HydrophobicContact CE1-CE 4.48Å; F328-M332 HydrophobicContact CE1-CG 3.94Å; F328-M332 HydrophobicContact CE1-SD 3.38Å; F328-M332 WeakPolarHBondContact CE1-SD 3.28Å; F328-M332 HydrophobicContact CZ-CG 4.32Å; F328-M332 HydrophobicContact CZ-SD 4.07Å; F328-M332 PolarHBondContact O-N 2.94Å; C329-M332 PolarHBondContact O-N 3.46Å; M332-S335 PolarHBondContact O-N 3.38Å; M332-K336 PolarHBondContact O-N 2.93Å
333K80.8Confident80.5Confident151 Ų151114 Ų11466%0.65755%0.552SS**Hα-helixtrans-63.2-42.3175.2-76.2-174177.9-169.70111.8C329 F330 K336 N337C329-K333 WeakPolarHBondContact O-CG 3.24Å; C329-K333 PolarHBondContact O-N 3.42Å; F330-K333 PolarHBondContact O-N 2.98Å; K333-K336 PolarHBondContact O-N 2.91Å; K333-N337 PolarHBondContact O-N 2.96Å; K333-N337 VanDerWaalsContact O-N 3.08Å
334F78.2Confident79.5Confident137 Ų137110.4 Ų110.460%0.60154%0.542SS*.Hα-helixtrans-63-45.1176.3-167.4-94.8000111.8F330 K331 K336 N337 S338F330-F334 PolarHBondContact O-N 3.48Å; K331-F334 PolarHBondContact O-N 3.47Å; F334-K336 VanDerWaalsContact C-N 3.33Å; F334-K336 PolarHBondContact O-N 3.18Å; F334-N337 PolarHBondContact O-N 3.45Å; F334-S338 PolarHBondContact O-N 3.11Å; F334-S338 PolarHBondContact O-OG 3.22Å
335S79.1Confident78.6Confident63 Ų63110.4 Ų110.444%0.44155%0.546SS..Hα-helixtrans-61.5-37176.7-174.20000113.2K331 M332 N339K331-S335 PolarHBondContact O-N 2.89Å; M332-S335 PolarHBondContact O-N 3.38Å; S335-N339 PolarHBondContact O-N 3.21Å
336K75.1Confident77.5Confident150 Ų150110 Ų11065%0.65255%0.548SS*.Hα-helixtrans-65.4-45.5174-77.5-171.5176.5-171.40111.6M332 K333 F334 S338 N339 T340M332-K336 PolarHBondContact O-N 2.93Å; K333-K336 PolarHBondContact O-N 2.91Å; F334-K336 VanDerWaalsContact C-N 3.33Å; F334-K336 PolarHBondContact O-N 3.18Å; K336-S338 PolarHBondContact O-N 2.9Å; K336-N339 PolarHBondContact O-N 3.37Å; K336-T340 PolarHBondContact O-N 3.46Å; K336-T340 VanDerWaalsContact O-N 3.12Å; K336-T340 PolarHBondContact O-OG1 2.86Å; K336-T340 VanDerWaalsContact O-OG1 3.04Å
337N76.1Confident76.2Confident110 Ų110103.4 Ų103.459%0.58853%0.533SS*.Hα-helixtrans-64.8-39.5179.6-73.56.3000112.4K333 F334 N339 T340 V341K333-N337 PolarHBondContact O-N 2.96Å; K333-N337 VanDerWaalsContact O-N 3.08Å; F334-N337 PolarHBondContact O-N 3.45Å; N337-N339 VanDerWaalsContact C-N 3.35Å; N337-N339 PolarHBondContact O-N 3.47Å; N337-T340 PolarHBondContact O-N 2.88Å; N337-V341 WeakPolarHBondContact O-CG2 3.37Å; N337-V341 PolarHBondContact O-N 3.01Å; N337-V341 VanDerWaalsContact O-N 3.12Å
338S71.5Confident75Confident45 Ų45101 Ų10132%0.31553%0.528SS..Hα-helixtrans-62.4-40.6176.2-61.60000112.4F334 K336 V341 I342F334-S338 PolarHBondContact O-N 3.11Å; F334-S338 PolarHBondContact O-OG 3.22Å; K336-S338 PolarHBondContact O-N 2.9Å; S338-V341 PolarHBondContact O-N 3.28Å; S338-I342 WeakPolarHBondContact O-CG1 3.08Å; S338-I342 PolarHBondContact O-N 3.27Å; S338-I342 VanDerWaalsContact O-N 3.16Å
339N72.4Confident73.9Confident103 Ų103100 Ų10055%0.55153%0.531SS*.Hα-helixtrans-67.8-37.8177.8-70-1.7000112.1S335 K336 N337 V341 I342 S343S335-N339 PolarHBondContact O-N 3.21Å; K336-N339 PolarHBondContact O-N 3.37Å; N337-N339 VanDerWaalsContact C-N 3.35Å; N337-N339 PolarHBondContact O-N 3.47Å; N339-V341 VanDerWaalsContact C-N 3.34Å; N339-V341 PolarHBondContact O-N 2.97Å; N339-I342 PolarHBondContact O-N 2.98Å; N339-S343 PolarHBondContact O-N 3.47Å; N339-S343 PolarHBondContact O-OG 2.8Å
340T72.3Confident72.5Confident81 Ų81105.6 Ų105.650%0.49755%0.547SS..Hα-helixtrans-64.3-38175.7-49.20000112.3K336 N337 S343 T344K336-T340 PolarHBondContact O-N 3.46Å; K336-T340 VanDerWaalsContact O-N 3.12Å; K336-T340 PolarHBondContact O-OG1 2.86Å; K336-T340 VanDerWaalsContact O-OG1 3.04Å; N337-T340 PolarHBondContact O-N 2.88Å; T340-S343 WeakPolarHBondContact CA-OG 3.45Å; T340-S343 PolarHBondContact O-OG 3.07Å; T340-T344 PolarHBondContact O-N 3.43Å; T340-T344 VanDerWaalsContact O-N 3.14Å; T340-T344 PolarHBondContact O-OG1 2.96Å
341V74.1Confident71.1Confident89 Ų89103.8 Ų103.854%0.53955%0.549SS..Hα-helixtrans-66.5-43.5177.3173.70000110.8N337 S338 N339 T344 I345N337-V341 WeakPolarHBondContact O-CG2 3.37Å; N337-V341 PolarHBondContact O-N 3.01Å; N337-V341 VanDerWaalsContact O-N 3.12Å; S338-V341 PolarHBondContact O-N 3.28Å; N339-V341 VanDerWaalsContact C-N 3.34Å; N339-V341 PolarHBondContact O-N 2.97Å; V341-T344 PolarHBondContact O-N 3.32Å; V341-I345 HydrophobicContact CG1-CD1 4.15Å; V341-I345 WeakPolarHBondContact O-CG1 3.49Å; V341-I345 PolarHBondContact O-N 3.28Å; V341-I345 VanDerWaalsContact O-N 3.15Å
342I70.9Confident69.9Low96 Ų96100.9 Ų100.949%0.49255%0.548SS..Hα-helixtrans-63.9-45.3178.1-65.3167.7000111S338 N339 T344 I345 D346S338-I342 WeakPolarHBondContact O-CG1 3.08Å; S338-I342 PolarHBondContact O-N 3.27Å; S338-I342 VanDerWaalsContact O-N 3.16Å; N339-I342 PolarHBondContact O-N 2.98Å; I342-T344 PolarHBondContact O-N 3.42Å; I342-I345 PolarHBondContact O-N 2.93Å; I342-I345 VanDerWaalsContact O-N 3.11Å; I342-D346 PolarHBondContact O-N 3.42Å
343S68.9Low68.7Low67 Ų6799 Ų9947%0.46956%0.556SS.*Hα-helixtrans-63.2-30.1178.159.80000113.4N339 T340 S347N339-S343 PolarHBondContact O-N 3.47Å; N339-S343 PolarHBondContact O-OG 2.8Å; T340-S343 WeakPolarHBondContact CA-OG 3.45Å; T340-S343 PolarHBondContact O-OG 3.07Å; S343-S347 PolarHBondContact O-N 3.33Å; S343-S347 PolarHBondContact O-OG 3.32Å
344T66.7Low67.4Low70 Ų70102.8 Ų102.843%0.42958%0.583SS.*Hα-helixtrans-73.8-31.9176.7-50.30000111.7T340 V341 I342 S347 N348T340-T344 PolarHBondContact O-N 3.43Å; T340-T344 VanDerWaalsContact O-N 3.14Å; T340-T344 PolarHBondContact O-OG1 2.96Å; V341-T344 PolarHBondContact O-N 3.32Å; I342-T344 PolarHBondContact O-N 3.42Å; T344-S347 WeakPolarHBondContact CA-OG 3.29Å; T344-S347 PolarHBondContact O-OG 3.02Å; T344-N348 PolarHBondContact O-N 3.17Å
345I68.5Low66.9Low99 Ų99101.1 Ų101.151%0.50858%0.583SS.*Hα-helixtrans-69.5-47.6174.7-67167.1000109.5V341 I342 S347 N348 T349V341-I345 HydrophobicContact CG1-CD1 4.15Å; V341-I345 WeakPolarHBondContact O-CG1 3.49Å; V341-I345 PolarHBondContact O-N 3.28Å; V341-I345 VanDerWaalsContact O-N 3.15Å; I342-I345 PolarHBondContact O-N 2.93Å; I342-I345 VanDerWaalsContact O-N 3.11Å; I345-S347 VanDerWaalsContact C-N 3.31Å; I345-S347 PolarHBondContact O-N 2.98Å; I345-N348 PolarHBondContact O-N 3.27Å; I345-T349 PolarHBondContact O-N 2.89Å; I345-T349 VanDerWaalsContact O-N 3.14Å; I345-T349 PolarHBondContact O-OG1 3.2Å
346D65.2Low66.2Low93 Ų93103.1 Ų103.150%0.49759%0.59SS.*Hα-helixtrans-64.3-31.6-179-71.5-22.7000113.7I342 N348 K350I342-D346 PolarHBondContact O-N 3.42Å; D346-N348 VanDerWaalsContact C-N 3.34Å; D346-K350 PolarHBondContact O-N 2.96Å
347S62.8Low65.7Low63 Ų63100.5 Ų100.544%0.44159%0.587SS.*Hα-helixtrans-68.4-33.8173.454.70000112.7S343 T344 I345 T351S343-S347 PolarHBondContact O-N 3.33Å; S343-S347 PolarHBondContact O-OG 3.32Å; T344-S347 WeakPolarHBondContact CA-OG 3.29Å; T344-S347 PolarHBondContact O-OG 3.02Å; I345-S347 VanDerWaalsContact C-N 3.31Å; I345-S347 PolarHBondContact O-N 2.98Å; S347-T351 PolarHBondContact O-OG1 3.29Å
348N64.2Low65.1Low111 Ų11199.9 Ų99.959%0.59459%0.586SS**Hα-helixtrans-77.7-24.3178.8-72.4-4.1000112.4T344 I345 D346 T351T344-N348 PolarHBondContact O-N 3.17Å; I345-N348 PolarHBondContact O-N 3.27Å; D346-N348 VanDerWaalsContact C-N 3.34Å; N348-T351 PolarHBondContact O-OG1 2.79Å
349T62.8Low64.7Low89 Ų89103.4 Ų103.455%0.54660%0.603SS.*Hα-helixtrans-75.7-32.2176.5-16.90000112.3I345 S352I345-T349 PolarHBondContact O-N 2.89Å; I345-T349 VanDerWaalsContact O-N 3.14Å; I345-T349 PolarHBondContact O-OG1 3.2Å; T349-S352 PolarHBondContact O-OG 3.29Å
350K58.9Low64.2Low185 Ų185103.4 Ų103.480%0.80461%0.607SS**Hα-helixtrans-76-18.8-178.9-76.7-173.6178.5-179.10114.7D346 S352D346-K350 PolarHBondContact O-N 2.96Å; K350-S352 VanDerWaalsContact C-N 3.31Å; K350-S352 PolarHBondContact O-N 3.07Å
351T58.6Low63.6Low114 Ų114105 Ų10570%0.69962%0.615SS**THydrogen-bonded Turntrans-88.29.3179.144.60000114.2S347 N348S347-T351 PolarHBondContact O-OG1 3.29Å; N348-T351 PolarHBondContact O-OG1 2.79Å
352S59.7Low62.8Low97 Ų97106.2 Ų106.268%0.67862%0.621SS**THydrogen-bonded Turntrans-11115.8177.670.70000114.6T349 K350T349-S352 PolarHBondContact O-OG 3.29Å; K350-S352 VanDerWaalsContact C-N 3.31Å; K350-S352 PolarHBondContact O-N 3.07Å
353G55.8Low62.2Low65 Ų65107.1 Ų107.167%0.6763%0.631SS**  trans-102.2-4.2-17300000117.3
354D54.3Low61.6Low232 Ų232110.7 Ų110.7100%1.24165%0.646SS**  trans-125.20174.3-63.3-31000109.1

Retrieved 354 of 354 residues in 1541 ms (Link to these results)

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