A0A5K4FAE3_SCHMA Loading...

G_PROTEIN_RECEP_F1_2 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FAE3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 287 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
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
1M45.7Very low76.3Confident201 Ų20180.8 Ų80.899%0.9942%0.423SS*.  0-23.50-84.1-169-90.300115.1G3M1-G3 PolarHBondContact O-N 3.24Å
2L52.7Low77.8Confident72 Ų7274.1 Ų74.138%0.37739%0.387SS..G310 helixtrans-84.51-176.6-74.1153000116.3N4 T5 K69L2-N4 VanDerWaalsContact C-N 3.33Å; L2-N4 PolarHBondContact O-N 3.34Å; L2-T5 HydrophobicContact CD2-CG2 4.23Å; L2-T5 PolarHBondContact O-N 3.16Å; L2-T5 PolarHBondContact O-OG1 2.8Å; L2-K69 HydrophobicContact CD1-CB 4.1Å; L2-K69 HydrophobicContact CD1-CD 4.47Å; L2-K69 HydrophobicContact CD1-CG 4.48Å; L2-K69 HydrophobicContact CD2-CB 4.33Å
3G53.8Low79.1Confident60 Ų6073.3 Ų73.362%0.61938%0.383SS*.G310 helixtrans-66.3-32-177.800000114.1M1 Y6M1-G3 PolarHBondContact O-N 3.24Å; G3-Y6 WeakPolarHBondContact O-CD2 3.12Å
4N62.7Low80.2Confident120 Ų12073.2 Ų73.264%0.64238%0.383SS*.G310 helixtrans-94.8-0.8-179.5-84.1-3.8000114L2 Y6L2-N4 VanDerWaalsContact C-N 3.33Å; L2-N4 PolarHBondContact O-N 3.34Å; N4-Y6 VanDerWaalsContact C-N 3.33Å; N4-Y6 PolarHBondContact O-N 3.26Å
5T78.4Confident81.2Confident14 Ų1468.9 Ų68.99%0.08636%0.361CS..THydrogen-bonded Turntrans-76.4-19-175.946.80000113.5L2 Q7 F8 G9 V66 F249L2-T5 HydrophobicContact CD2-CG2 4.23Å; L2-T5 PolarHBondContact O-N 3.16Å; L2-T5 PolarHBondContact O-OG1 2.8Å; T5-Q7 PolarHBondContact O-N 3.43Å; T5-Q7 VanDerWaalsContact O-N 3.11Å; T5-F8 WeakPolarHBondContact O-CA 3.19Å; T5-F8 WeakPolarHBondContact O-CB 3.43Å; T5-F8 PolarHBondContact O-N 3.42Å; T5-G9 PolarHBondContact O-N 3.46Å; T5-V66 WeakPolarHBondContact O-CG1 3.47Å; T5-F249 HydrophobicContact CG2-CE1 3.63Å; T5-F249 HydrophobicContact CG2-CZ 4.29Å
6Y85.6Confident82Confident100 Ų10064.9 Ų64.939%0.39234%0.342SS..Hα-helixtrans-56.6-30.9179.6-64.5-67.2000113.3G3 N4 F8 G9 F10 Y67 K69G3-Y6 WeakPolarHBondContact O-CD2 3.12Å; N4-Y6 VanDerWaalsContact C-N 3.33Å; N4-Y6 PolarHBondContact O-N 3.26Å; Y6-F8 VanDerWaalsContact C-N 3.3Å; Y6-F8 PolarHBondContact O-N 2.8Å; Y6-G9 PolarHBondContact O-N 2.86Å; Y6-F10 PolarHBondContact O-N 3.14Å; Y6-Y67 AromaticContact CD1-CD1 3.75Å; Y6-Y67 HydrophobicContact CD1-CD1 3.75Å; Y6-Y67 HydrophobicContact CD1-CE1 4.02Å; Y6-Y67 HydrophobicContact CE1-CD1 4.27Å; Y6-K69 WeakPolarHBondContact OH-CE 3.41Å; Y6-K69 PolarHBondContact OH-NZ 3.22Å
7Q89.4Confident82.7Confident144 Ų14468.2 Ų68.267%0.67336%0.359SS*.Hα-helixtrans-60.9-38.2174-67.1179.7-1700112.1T5 F10 A11T5-Q7 PolarHBondContact O-N 3.43Å; T5-Q7 VanDerWaalsContact O-N 3.11Å; Q7-F10 PolarHBondContact O-N 2.76Å; Q7-A11 WeakPolarHBondContact O-CB 3.28Å; Q7-A11 PolarHBondContact O-N 3.07Å
8F90.5Very high83.4Confident34 Ų3468 Ų6815%0.14936%0.358CS..Hα-helixtrans-67.5-40.7173.9-70.6-73.8000111.8T5 Y6 F10 A11 F12 F249 C252 I253 L256T5-F8 WeakPolarHBondContact O-CA 3.19Å; T5-F8 WeakPolarHBondContact O-CB 3.43Å; T5-F8 PolarHBondContact O-N 3.42Å; Y6-F8 VanDerWaalsContact C-N 3.3Å; Y6-F8 PolarHBondContact O-N 2.8Å; F8-F10 VanDerWaalsContact C-N 3.32Å; F8-F10 PolarHBondContact O-N 2.68Å; F8-A11 PolarHBondContact O-N 3.2Å; F8-F12 HydrophobicContact CB-CD2 4.5Å; F8-F12 HydrophobicContact CB-CE2 4.27Å; F8-F12 WeakPolarHBondContact O-CD2 3.38Å; F8-F12 WeakPolarHBondContact O-CG 3.24Å; F8-F12 PolarHBondContact O-N 3.28Å; F8-F249 HydrophobicContact CD2-CD1 4.37Å; F8-F249 AromaticContact CE2-CD1 3.55Å; F8-F249 HydrophobicContact CE2-CD1 3.55Å; F8-F249 AromaticContact CE2-CE1 3.98Å; F8-F249 HydrophobicContact CE2-CE1 3.98Å; F8-F249 HydrophobicContact CZ-CD1 4.2Å; F8-C252 HydrophobicContact CD1-CB 4.45Å; F8-C252 WeakPolarHBondContact CD1-SG 3.46Å; F8-C252 HydrophobicContact CE1-CB 4.42Å; F8-C252 VanDerWaalsContact CG-SG 3.55Å; F8-I253 HydrophobicContact CE1-CG1 3.71Å; F8-I253 HydrophobicContact CZ-CD1 4.45Å; F8-I253 HydrophobicContact CZ-CG1 3.85Å; F8-L256 HydrophobicContact CD1-CD2 4.22Å
9G92.2Very high84.1Confident0 Ų064.4 Ų64.40%034%0.339CS..Hα-helixtrans-58.7-45.5175.700000111.5T5 Y6 F12 L13 A63T5-G9 PolarHBondContact O-N 3.46Å; Y6-G9 PolarHBondContact O-N 2.86Å; G9-F12 PolarHBondContact O-N 2.68Å; G9-L13 PolarHBondContact O-N 3.49Å; G9-L13 VanDerWaalsContact O-N 3.09Å; G9-A63 WeakPolarHBondContact O-CB 3.46Å
10F93.4Very high84.6Confident121 Ų12166.1 Ų66.153%0.53135%0.347SS..Hα-helixtrans-62.7-45.9174179-100.7000111.8Y6 Q7 F8 F12 L13 L14 Y67Y6-F10 PolarHBondContact O-N 3.14Å; Q7-F10 PolarHBondContact O-N 2.76Å; F8-F10 VanDerWaalsContact C-N 3.32Å; F8-F10 PolarHBondContact O-N 2.68Å; F10-F12 VanDerWaalsContact C-N 3.34Å; F10-F12 PolarHBondContact O-N 3.13Å; F10-L13 PolarHBondContact O-N 3.26Å; F10-L14 HydrophobicContact CE1-CB 4.49Å; F10-L14 HydrophobicContact CE1-CD2 3.98Å; F10-L14 HydrophobicContact CZ-CD2 4.36Å; F10-L14 VanDerWaalsContact O-CB 3.32Å; F10-L14 WeakPolarHBondContact O-CB 3.49Å; F10-L14 PolarHBondContact O-N 3.36Å; F10-Y67 VanDerWaalsContact CA-OH 3.29Å; F10-Y67 WeakPolarHBondContact CA-OH 3.43Å; F10-Y67 PolarHBondContact N-OH 3.38Å
11A94.6Very high85.1Confident23 Ų2370 Ų7019%0.1936%0.358CS..Hα-helixtrans-61.4-40.2178.900000112.6Q7 F8 T15 L256Q7-A11 WeakPolarHBondContact O-CB 3.28Å; Q7-A11 PolarHBondContact O-N 3.07Å; F8-A11 PolarHBondContact O-N 3.2Å; A11-T15 VanDerWaalsContact O-CB 3.23Å; A11-T15 WeakPolarHBondContact O-CB 3.27Å; A11-T15 PolarHBondContact O-N 3.03Å; A11-T15 PolarHBondContact O-OG1 3.45Å; A11-L256 HydrophobicContact CB-CD1 4Å; A11-L256 HydrophobicContact CB-CD2 3.68Å
12F94.8Very high87.5Confident0 Ų061.2 Ų61.20%032%0.315CS..Hα-helixtrans-63.4-47.8174-74.5-54.7000111.6F8 G9 F10 L14 T15 G16 T59 A63 V66 Q255 L256 K259F8-F12 HydrophobicContact CB-CD2 4.5Å; F8-F12 HydrophobicContact CB-CE2 4.27Å; F8-F12 WeakPolarHBondContact O-CD2 3.38Å; F8-F12 WeakPolarHBondContact O-CG 3.24Å; F8-F12 PolarHBondContact O-N 3.28Å; G9-F12 PolarHBondContact O-N 2.68Å; F10-F12 VanDerWaalsContact C-N 3.34Å; F10-F12 PolarHBondContact O-N 3.13Å; F12-L14 PolarHBondContact O-N 3.4Å; F12-T15 PolarHBondContact O-N 3.35Å; F12-G16 PolarHBondContact O-N 2.83Å; F12-T59 HydrophobicContact CB-CG2 3.99Å; F12-T59 HydrophobicContact CD1-CG2 4.04Å; F12-T59 HydrophobicContact CG-CG2 4.45Å; F12-T59 WeakPolarHBondContact O-CG2 3.35Å; F12-A63 HydrophobicContact CB-CB 3.8Å; F12-V66 HydrophobicContact CD2-CG2 4.31Å; F12-V66 HydrophobicContact CE2-CG2 4.23Å; F12-Q255 HydrophobicContact CE1-CG 4.03Å; F12-Q255 HydrophobicContact CZ-CB 4.36Å; F12-Q255 HydrophobicContact CZ-CG 4.1Å; F12-L256 HydrophobicContact CD1-CD1 3.61Å; F12-L256 HydrophobicContact CE1-CB 3.88Å; F12-L256 HydrophobicContact CE1-CD1 3.78Å; F12-L256 HydrophobicContact CE1-CG 4.43Å; F12-L256 HydrophobicContact CG-CD1 4.28Å; F12-L256 HydrophobicContact CZ-CB 4.24Å; F12-K259 HydrophobicContact CD1-CD 3.67Å; F12-K259 HydrophobicContact CE1-CD 3.62Å
13L94Very high89.6Confident64 Ų6457.9 Ų57.934%0.33530%0.297SS..Hα-helixtrans-59.8-47.7176.7-73.4-179.8000111.9G9 F10 T15 G16 L17 A63 Y67G9-L13 PolarHBondContact O-N 3.49Å; G9-L13 VanDerWaalsContact O-N 3.09Å; F10-L13 PolarHBondContact O-N 3.26Å; L13-T15 VanDerWaalsContact C-N 3.33Å; L13-T15 PolarHBondContact O-N 3.3Å; L13-G16 PolarHBondContact O-N 3.34Å; L13-G16 VanDerWaalsContact O-N 3.17Å; L13-L17 WeakPolarHBondContact O-CG 3.35Å; L13-L17 PolarHBondContact O-N 2.96Å; L13-A63 HydrophobicContact CD2-CB 3.65Å; L13-A63 HydrophobicContact CG-CB 3.6Å; L13-Y67 HydrophobicContact CD1-CE2 3.6Å; L13-Y67 HydrophobicContact CG-CE2 4.22Å
14L94.8Very high91.4Very high72 Ų7259.1 Ų59.138%0.37729%0.293SS..Hα-helixtrans-60.9-44.6180-176.465000111F10 F12 G16 L17 L18F10-L14 HydrophobicContact CE1-CB 4.49Å; F10-L14 HydrophobicContact CE1-CD2 3.98Å; F10-L14 HydrophobicContact CZ-CD2 4.36Å; F10-L14 VanDerWaalsContact O-CB 3.32Å; F10-L14 WeakPolarHBondContact O-CB 3.49Å; F10-L14 PolarHBondContact O-N 3.36Å; F12-L14 PolarHBondContact O-N 3.4Å; L14-G16 VanDerWaalsContact C-N 3.31Å; L14-G16 PolarHBondContact O-N 2.93Å; L14-L17 PolarHBondContact O-N 3.5Å; L14-L18 HydrophobicContact CD1-CD1 3.8Å; L14-L18 HydrophobicContact CD1-CG 3.9Å; L14-L18 HydrophobicContact CD2-CD1 4.37Å; L14-L18 HydrophobicContact CG-CD1 3.76Å; L14-L18 HydrophobicContact CG-CG 4.21Å; L14-L18 VanDerWaalsContact O-CB 3.28Å; L14-L18 WeakPolarHBondContact O-CB 3.5Å; L14-L18 WeakPolarHBondContact O-CG 3.4Å; L14-L18 PolarHBondContact O-N 3.42Å
15T95.3Very high92.9Very high8 Ų858.3 Ų58.35%0.04928%0.284CS..Hα-helixtrans-60.1-42.8175.9-60.20000111.2A11 F12 L13 G19 K259 I260 A263A11-T15 VanDerWaalsContact O-CB 3.23Å; A11-T15 WeakPolarHBondContact O-CB 3.27Å; A11-T15 PolarHBondContact O-N 3.03Å; A11-T15 PolarHBondContact O-OG1 3.45Å; F12-T15 PolarHBondContact O-N 3.35Å; L13-T15 VanDerWaalsContact C-N 3.33Å; L13-T15 PolarHBondContact O-N 3.3Å; T15-G19 WeakPolarHBondContact O-CA 3.26Å; T15-G19 PolarHBondContact O-N 3.22Å; T15-K259 HydrophobicContact CG2-CB 4.12Å; T15-I260 HydrophobicContact CG2-CB 4.49Å; T15-I260 HydrophobicContact CG2-CG1 3.9Å; T15-A263 HydrophobicContact CG2-CB 3.62Å; T15-A263 WeakPolarHBondContact O-CB 3.46Å
16G94.1Very high93.6Very high6 Ų657.7 Ų57.76%0.06228%0.28CS..Hα-helixtrans-62.9-49.1177.100000112.9F12 L13 L14 L20 I56F12-G16 PolarHBondContact O-N 2.83Å; L13-G16 PolarHBondContact O-N 3.34Å; L13-G16 VanDerWaalsContact O-N 3.17Å; L14-G16 VanDerWaalsContact C-N 3.31Å; L14-G16 PolarHBondContact O-N 2.93Å; G16-L20 WeakPolarHBondContact O-CB 3.13Å; G16-L20 PolarHBondContact O-N 2.87Å; G16-I56 WeakPolarHBondContact O-CG2 3.44Å
17L94.7Very high93.8Very high120 Ų12058 Ų5863%0.62829%0.287SS*.Hα-helixtrans-67.2-48.5-178.8-68.5173.8000112.3L13 L14 G19 L20 W21L13-L17 WeakPolarHBondContact O-CG 3.35Å; L13-L17 PolarHBondContact O-N 2.96Å; L14-L17 PolarHBondContact O-N 3.5Å; L17-G19 VanDerWaalsContact C-N 3.33Å; L17-G19 PolarHBondContact O-N 2.99Å; L17-L20 PolarHBondContact O-N 2.81Å; L17-W21 PolarHBondContact O-N 3.2Å
18L95.2Very high93.8Very high65 Ų6554.2 Ų54.234%0.3428%0.276SS..Hα-helixtrans-64-40.9177-69.9-179.9000111.2L14 W21 L22 F264L14-L18 HydrophobicContact CD1-CD1 3.8Å; L14-L18 HydrophobicContact CD1-CG 3.9Å; L14-L18 HydrophobicContact CD2-CD1 4.37Å; L14-L18 HydrophobicContact CG-CD1 3.76Å; L14-L18 HydrophobicContact CG-CG 4.21Å; L14-L18 VanDerWaalsContact O-CB 3.28Å; L14-L18 WeakPolarHBondContact O-CB 3.5Å; L14-L18 WeakPolarHBondContact O-CG 3.4Å; L14-L18 PolarHBondContact O-N 3.42Å; L18-W21 PolarHBondContact O-N 3.32Å; L18-L22 WeakPolarHBondContact O-CB 3.39Å; L18-L22 VanDerWaalsContact O-CG 3.29Å; L18-L22 WeakPolarHBondContact O-CG 3.5Å; L18-L22 PolarHBondContact O-N 3.01Å; L18-F264 HydrophobicContact CB-CZ 4.42Å; L18-F264 HydrophobicContact CD1-CZ 3.94Å
19G95.7Very high93.9Very high0 Ų054.2 Ų54.20%028%0.276CS..Hα-helixtrans-58.6-49.1175.300000111.8T15 L17 W21 L22 H23T15-G19 WeakPolarHBondContact O-CA 3.26Å; T15-G19 PolarHBondContact O-N 3.22Å; L17-G19 VanDerWaalsContact C-N 3.33Å; L17-G19 PolarHBondContact O-N 2.99Å; G19-W21 VanDerWaalsContact C-N 3.34Å; G19-W21 PolarHBondContact O-N 3.07Å; G19-L22 PolarHBondContact O-N 3.11Å; G19-H23 WeakPolarHBondContact O-CB 3.18Å; G19-H23 PolarHBondContact O-CD2 3.22Å; G19-H23 VanDerWaalsContact O-CD2 3.23Å; G19-H23 PolarHBondContact O-N 3.21Å
20L94.8Very high94Very high97 Ų9754.5 Ų54.551%0.50828%0.277SS..Hα-helixtrans-59.9-44.3178-17564.7000111.9G16 L17 H23 T24 L53G16-L20 WeakPolarHBondContact O-CB 3.13Å; G16-L20 PolarHBondContact O-N 2.87Å; L17-L20 PolarHBondContact O-N 2.81Å; L20-H23 PolarHBondContact O-N 3.4Å; L20-T24 WeakPolarHBondContact O-CB 3.31Å; L20-T24 PolarHBondContact O-N 2.97Å; L20-T24 PolarHBondContact O-OG1 3.36Å; L20-L53 HydrophobicContact CD1-CD2 4.18Å
21W95Very high93.7Very high149 Ų14951.5 Ų51.556%0.56427%0.274SS*.Hα-helixtrans-61.7-46.9176.7176.280.7000112.1L17 L18 G19 T24 K25L17-W21 PolarHBondContact O-N 3.2Å; L18-W21 PolarHBondContact O-N 3.32Å; G19-W21 VanDerWaalsContact C-N 3.34Å; G19-W21 PolarHBondContact O-N 3.07Å; W21-T24 PolarHBondContact O-N 3.25Å; W21-K25 PolarHBondContact O-N 3.23Å
22L96.4Very high93.4Very high17 Ų1755.7 Ų55.79%0.08929%0.289CS..Hα-helixtrans-61.6-44.5178.5-78.6175.6000112.1L18 G19 K25 N26 A263 F264 P266L18-L22 WeakPolarHBondContact O-CB 3.39Å; L18-L22 VanDerWaalsContact O-CG 3.29Å; L18-L22 WeakPolarHBondContact O-CG 3.5Å; L18-L22 PolarHBondContact O-N 3.01Å; G19-L22 PolarHBondContact O-N 3.11Å; L22-K25 PolarHBondContact O-N 3.42Å; L22-N26 WeakPolarHBondContact O-CB 3.48Å; L22-N26 PolarHBondContact O-N 3.04Å; L22-A263 WeakPolarHBondContact CD1-O 3.41Å; L22-F264 HydrophobicContact CD1-CD1 4.24Å; L22-F264 HydrophobicContact CD1-CG 4.26Å; L22-P266 HydrophobicContact CB-CB 3.95Å; L22-P266 HydrophobicContact CB-CG 4Å
23H95.8Very high93.2Very high2 Ų255.7 Ų55.71%0.00929%0.289CS..Hα-helixtrans-70.2-32.9178.9-82.7-79.7000112.8G19 L20 K25 N26 I27 C52 L53 I56 Q262 P266G19-H23 WeakPolarHBondContact O-CB 3.18Å; G19-H23 PolarHBondContact O-CD2 3.22Å; G19-H23 VanDerWaalsContact O-CD2 3.23Å; G19-H23 PolarHBondContact O-N 3.21Å; L20-H23 PolarHBondContact O-N 3.4Å; H23-K25 VanDerWaalsContact C-N 3.33Å; H23-K25 PolarHBondContact O-N 3.49Å; H23-N26 WeakPolarHBondContact O-CA 2.81Å; H23-N26 VanDerWaalsContact O-CB 3.23Å; H23-N26 WeakPolarHBondContact O-CB 3.41Å; H23-N26 PolarHBondContact O-N 3.12Å; H23-I27 PolarHBondContact O-N 3.13Å; H23-C52 WeakPolarHBondContact CE1-CB 3.13Å; H23-L53 HydrophobicContact CB-CD1 4.32Å; H23-L53 HydrophobicContact CB-CD2 3.47Å; H23-L53 VanDerWaalsContact CB-CD2 3.47Å; H23-L53 HydrophobicContact CB-CG 3.87Å; H23-I56 WeakPolarHBondContact CD2-CD1 3.5Å; H23-I56 WeakPolarHBondContact NE2-CD1 3.41Å; H23-Q262 PolarHBondContact NE2-O 3.17Å; H23-P266 HydrophobicContact CB-CG 4.45Å; H23-P266 VanDerWaalsContact CE1-CG 3.42Å; H23-P266 WeakPolarHBondContact CE1-CG 3.34Å; H23-P266 WeakPolarHBondContact NE2-CD 3.31Å; H23-P266 WeakPolarHBondContact NE2-CG 3.13Å
24T92.6Very high92.8Very high85 Ų8555.8 Ų55.852%0.52129%0.289SS..Hα-helixtrans-59.9-44.8172.1-57.50000111L20 W21 N26L20-T24 WeakPolarHBondContact O-CB 3.31Å; L20-T24 PolarHBondContact O-N 2.97Å; L20-T24 PolarHBondContact O-OG1 3.36Å; W21-T24 PolarHBondContact O-N 3.25Å; T24-N26 VanDerWaalsContact C-N 3.29Å; T24-N26 PolarHBondContact O-N 3.18Å
25K93.1Very high92.4Very high104 Ų10455.7 Ų55.745%0.45229%0.294SS..Hα-helixtrans-66.7-33173.1-63-60.9-176.3-176.10111.9W21 L22 H23 I27 S28W21-K25 PolarHBondContact O-N 3.23Å; L22-K25 PolarHBondContact O-N 3.42Å; H23-K25 VanDerWaalsContact C-N 3.33Å; H23-K25 PolarHBondContact O-N 3.49Å; K25-I27 VanDerWaalsContact C-N 3.26Å; K25-I27 PolarHBondContact O-N 3.09Å; K25-S28 PolarHBondContact O-N 3.49Å; K25-S28 PolarHBondContact O-OG 3.08Å
26N94.6Very high92.1Very high1 Ų155.3 Ų55.31%0.00529%0.292CS..Hα-helixtrans-60.9-32.3-178.3-160.437000113.3L22 H23 T24 S28 R29 L30 P266 Y269L22-N26 WeakPolarHBondContact O-CB 3.48Å; L22-N26 PolarHBondContact O-N 3.04Å; H23-N26 WeakPolarHBondContact O-CA 2.81Å; H23-N26 VanDerWaalsContact O-CB 3.23Å; H23-N26 WeakPolarHBondContact O-CB 3.41Å; H23-N26 PolarHBondContact O-N 3.12Å; T24-N26 VanDerWaalsContact C-N 3.29Å; T24-N26 PolarHBondContact O-N 3.18Å; N26-S28 VanDerWaalsContact C-N 3.28Å; N26-S28 PolarHBondContact O-N 2.88Å; N26-R29 CarbonylContact O-C 3.17Å; N26-R29 WeakPolarHBondContact O-CA 3.31Å; N26-R29 WeakPolarHBondContact O-CB 3.1Å; N26-R29 PolarHBondContact O-N 3.24Å; N26-L30 WeakPolarHBondContact O-CG 3.32Å; N26-L30 PolarHBondContact O-N 3.2Å; N26-P266 HydrophobicContact CB-CB 4Å; N26-P266 HydrophobicContact CB-CG 4.21Å; N26-Y269 VanDerWaalsContact ND2-CD2 3.34Å; N26-Y269 WeakPolarHBondContact ND2-CD2 3.45Å; N26-Y269 WeakPolarHBondContact OD1-CB 3.42Å; N26-Y269 WeakPolarHBondContact OD1-CD2 3.41Å
27I89.7Confident92Very high105 Ų10555.5 Ų55.554%0.53829%0.292SS..Hα-helixtrans-54.7-46178.3-63.2171.3000111.1H23 K25 R29 L30 A31H23-I27 PolarHBondContact O-N 3.13Å; K25-I27 VanDerWaalsContact C-N 3.26Å; K25-I27 PolarHBondContact O-N 3.09Å; I27-R29 VanDerWaalsContact C-N 3.3Å; I27-R29 PolarHBondContact O-N 2.91Å; I27-L30 PolarHBondContact O-N 3.09Å; I27-A31 PolarHBondContact O-N 2.93Å
28S88.4Confident91.7Very high65 Ų6550.8 Ų50.846%0.45527%0.268SS..Hα-helixtrans-66.3-32176.970.70000113K25 N26 A31 K32K25-S28 PolarHBondContact O-N 3.49Å; K25-S28 PolarHBondContact O-OG 3.08Å; N26-S28 VanDerWaalsContact C-N 3.28Å; N26-S28 PolarHBondContact O-N 2.88Å; S28-A31 PolarHBondContact O-N 2.88Å; S28-K32 PolarHBondContact O-N 2.69Å
29R93.4Very high90.9Very high35 Ų3557.7 Ų57.713%0.13229%0.291CS..Hα-helixtrans-72.4-40.5177.8-60.4179.3176.2140.82.5111.3N26 I27 A31 K32 I33 S270 E273N26-R29 CarbonylContact O-C 3.17Å; N26-R29 WeakPolarHBondContact O-CA 3.31Å; N26-R29 WeakPolarHBondContact O-CB 3.1Å; N26-R29 PolarHBondContact O-N 3.24Å; I27-R29 VanDerWaalsContact C-N 3.3Å; I27-R29 PolarHBondContact O-N 2.91Å; R29-A31 PolarHBondContact O-N 2.99Å; R29-K32 PolarHBondContact O-N 2.83Å; R29-I33 WeakPolarHBondContact O-CG2 3.45Å; R29-I33 PolarHBondContact O-N 2.59Å; R29-S270 PolarHBondContact NH2-OG 2.7Å; R29-E273 WeakPolarHBondContact CG-OE2 3.34Å; R29-E273 IonicContact NE-OE2 2.84Å; R29-E273 PolarHBondContact NE-OE2 2.86Å
30L93.1Very high90.2Very high5 Ų557.8 Ų57.83%0.02629%0.293CS..Hα-helixtrans-58.3-37.8175.1-70.4179.8000111.6N26 I27 I33 N34 H45 Y46 A49 Y269N26-L30 WeakPolarHBondContact O-CG 3.32Å; N26-L30 PolarHBondContact O-N 3.2Å; I27-L30 PolarHBondContact O-N 3.09Å; L30-I33 HydrophobicContact CD2-CD1 3.66Å; L30-I33 VanDerWaalsContact O-CG1 3.26Å; L30-I33 WeakPolarHBondContact O-CG1 3.23Å; L30-N34 PolarHBondContact O-N 3.3Å; L30-H45 HydrophobicContact CD2-CB 3.84Å; L30-Y46 HydrophobicContact CB-CD1 4.39Å; L30-Y46 HydrophobicContact CB-CE1 3.75Å; L30-Y46 HydrophobicContact CD1-CD1 3.62Å; L30-Y46 HydrophobicContact CD1-CE1 3.78Å; L30-Y46 HydrophobicContact CD1-CG 4.32Å; L30-Y46 HydrophobicContact CG-CE1 4.44Å; L30-A49 HydrophobicContact CD1-CB 3.91Å; L30-Y269 HydrophobicContact CD2-CD1 3.9Å; L30-Y269 HydrophobicContact CD2-CE1 3.6Å; L30-Y269 HydrophobicContact CD2-CE2 4.27Å; L30-Y269 HydrophobicContact CD2-CG 4.35Å
31A88.8Confident90.1Very high58 Ų5853.2 Ų53.248%0.47927%0.268SS..Hα-helixtrans-64.4-40.1173.800000112.3I27 S28 R29 N34I27-A31 PolarHBondContact O-N 2.93Å; S28-A31 PolarHBondContact O-N 2.88Å; R29-A31 PolarHBondContact O-N 2.99Å; A31-N34 VanDerWaalsContact O-CB 3.28Å; A31-N34 WeakPolarHBondContact O-CB 3.47Å
32K87.6Confident90Very high112 Ų11249.9 Ų49.949%0.48726%0.258SS..Hα-helixtrans-71.5-40.4179.2-69.2179.6-175.21790113.3S28 R29 N34 S35 E273S28-K32 PolarHBondContact O-N 2.69Å; R29-K32 PolarHBondContact O-N 2.83Å; K32-N34 PolarHBondContact O-N 2.95Å; K32-S35 PolarHBondContact O-N 3.18Å; K32-S35 PolarHBondContact O-OG 3.41Å; K32-S35 VanDerWaalsContact O-OG 3.07Å; K32-E273 HydrophobicContact CD-CG 4.01Å; K32-E273 VanDerWaalsContact CD-OE1 3.27Å; K32-E273 WeakPolarHBondContact CD-OE1 3.49Å; K32-E273 WeakPolarHBondContact CE-OE1 3.38Å; K32-E273 IonicContact NZ-OE1 2.7Å; K32-E273 PolarHBondContact NZ-OE1 3.24Å
33I90.4Very high89.9Confident0 Ų050.2 Ų50.20%026%0.261CS..Hα-helixtrans-67.1-19.6179.169177.4000112.7R29 L30 S35 I36 L37 L216 Y269 T272 I276R29-I33 WeakPolarHBondContact O-CG2 3.45Å; R29-I33 PolarHBondContact O-N 2.59Å; L30-I33 HydrophobicContact CD2-CD1 3.66Å; L30-I33 VanDerWaalsContact O-CG1 3.26Å; L30-I33 WeakPolarHBondContact O-CG1 3.23Å; I33-S35 PolarHBondContact O-N 2.61Å; I33-S35 VanDerWaalsContact O-N 3.07Å; I33-I36 WeakPolarHBondContact O-CG1 3.16Å; I33-I36 PolarHBondContact O-N 2.88Å; I33-L37 HydrophobicContact CD1-CD1 3.96Å; I33-L37 HydrophobicContact CG1-CD1 3.89Å; I33-L37 HydrophobicContact CG1-CG 4.42Å; I33-L37 WeakPolarHBondContact O-CG 3.46Å; I33-L37 PolarHBondContact O-N 2.89Å; I33-L216 HydrophobicContact CD1-CD2 4.41Å; I33-Y269 HydrophobicContact CD1-CD1 3.55Å; I33-Y269 HydrophobicContact CD1-CE1 3.6Å; I33-T272 HydrophobicContact CG2-CG2 3.95Å; I33-I276 HydrophobicContact CB-CD1 3.96Å; I33-I276 HydrophobicContact CG2-CD1 3.74Å
34N86.3Confident89.9Confident66 Ų6650.1 Ų50.135%0.35326%0.26SS..THydrogen-bonded Turntrans-56-26.5179.2-172.246.8000113L30 A31 K32 I36 K42L30-N34 PolarHBondContact O-N 3.3Å; A31-N34 VanDerWaalsContact O-CB 3.28Å; A31-N34 WeakPolarHBondContact O-CB 3.47Å; K32-N34 PolarHBondContact O-N 2.95Å; N34-I36 PolarHBondContact O-N 3.4Å; N34-K42 VanDerWaalsContact OD1-CB 3.24Å; N34-K42 WeakPolarHBondContact OD1-CB 3.47Å; N34-K42 WeakPolarHBondContact OD1-CD 3.4Å
35S84.9Confident90Very high69 Ų6946.1 Ų46.148%0.48324%0.236SC..THydrogen-bonded Turntrans-65.2-25.3176.463.10000113.7K32 I33K32-S35 PolarHBondContact O-N 3.18Å; K32-S35 PolarHBondContact O-OG 3.41Å; K32-S35 VanDerWaalsContact O-OG 3.07Å; I33-S35 PolarHBondContact O-N 2.61Å; I33-S35 VanDerWaalsContact O-N 3.07Å
36I89.8Confident90.1Very high0 Ų045.9 Ų45.90%023%0.233CC..THydrogen-bonded Turntrans-106.6-14.2-179.466.1158000113.5I33 N34 K209 I212 L213 T272 I276 W279I33-I36 WeakPolarHBondContact O-CG1 3.16Å; I33-I36 PolarHBondContact O-N 2.88Å; N34-I36 PolarHBondContact O-N 3.4Å; I36-K209 HydrophobicContact CB-CG 4.24Å; I36-K209 WeakPolarHBondContact O-CE 3.08Å; I36-K209 PolarHBondContact O-NZ 3.09Å; I36-I212 HydrophobicContact CD1-CB 4.3Å; I36-I212 HydrophobicContact CD1-CG2 3.49Å; I36-I212 VanDerWaalsContact CD1-CG2 3.49Å; I36-L213 HydrophobicContact CD1-CD2 4.07Å; I36-L213 HydrophobicContact CG1-CD2 4.37Å; I36-T272 HydrophobicContact CD1-CG2 4.19Å; I36-I276 HydrophobicContact CD1-CD1 3.55Å; I36-I276 HydrophobicContact CD1-CG1 3.73Å; I36-I276 HydrophobicContact CG1-CD1 3.65Å; I36-I276 HydrophobicContact CG1-CG1 4.15Å; I36-I276 HydrophobicContact CG2-CD1 4.21Å; I36-I276 HydrophobicContact CG2-CG1 4.03Å; I36-I276 HydrophobicContact CG2-CG2 4.48Å; I36-W279 HydrophobicContact CG2-CE3 4.4Å; I36-W279 HydrophobicContact CG2-CZ3 4.34Å
37L92.3Very high90.3Very high11 Ų1147.4 Ų47.46%0.05824%0.24CC..SBendtrans-74.2145.5179.7-68.3175.8000110.9I33 L41 K42 L213 L216I33-L37 HydrophobicContact CD1-CD1 3.96Å; I33-L37 HydrophobicContact CG1-CD1 3.89Å; I33-L37 HydrophobicContact CG1-CG 4.42Å; I33-L37 WeakPolarHBondContact O-CG 3.46Å; I33-L37 PolarHBondContact O-N 2.89Å; L37-L41 HydrophobicContact CB-CB 4.39Å; L37-L41 HydrophobicContact CD2-CB 4.48Å; L37-K42 HydrophobicContact CD1-CB 4.33Å; L37-L213 HydrophobicContact CD2-CD2 3.78Å; L37-L216 HydrophobicContact CD2-CD2 4.5Å
38P89Confident90.6Very high20 Ų2042.4 Ų42.413%0.1321%0.214CC..  trans-60.2150164.9-13.525.2000110.8G40 L41 E106P38-G40 PolarHBondContact O-N 3.44Å; P38-L41 HydrophobicContact CB-CD1 4.05Å; P38-L41 HydrophobicContact CG-CD1 4.15Å; P38-L41 HydrophobicContact CG-CD2 4.22Å; P38-L41 PolarHBondContact O-N 3.38Å; P38-E106 HydrophobicContact CB-CB 3.78Å; P38-E106 HydrophobicContact CB-CG 3.71Å; P38-E106 HydrophobicContact CG-CB 3.8Å; P38-E106 HydrophobicContact CG-CG 4.15Å
39Y77.1Confident91Very high210 Ų21039.7 Ų39.782%0.82420%0.196SC*.THydrogen-bonded Turntrans-47-32-164.1-174.7-104000115.7
40G81.7Confident91.2Very high3 Ų340.3 Ų40.33%0.03121%0.208CC..THydrogen-bonded Turntrans-97.4-14.8-178.800000116.9P38 K42 Y121P38-G40 PolarHBondContact O-N 3.44Å; G40-K42 VanDerWaalsContact C-N 3.35Å; G40-K42 PolarHBondContact O-N 3.39Å; G40-Y121 VanDerWaalsContact CA-CD1 3.49Å; G40-Y121 VanDerWaalsContact CA-CG 3.45Å
41L93.2Very high91.4Very high0 Ų040 Ų400%021%0.207CC..Hα-helixtrans-76.5-22-170-89.570.6000113.4L37 P38 T43 F44 H45 L102 T103 E106 Y121L37-L41 HydrophobicContact CB-CB 4.39Å; L37-L41 HydrophobicContact CD2-CB 4.48Å; P38-L41 HydrophobicContact CB-CD1 4.05Å; P38-L41 HydrophobicContact CG-CD1 4.15Å; P38-L41 HydrophobicContact CG-CD2 4.22Å; P38-L41 PolarHBondContact O-N 3.38Å; L41-T43 PolarHBondContact O-N 3.35Å; L41-F44 WeakPolarHBondContact O-CB 3.15Å; L41-F44 PolarHBondContact O-N 3.47Å; L41-F44 VanDerWaalsContact O-N 3.1Å; L41-H45 PolarHBondContact O-CD2 2.93Å; L41-H45 VanDerWaalsContact O-CD2 3.27Å; L41-H45 PolarHBondContact O-N 3.28Å; L41-L102 HydrophobicContact CD1-CB 3.95Å; L41-L102 HydrophobicContact CD2-CB 4.43Å; L41-L102 HydrophobicContact CG-CB 4.26Å; L41-T103 WeakPolarHBondContact CD2-OG1 3.34Å; L41-E106 HydrophobicContact CD1-CG 4.31Å; L41-Y121 HydrophobicContact CD1-CE1 3.89Å
42K92.5Very high91.9Very high79 Ų7937.3 Ų37.334%0.34318%0.184SC..Hα-helixtrans-52.9-43.8179.574.4-174.8-176.1-177.90112N34 L37 G40 F44 H45 Y46N34-K42 VanDerWaalsContact OD1-CB 3.24Å; N34-K42 WeakPolarHBondContact OD1-CB 3.47Å; N34-K42 WeakPolarHBondContact OD1-CD 3.4Å; L37-K42 HydrophobicContact CD1-CB 4.33Å; G40-K42 VanDerWaalsContact C-N 3.35Å; G40-K42 PolarHBondContact O-N 3.39Å; K42-F44 VanDerWaalsContact C-N 3.3Å; K42-F44 PolarHBondContact O-N 3.18Å; K42-H45 PolarHBondContact O-N 2.76Å; K42-Y46 WeakPolarHBondContact O-CD2 3.49Å; K42-Y46 PolarHBondContact O-N 3.47Å
43T92.9Very high92.3Very high24 Ų2434.6 Ų34.615%0.14717%0.174CC..Hα-helixtrans-62.4-40.6-176.9-50.10000110.3L41 H45 Y46 H47 N122 P125L41-T43 PolarHBondContact O-N 3.35Å; T43-H45 PolarHBondContact O-N 3.35Å; T43-Y46 PolarHBondContact O-N 3.3Å; T43-H47 PolarHBondContact O-CD2 3.19Å; T43-H47 PolarHBondContact O-N 3.39Å; T43-N122 PolarHBondContact OG1-OD1 2.92Å; T43-N122 VanDerWaalsContact OG1-OD1 3.09Å; T43-P125 HydrophobicContact CG2-CG 4.3Å
44F96.1Very high92.6Very high0 Ų035 Ų350%018%0.178CC..Hα-helixtrans-62.9-40.7177.5-72.3-103.1000112.6L41 K42 Y46 H47 L48 L95 F98 I99 L102 Y121 I124 P125 I128L41-F44 WeakPolarHBondContact O-CB 3.15Å; L41-F44 PolarHBondContact O-N 3.47Å; L41-F44 VanDerWaalsContact O-N 3.1Å; K42-F44 VanDerWaalsContact C-N 3.3Å; K42-F44 PolarHBondContact O-N 3.18Å; F44-Y46 VanDerWaalsContact C-N 3.33Å; F44-Y46 PolarHBondContact O-N 3.47Å; F44-H47 PolarHBondContact O-N 3.36Å; F44-L48 WeakPolarHBondContact O-CB 3.39Å; F44-L48 PolarHBondContact O-N 3.29Å; F44-L95 HydrophobicContact CD1-CD2 3.92Å; F44-F98 HydrophobicContact CD1-CD1 4.25Å; F44-F98 AromaticContact CE1-CD1 3.51Å; F44-F98 HydrophobicContact CE1-CD1 3.51Å; F44-F98 AromaticContact CE1-CE1 3.97Å; F44-F98 HydrophobicContact CE1-CE1 3.97Å; F44-F98 HydrophobicContact CZ-CD1 4.18Å; F44-F98 HydrophobicContact CZ-CE1 4.21Å; F44-I99 HydrophobicContact CB-CD1 3.98Å; F44-I99 HydrophobicContact CB-CG1 3.6Å; F44-I99 HydrophobicContact CD1-CG1 4.5Å; F44-I99 HydrophobicContact CG-CG1 4.38Å; F44-L102 HydrophobicContact CD1-CD1 4.04Å; F44-L102 HydrophobicContact CD2-CD1 4.09Å; F44-L102 HydrophobicContact CE1-CD1 3.62Å; F44-L102 HydrophobicContact CE2-CD1 3.7Å; F44-L102 HydrophobicContact CG-CD1 4.25Å; F44-L102 HydrophobicContact CZ-CD1 3.4Å; F44-L102 VanDerWaalsContact CZ-CD1 3.4Å; F44-Y121 AromaticContact CE2-CD1 3.78Å; F44-Y121 HydrophobicContact CE2-CD1 3.78Å; F44-Y121 WeakPolarHBondContact CE2-O 3.44Å; F44-I124 HydrophobicContact CE1-CB 4.46Å; F44-I124 HydrophobicContact CE1-CG2 3.89Å; F44-I124 HydrophobicContact CZ-CB 3.75Å; F44-I124 HydrophobicContact CZ-CG2 3.59Å; F44-P125 HydrophobicContact CD1-CG 4.04Å; F44-P125 HydrophobicContact CD2-CG 3.94Å; F44-P125 HydrophobicContact CE1-CG 3.87Å; F44-P125 HydrophobicContact CE2-CG 3.72Å; F44-P125 HydrophobicContact CG-CG 4.08Å; F44-P125 HydrophobicContact CZ-CG 3.73Å; F44-I128 HydrophobicContact CD1-CD1 4.26Å; F44-I128 HydrophobicContact CE1-CD1 3.82Å
45H96.1Very high93.1Very high1 Ų132 Ų321%0.00516%0.163CC..Hα-helixtrans-66.7-34.8177.2-73-80.2000112.5L30 L41 K42 T43 L48 A49 Y269L30-H45 HydrophobicContact CD2-CB 3.84Å; L41-H45 PolarHBondContact O-CD2 2.93Å; L41-H45 VanDerWaalsContact O-CD2 3.27Å; L41-H45 PolarHBondContact O-N 3.28Å; K42-H45 PolarHBondContact O-N 2.76Å; T43-H45 PolarHBondContact O-N 3.35Å; H45-L48 PolarHBondContact O-N 3.45Å; H45-A49 PolarHBondContact O-N 3.27Å; H45-Y269 HydrophobicContact CB-CE1 4.44Å; H45-Y269 AromaticContact ND1-CE1 3.38Å; H45-Y269 WeakPolarHBondContact ND1-CE1 3.34Å; H45-Y269 AromaticContact ND1-CZ 3.54Å; H45-Y269 PolarHBondContact ND1-OH 2.89Å
46Y95.3Very high93.6Very high100 Ų10029.1 Ų29.139%0.39214%0.142SC..Hα-helixtrans-65.7-44.9171.4-75.8-69.9000112.1L30 K42 T43 F44 L48 A49 A50L30-Y46 HydrophobicContact CB-CD1 4.39Å; L30-Y46 HydrophobicContact CB-CE1 3.75Å; L30-Y46 HydrophobicContact CD1-CD1 3.62Å; L30-Y46 HydrophobicContact CD1-CE1 3.78Å; L30-Y46 HydrophobicContact CD1-CG 4.32Å; L30-Y46 HydrophobicContact CG-CE1 4.44Å; K42-Y46 WeakPolarHBondContact O-CD2 3.49Å; K42-Y46 PolarHBondContact O-N 3.47Å; T43-Y46 PolarHBondContact O-N 3.3Å; F44-Y46 VanDerWaalsContact C-N 3.33Å; F44-Y46 PolarHBondContact O-N 3.47Å; Y46-L48 VanDerWaalsContact C-N 3.29Å; Y46-L48 PolarHBondContact O-N 3.34Å; Y46-A49 PolarHBondContact O-N 3.27Å; Y46-A50 PolarHBondContact O-N 3.04Å
47H97.1Very high93.8Very high32 Ų3232.2 Ų32.215%0.14817%0.168CC..Hα-helixtrans-63.3-35.8174.6-77.1-82.2000112.2T43 F44 A50 A51 L95 P125 W129T43-H47 PolarHBondContact O-CD2 3.19Å; T43-H47 PolarHBondContact O-N 3.39Å; F44-H47 PolarHBondContact O-N 3.36Å; H47-A50 PolarHBondContact O-N 3.34Å; H47-A51 PolarHBondContact O-N 3.46Å; H47-L95 HydrophobicContact CB-CD1 3.77Å; H47-L95 HydrophobicContact CB-CD2 4.12Å; H47-P125 HydrophobicContact CB-CB 4.23Å; H47-P125 WeakPolarHBondContact CD2-CB 3.36Å; H47-W129 AromaticContact CG-NE1 3.82Å; H47-W129 AromaticContact ND1-CD1 3.74Å; H47-W129 AromaticContact ND1-NE1 3.12Å; H47-W129 PolarHBondContact ND1-NE1 3.5Å; H47-W129 VanDerWaalsContact ND1-NE1 3.12Å
48L97.6Very high93.9Very high0 Ų032.8 Ų32.80%017%0.171CC..Hα-helixtrans-64.3-46.1176.4176.258.7000110.1F44 H45 Y46 A50 A51 C52 S92 L95 I99 I220 L265F44-L48 WeakPolarHBondContact O-CB 3.39Å; F44-L48 PolarHBondContact O-N 3.29Å; H45-L48 PolarHBondContact O-N 3.45Å; Y46-L48 VanDerWaalsContact C-N 3.29Å; Y46-L48 PolarHBondContact O-N 3.34Å; L48-A50 VanDerWaalsContact C-N 3.3Å; L48-A50 PolarHBondContact O-N 2.85Å; L48-A51 PolarHBondContact O-N 2.9Å; L48-C52 PolarHBondContact O-N 3.12Å; L48-C52 PolarHBondContact O-SG 3.4Å; L48-S92 WeakPolarHBondContact CD1-O 3.38Å; L48-L95 HydrophobicContact CB-CB 4.23Å; L48-L95 HydrophobicContact CB-CD1 4.33Å; L48-L95 HydrophobicContact CD1-CB 4.17Å; L48-I99 HydrophobicContact CB-CD1 4.36Å; L48-I99 HydrophobicContact CD2-CD1 3.92Å; L48-I220 HydrophobicContact CD2-CD1 4.34Å; L48-I220 HydrophobicContact CD2-CG2 3.7Å; L48-L265 HydrophobicContact CD2-CD2 4.39Å
49A96.8Very high94.2Very high9 Ų931.9 Ų31.97%0.07417%0.165CC..Hα-helixtrans-59.8-40.2174.500000112.1L30 H45 Y46 C52 L53L30-A49 HydrophobicContact CD1-CB 3.91Å; H45-A49 PolarHBondContact O-N 3.27Å; Y46-A49 PolarHBondContact O-N 3.27Å; A49-C52 PolarHBondContact O-N 3.16Å; A49-L53 WeakPolarHBondContact O-CB 3.31Å; A49-L53 WeakPolarHBondContact O-CG 3.4Å; A49-L53 PolarHBondContact O-N 2.93Å
50A97Very high94.9Very high47 Ų4724.1 Ų24.139%0.38814%0.14SC..Hα-helixtrans-63.1-43.2175.500000112.5Y46 H47 L48 L53 G54 W129Y46-A50 PolarHBondContact O-N 3.04Å; H47-A50 PolarHBondContact O-N 3.34Å; L48-A50 VanDerWaalsContact C-N 3.3Å; L48-A50 PolarHBondContact O-N 2.85Å; A50-L53 PolarHBondContact O-N 3.31Å; A50-G54 PolarHBondContact O-N 3.21Å; A50-W129 HydrophobicContact CB-CZ2 4.41Å
51A98Very high95.5Very high0 Ų028.2 Ų28.20%016%0.157CC..Hα-helixtrans-62.6-46.217500000111.5H47 L48 L53 G54 C55 F88 T91 L95 W129H47-A51 PolarHBondContact O-N 3.46Å; L48-A51 PolarHBondContact O-N 2.9Å; A51-L53 VanDerWaalsContact C-N 3.34Å; A51-L53 PolarHBondContact O-N 3.16Å; A51-G54 PolarHBondContact O-N 3.35Å; A51-G54 VanDerWaalsContact O-N 3.13Å; A51-C55 PolarHBondContact O-N 3.11Å; A51-C55 VanDerWaalsContact O-N 3.11Å; A51-F88 WeakPolarHBondContact O-CB 3.33Å; A51-T91 HydrophobicContact CB-CG2 3.96Å; A51-L95 HydrophobicContact CB-CD1 4.4Å; A51-W129 HydrophobicContact CB-CH2 4.07Å; A51-W129 HydrophobicContact CB-CZ2 4.09Å
52C97.4Very high95.5Very high0 Ų028.2 Ų28.20%016%0.157CC..Hα-helixtrans-60-43.1175.5-61.10000112.1H23 L48 A49 G54 C55 I56 Q262H23-C52 WeakPolarHBondContact CE1-CB 3.13Å; L48-C52 PolarHBondContact O-N 3.12Å; L48-C52 PolarHBondContact O-SG 3.4Å; A49-C52 PolarHBondContact O-N 3.16Å; C52-G54 VanDerWaalsContact C-N 3.29Å; C52-G54 PolarHBondContact O-N 3.47Å; C52-C55 WeakPolarHBondContact O-CB 3.45Å; C52-C55 PolarHBondContact O-N 3.45Å; C52-I56 WeakPolarHBondContact O-CD1 3.48Å; C52-I56 VanDerWaalsContact O-CG1 3.29Å; C52-I56 WeakPolarHBondContact O-CG1 3.48Å; C52-I56 PolarHBondContact O-N 2.98Å; C52-Q262 HydrophobicContact CB-CB 4.37Å; C52-Q262 PolarHBondContact SG-OE1 3.28Å
53L96.7Very high95.6Very high55 Ų5524.4 Ų24.429%0.28814%0.141SC..Hα-helixtrans-60.6-38.4175.2-83169.5000111.9L20 H23 A49 A50 A51 I56 A57L20-L53 HydrophobicContact CD1-CD2 4.18Å; H23-L53 HydrophobicContact CB-CD1 4.32Å; H23-L53 HydrophobicContact CB-CD2 3.47Å; H23-L53 VanDerWaalsContact CB-CD2 3.47Å; H23-L53 HydrophobicContact CB-CG 3.87Å; A49-L53 WeakPolarHBondContact O-CB 3.31Å; A49-L53 WeakPolarHBondContact O-CG 3.4Å; A49-L53 PolarHBondContact O-N 2.93Å; A50-L53 PolarHBondContact O-N 3.31Å; A51-L53 VanDerWaalsContact C-N 3.34Å; A51-L53 PolarHBondContact O-N 3.16Å; L53-I56 PolarHBondContact O-N 3.1Å; L53-A57 WeakPolarHBondContact O-CB 3.26Å; L53-A57 PolarHBondContact O-N 3.31Å
54G96.9Very high95.6Very high8 Ų826.4 Ų26.48%0.08215%0.15CC..Hα-helixtrans-59.3-46.4172.700000112.8A50 A51 C52 I56 A57 I58 F88A50-G54 PolarHBondContact O-N 3.21Å; A51-G54 PolarHBondContact O-N 3.35Å; A51-G54 VanDerWaalsContact O-N 3.13Å; C52-G54 VanDerWaalsContact C-N 3.29Å; C52-G54 PolarHBondContact O-N 3.47Å; G54-I56 VanDerWaalsContact C-N 3.25Å; G54-I56 PolarHBondContact O-N 2.96Å; G54-A57 PolarHBondContact O-N 2.99Å; G54-I58 PolarHBondContact O-N 3.49Å; G54-F88 VanDerWaalsContact CA-CD2 3.46Å
55C96.1Very high95.5Very high5 Ų526.4 Ų26.43%0.03415%0.15CC..Hα-helixtrans-58.6-37.2173.8-71.40000112.6A51 C52 I58 T59 F88 Q262A51-C55 PolarHBondContact O-N 3.11Å; A51-C55 VanDerWaalsContact O-N 3.11Å; C52-C55 WeakPolarHBondContact O-CB 3.45Å; C52-C55 PolarHBondContact O-N 3.45Å; C55-I58 VanDerWaalsContact O-CG1 3.28Å; C55-I58 WeakPolarHBondContact O-CG1 3.08Å; C55-T59 PolarHBondContact O-OG1 3.42Å; C55-F88 WeakPolarHBondContact SG-CB 3.43Å; C55-Q262 HydrophobicContact CB-CB 4.02Å; C55-Q262 HydrophobicContact CB-CG 3.99Å
56I95.8Very high95.4Very high7 Ų726.4 Ų26.44%0.03615%0.15CC..Hα-helixtrans-73.7-42.8179.6-65.9159.5000110.8G16 H23 C52 L53 G54 I58 T59 P60 A263G16-I56 WeakPolarHBondContact O-CG2 3.44Å; H23-I56 WeakPolarHBondContact CD2-CD1 3.5Å; H23-I56 WeakPolarHBondContact NE2-CD1 3.41Å; C52-I56 WeakPolarHBondContact O-CD1 3.48Å; C52-I56 VanDerWaalsContact O-CG1 3.29Å; C52-I56 WeakPolarHBondContact O-CG1 3.48Å; C52-I56 PolarHBondContact O-N 2.98Å; L53-I56 PolarHBondContact O-N 3.1Å; G54-I56 VanDerWaalsContact C-N 3.25Å; G54-I56 PolarHBondContact O-N 2.96Å; I56-I58 PolarHBondContact O-N 3.41Å; I56-T59 VanDerWaalsContact O-CB 3.25Å; I56-T59 WeakPolarHBondContact O-CB 3.35Å; I56-T59 PolarHBondContact O-N 3.22Å; I56-P60 WeakPolarHBondContact O-CD 3.35Å; I56-A263 HydrophobicContact CD1-CB 4.27Å; I56-A263 HydrophobicContact CG1-CB 4.22Å
57A94.8Very high95.3Very high66 Ų6625.9 Ų25.955%0.54515%0.148SC..Hα-helixtrans-58.7-33.5-177.800000113L53 G54 P60L53-A57 WeakPolarHBondContact O-CB 3.26Å; L53-A57 PolarHBondContact O-N 3.31Å; G54-A57 PolarHBondContact O-N 2.99Å; A57-P60 WeakPolarHBondContact O-CD 3.47Å
58I94.8Very high95.1Very high22 Ų2230.1 Ų30.111%0.11317%0.168CC..THydrogen-bonded Turntrans-83.5-14.4177.365.3171000113.5G54 C55 I56 F61 Y81 A84 G85G54-I58 PolarHBondContact O-N 3.49Å; C55-I58 VanDerWaalsContact O-CG1 3.28Å; C55-I58 WeakPolarHBondContact O-CG1 3.08Å; I56-I58 PolarHBondContact O-N 3.41Å; I58-F61 WeakPolarHBondContact O-CB 3.37Å; I58-F61 WeakPolarHBondContact O-CD2 3.41Å; I58-F61 PolarHBondContact O-N 3.28Å; I58-Y81 HydrophobicContact CB-CD2 4.15Å; I58-Y81 HydrophobicContact CB-CE2 4.09Å; I58-Y81 HydrophobicContact CD1-CD2 4.46Å; I58-Y81 HydrophobicContact CD1-CE2 4.16Å; I58-Y81 HydrophobicContact CG1-CE2 4.22Å; I58-Y81 WeakPolarHBondContact O-CE2 3.33Å; I58-A84 HydrophobicContact CD1-CB 4.38Å; I58-A84 HydrophobicContact CG2-CB 3.87Å; I58-G85 VanDerWaalsContact CD1-CA 3.42Å
59T94.1Very high94.8Very high1 Ų135.4 Ų35.41%0.00619%0.19CC..Hα-helixtrans-61.7-37.6-174.7-660000115.2F12 C55 I56 F61 S62 A63 K259F12-T59 HydrophobicContact CB-CG2 3.99Å; F12-T59 HydrophobicContact CD1-CG2 4.04Å; F12-T59 HydrophobicContact CG-CG2 4.45Å; F12-T59 WeakPolarHBondContact O-CG2 3.35Å; C55-T59 PolarHBondContact O-OG1 3.42Å; I56-T59 VanDerWaalsContact O-CB 3.25Å; I56-T59 WeakPolarHBondContact O-CB 3.35Å; I56-T59 PolarHBondContact O-N 3.22Å; T59-F61 PolarHBondContact O-N 2.83Å; T59-F61 VanDerWaalsContact O-N 3.16Å; T59-S62 WeakPolarHBondContact O-CB 3.38Å; T59-S62 PolarHBondContact O-N 3.1Å; T59-S62 VanDerWaalsContact O-N 3.12Å; T59-S62 PolarHBondContact O-OG 2.97Å; T59-A63 PolarHBondContact O-N 3.41Å; T59-K259 HydrophobicContact CG2-CD 3.74Å; T59-K259 VanDerWaalsContact OG1-CD 3.29Å; T59-K259 WeakPolarHBondContact OG1-CD 3.45Å; T59-K259 WeakPolarHBondContact OG1-CG 3.24Å; T59-K259 PolarHBondContact OG1-NZ 3.43Å
60P93.3Very high94.6Very high47 Ų4736 Ų3631%0.30520%0.197SC..Hα-helixtrans-56.4-29.5175.1-28.236.5000114.1I56 A57 S62 A63 I64I56-P60 WeakPolarHBondContact O-CD 3.35Å; A57-P60 WeakPolarHBondContact O-CD 3.47Å; P60-S62 VanDerWaalsContact C-N 3.34Å; P60-S62 PolarHBondContact O-N 3.25Å; P60-A63 WeakPolarHBondContact O-CB 3.44Å; P60-A63 PolarHBondContact O-N 3.16Å; P60-A63 VanDerWaalsContact O-N 3.15Å; P60-I64 WeakPolarHBondContact O-CG1 3.3Å; P60-I64 PolarHBondContact O-N 3.21Å
61F94.3Very high94.5Very high89 Ų8935.1 Ų35.139%0.3918%0.184SC..Hα-helixtrans-64.9-38.1178.3-66.1-99.1000111.9I58 T59 A63 I64 G65 W71 F73 Y81I58-F61 WeakPolarHBondContact O-CB 3.37Å; I58-F61 WeakPolarHBondContact O-CD2 3.41Å; I58-F61 PolarHBondContact O-N 3.28Å; T59-F61 PolarHBondContact O-N 2.83Å; T59-F61 VanDerWaalsContact O-N 3.16Å; F61-A63 VanDerWaalsContact C-N 3.32Å; F61-A63 PolarHBondContact O-N 3.16Å; F61-I64 PolarHBondContact O-N 3.17Å; F61-G65 PolarHBondContact O-N 3.27Å; F61-W71 HydrophobicContact CB-CH2 3.95Å; F61-W71 HydrophobicContact CB-CZ3 4.21Å; F61-F73 HydrophobicContact CB-CE2 3.99Å; F61-F73 HydrophobicContact CB-CZ 4.48Å; F61-F73 HydrophobicContact CD1-CD1 4.28Å; F61-F73 HydrophobicContact CD1-CD2 4.08Å; F61-F73 AromaticContact CD1-CE1 3.88Å; F61-F73 HydrophobicContact CD1-CE1 3.88Å; F61-F73 AromaticContact CD1-CE2 3.66Å; F61-F73 HydrophobicContact CD1-CE2 3.66Å; F61-F73 HydrophobicContact CD1-CG 4.37Å; F61-F73 AromaticContact CD1-CZ 3.54Å; F61-F73 HydrophobicContact CD1-CZ 3.54Å; F61-F73 HydrophobicContact CE1-CE1 4.14Å; F61-F73 HydrophobicContact CE1-CZ 4.21Å; F61-F73 HydrophobicContact CG-CE2 4.3Å; F61-F73 HydrophobicContact CG-CZ 4.4Å; F61-Y81 HydrophobicContact CB-CD2 4.07Å; F61-Y81 HydrophobicContact CB-CE2 4.3Å
62S92.9Very high94.5Very high0 Ų037.7 Ų37.70%020%0.201CC..Hα-helixtrans-63.1-41172.9-37.20000111.2T59 P60 G65 V66 Y81T59-S62 WeakPolarHBondContact O-CB 3.38Å; T59-S62 PolarHBondContact O-N 3.1Å; T59-S62 VanDerWaalsContact O-N 3.12Å; T59-S62 PolarHBondContact O-OG 2.97Å; P60-S62 VanDerWaalsContact C-N 3.34Å; P60-S62 PolarHBondContact O-N 3.25Å; S62-G65 PolarHBondContact O-N 3.12Å; S62-V66 WeakPolarHBondContact O-CG2 3.42Å; S62-V66 PolarHBondContact O-N 3.43Å; S62-Y81 PolarHBondContact OG-OH 2.98Å
63A93.4Very high94.5Very high0 Ų041 Ų410%022%0.215CC..Hα-helixtrans-63.4-45.8177.500000111.8G9 F12 L13 T59 P60 F61 G65 V66 Y67G9-A63 WeakPolarHBondContact O-CB 3.46Å; F12-A63 HydrophobicContact CB-CB 3.8Å; L13-A63 HydrophobicContact CD2-CB 3.65Å; L13-A63 HydrophobicContact CG-CB 3.6Å; T59-A63 PolarHBondContact O-N 3.41Å; P60-A63 WeakPolarHBondContact O-CB 3.44Å; P60-A63 PolarHBondContact O-N 3.16Å; P60-A63 VanDerWaalsContact O-N 3.15Å; F61-A63 VanDerWaalsContact C-N 3.32Å; F61-A63 PolarHBondContact O-N 3.16Å; A63-G65 VanDerWaalsContact C-N 3.29Å; A63-G65 PolarHBondContact O-N 3.07Å; A63-V66 WeakPolarHBondContact O-CB 3.43Å; A63-V66 PolarHBondContact O-N 3.45Å; A63-V66 VanDerWaalsContact O-N 3.08Å; A63-Y67 HydrophobicContact CB-CD2 4.49Å; A63-Y67 HydrophobicContact CB-CE2 4.36Å; A63-Y67 WeakPolarHBondContact O-CD2 3.32Å; A63-Y67 PolarHBondContact O-N 3.43Å
64I94.4Very high94.5Very high65 Ų6540.5 Ų40.533%0.33322%0.223SC..Hα-helixtrans-57.6-46.1175.8-66.5165.2000109.9P60 F61 V66 Y67 Q68 P72 F73P60-I64 WeakPolarHBondContact O-CG1 3.3Å; P60-I64 PolarHBondContact O-N 3.21Å; F61-I64 PolarHBondContact O-N 3.17Å; I64-V66 VanDerWaalsContact C-N 3.27Å; I64-V66 PolarHBondContact O-N 2.82Å; I64-Y67 PolarHBondContact O-N 2.99Å; I64-Q68 HydrophobicContact CG2-CG 4.24Å; I64-Q68 WeakPolarHBondContact O-CB 3.46Å; I64-Q68 WeakPolarHBondContact O-CG 3.46Å; I64-Q68 PolarHBondContact O-N 2.93Å; I64-P72 HydrophobicContact CG2-CG 4.08Å; I64-F73 HydrophobicContact CB-CE2 4.31Å; I64-F73 HydrophobicContact CB-CZ 4.07Å; I64-F73 HydrophobicContact CD1-CZ 3.96Å; I64-F73 HydrophobicContact CG2-CE2 4.18Å; I64-F73 HydrophobicContact CG2-CZ 3.77Å
65G93.9Very high94.5Very high0 Ų047 Ų470%025%0.251CS..Hα-helixtrans-57.9-39.3175.800000112.9F61 S62 A63 K69 G70 T153F61-G65 PolarHBondContact O-N 3.27Å; S62-G65 PolarHBondContact O-N 3.12Å; A63-G65 VanDerWaalsContact C-N 3.29Å; A63-G65 PolarHBondContact O-N 3.07Å; G65-K69 PolarHBondContact O-N 2.99Å; G65-G70 WeakPolarHBondContact CA-O 3.48Å; G65-G70 PolarHBondContact O-N 2.96Å; G65-G70 VanDerWaalsContact O-O 3.1Å; G65-T153 WeakPolarHBondContact O-CG2 3.36Å
66V92.8Very high94.6Very high1 Ų154.7 Ų54.71%0.00628%0.284CS..Hα-helixtrans-65.9-46.7176.1172.10000111.9T5 F12 S62 A63 I64 Q68 K69 T153T5-V66 WeakPolarHBondContact O-CG1 3.47Å; F12-V66 HydrophobicContact CD2-CG2 4.31Å; F12-V66 HydrophobicContact CE2-CG2 4.23Å; S62-V66 WeakPolarHBondContact O-CG2 3.42Å; S62-V66 PolarHBondContact O-N 3.43Å; A63-V66 WeakPolarHBondContact O-CB 3.43Å; A63-V66 PolarHBondContact O-N 3.45Å; A63-V66 VanDerWaalsContact O-N 3.08Å; I64-V66 VanDerWaalsContact C-N 3.27Å; I64-V66 PolarHBondContact O-N 2.82Å; V66-Q68 VanDerWaalsContact C-N 3.34Å; V66-Q68 PolarHBondContact O-N 3.02Å; V66-K69 PolarHBondContact O-N 3.03Å; V66-K69 VanDerWaalsContact O-N 3.1Å; V66-T153 HydrophobicContact CB-CG2 4.48Å; V66-T153 HydrophobicContact CG2-CG2 4.07Å; V66-T153 WeakPolarHBondContact CG2-OG1 3.29Å
67Y93Very high94.6Very high89 Ų8955.1 Ų55.135%0.34929%0.29SS..Hα-helixtrans-67.2-34.2179.5-72.6-63.3000112.8Y6 F10 L13 A63 I64 K69Y6-Y67 AromaticContact CD1-CD1 3.75Å; Y6-Y67 HydrophobicContact CD1-CD1 3.75Å; Y6-Y67 HydrophobicContact CD1-CE1 4.02Å; Y6-Y67 HydrophobicContact CE1-CD1 4.27Å; F10-Y67 VanDerWaalsContact CA-OH 3.29Å; F10-Y67 WeakPolarHBondContact CA-OH 3.43Å; F10-Y67 PolarHBondContact N-OH 3.38Å; L13-Y67 HydrophobicContact CD1-CE2 3.6Å; L13-Y67 HydrophobicContact CG-CE2 4.22Å; A63-Y67 HydrophobicContact CB-CD2 4.49Å; A63-Y67 HydrophobicContact CB-CE2 4.36Å; A63-Y67 WeakPolarHBondContact O-CD2 3.32Å; A63-Y67 PolarHBondContact O-N 3.43Å; I64-Y67 PolarHBondContact O-N 2.99Å; Y67-K69 PolarHBondContact O-N 3.17Å
68Q93.2Very high94.8Very high122 Ų12252.2 Ų52.257%0.5727%0.266SS*.THydrogen-bonded Turntrans-81.3-1173.7-64.7-161.912.800113.5I64 V66 G70I64-Q68 HydrophobicContact CG2-CG 4.24Å; I64-Q68 WeakPolarHBondContact O-CB 3.46Å; I64-Q68 WeakPolarHBondContact O-CG 3.46Å; I64-Q68 PolarHBondContact O-N 2.93Å; V66-Q68 VanDerWaalsContact C-N 3.34Å; V66-Q68 PolarHBondContact O-N 3.02Å; Q68-G70 PolarHBondContact O-N 3.23Å
69K90.6Very high95Very high110 Ų11052.5 Ų52.548%0.47827%0.267SS..THydrogen-bonded Turntrans58.328.3-179.8-58.6175.9-177.4169.90113.8L2 Y6 G65 V66 Y67L2-K69 HydrophobicContact CD1-CB 4.1Å; L2-K69 HydrophobicContact CD1-CD 4.47Å; L2-K69 HydrophobicContact CD1-CG 4.48Å; L2-K69 HydrophobicContact CD2-CB 4.33Å; Y6-K69 WeakPolarHBondContact OH-CE 3.41Å; Y6-K69 PolarHBondContact OH-NZ 3.22Å; G65-K69 PolarHBondContact O-N 2.99Å; V66-K69 PolarHBondContact O-N 3.03Å; V66-K69 VanDerWaalsContact O-N 3.1Å; Y67-K69 PolarHBondContact O-N 3.17Å
70G93.3Very high95.1Very high21 Ų2154.7 Ų54.722%0.21628%0.282CS..SBendtrans172.3156.4-177.900000110.6G65 Q68 P72 K152G65-G70 WeakPolarHBondContact CA-O 3.48Å; G65-G70 PolarHBondContact O-N 2.96Å; G65-G70 VanDerWaalsContact O-O 3.1Å; Q68-G70 PolarHBondContact O-N 3.23Å; G70-P72 VanDerWaalsContact O-CD 3.23Å; G70-P72 WeakPolarHBondContact O-CD 3.42Å; G70-K152 CarbonylContact C-O 3.56Å; G70-K152 WeakPolarHBondContact CA-O 3.2Å
71W95.9Very high95.4Very high30 Ų3053.2 Ų53.211%0.11427%0.27CS..  trans-72.2115.4176.8-175.5-105.2000111.6F61 F73 G74 G77 Y81 L148 K152F61-W71 HydrophobicContact CB-CH2 3.95Å; F61-W71 HydrophobicContact CB-CZ3 4.21Å; W71-F73 AromaticContact CD2-CD2 3.97Å; W71-F73 HydrophobicContact CD2-CD2 3.97Å; W71-F73 AromaticContact CE2-CD2 3.69Å; W71-F73 HydrophobicContact CE3-CD2 4.03Å; W71-F73 HydrophobicContact CE3-CE2 4.49Å; W71-F73 AromaticContact CH2-CD2 3.64Å; W71-F73 HydrophobicContact CH2-CD2 3.64Å; W71-F73 HydrophobicContact CH2-CE2 4.2Å; W71-F73 HydrophobicContact CZ2-CB 3.92Å; W71-F73 AromaticContact CZ2-CD2 3.53Å; W71-F73 HydrophobicContact CZ2-CD2 3.53Å; W71-F73 HydrophobicContact CZ2-CG 4.14Å; W71-F73 AromaticContact CZ3-CD2 3.88Å; W71-F73 HydrophobicContact CZ3-CD2 3.88Å; W71-F73 HydrophobicContact CZ3-CE2 4.18Å; W71-G74 PolarHBondContact NE1-O 3Å; W71-G74 VanDerWaalsContact NE1-O 3.17Å; W71-G77 WeakPolarHBondContact CZ2-O 3.33Å; W71-Y81 HydrophobicContact CH2-CD1 4.23Å; W71-Y81 AromaticContact CH2-CD2 3.7Å; W71-Y81 HydrophobicContact CH2-CD2 3.7Å; W71-Y81 HydrophobicContact CH2-CE2 4.44Å; W71-Y81 AromaticContact CH2-CG 3.59Å; W71-Y81 HydrophobicContact CH2-CG 3.59Å; W71-Y81 HydrophobicContact CZ2-CG 4.17Å; W71-Y81 HydrophobicContact CZ3-CD2 4.38Å; W71-Y81 HydrophobicContact CZ3-CG 4.39Å; W71-L148 HydrophobicContact CB-CD2 3.69Å; W71-L148 HydrophobicContact CB-CG 4.47Å; W71-K152 PolarHBondContact N-O 3.32Å
72P96.6Very high95.5Very high53 Ų5349 Ų4934%0.34425%0.252SS..  trans-96.8-7.4-17237.6-34.8000114.3I64 G70 G74I64-P72 HydrophobicContact CG2-CG 4.08Å; G70-P72 VanDerWaalsContact O-CD 3.23Å; G70-P72 WeakPolarHBondContact O-CD 3.42Å; P72-G74 PolarHBondContact O-N 2.89Å
73F97.3Very high95.8Very high71 Ų7151.6 Ų51.631%0.31126%0.263SS..SBendtrans-87.814.4-172.2-51.8-75.8000113.7F61 I64 W71 G77F61-F73 HydrophobicContact CB-CE2 3.99Å; F61-F73 HydrophobicContact CB-CZ 4.48Å; F61-F73 HydrophobicContact CD1-CD1 4.28Å; F61-F73 HydrophobicContact CD1-CD2 4.08Å; F61-F73 AromaticContact CD1-CE1 3.88Å; F61-F73 HydrophobicContact CD1-CE1 3.88Å; F61-F73 AromaticContact CD1-CE2 3.66Å; F61-F73 HydrophobicContact CD1-CE2 3.66Å; F61-F73 HydrophobicContact CD1-CG 4.37Å; F61-F73 AromaticContact CD1-CZ 3.54Å; F61-F73 HydrophobicContact CD1-CZ 3.54Å; F61-F73 HydrophobicContact CE1-CE1 4.14Å; F61-F73 HydrophobicContact CE1-CZ 4.21Å; F61-F73 HydrophobicContact CG-CE2 4.3Å; F61-F73 HydrophobicContact CG-CZ 4.4Å; I64-F73 HydrophobicContact CB-CE2 4.31Å; I64-F73 HydrophobicContact CB-CZ 4.07Å; I64-F73 HydrophobicContact CD1-CZ 3.96Å; I64-F73 HydrophobicContact CG2-CE2 4.18Å; I64-F73 HydrophobicContact CG2-CZ 3.77Å; W71-F73 AromaticContact CD2-CD2 3.97Å; W71-F73 HydrophobicContact CD2-CD2 3.97Å; W71-F73 AromaticContact CE2-CD2 3.69Å; W71-F73 HydrophobicContact CE3-CD2 4.03Å; W71-F73 HydrophobicContact CE3-CE2 4.49Å; W71-F73 AromaticContact CH2-CD2 3.64Å; W71-F73 HydrophobicContact CH2-CD2 3.64Å; W71-F73 HydrophobicContact CH2-CE2 4.2Å; W71-F73 HydrophobicContact CZ2-CB 3.92Å; W71-F73 AromaticContact CZ2-CD2 3.53Å; W71-F73 HydrophobicContact CZ2-CD2 3.53Å; W71-F73 HydrophobicContact CZ2-CG 4.14Å; W71-F73 AromaticContact CZ3-CD2 3.88Å; W71-F73 HydrophobicContact CZ3-CD2 3.88Å; W71-F73 HydrophobicContact CZ3-CE2 4.18Å; F73-G77 WeakPolarHBondContact O-CA 3.36Å; F73-G77 PolarHBondContact O-N 3.37Å; F73-G77 VanDerWaalsContact O-N 3.15Å
74G97.1Very high96Very high44 Ų4452.3 Ų52.345%0.45427%0.269SS..Hα-helixtrans62-171-179.700000114.2W71 P72 C78W71-G74 PolarHBondContact NE1-O 3Å; W71-G74 VanDerWaalsContact NE1-O 3.17Å; P72-G74 PolarHBondContact O-N 2.89Å; G74-C78 WeakPolarHBondContact O-CB 3.41Å; G74-C78 PolarHBondContact O-N 2.95Å; G74-C78 VanDerWaalsContact O-N 3.08Å
75H96.8Very high96.1Very high143 Ų14349.9 Ų49.966%0.66226%0.26SS*.Hα-helixtrans-65.8-45.9-178.2-177.277.7000112.2G77 C78 Q79H75-G77 PolarHBondContact O-N 3.42Å; H75-C78 VanDerWaalsContact O-CB 3.25Å; H75-C78 WeakPolarHBondContact O-CB 3.45Å; H75-C78 PolarHBondContact O-N 3.07Å; H75-C78 VanDerWaalsContact O-N 3.13Å; H75-Q79 PolarHBondContact CE1-NE2 2.98Å; H75-Q79 VanDerWaalsContact CE1-NE2 3.33Å; H75-Q79 WeakPolarHBondContact O-CG 3.38Å; H75-Q79 PolarHBondContact O-N 3.39Å
76F97.5Very high96.3Very high168 Ų16850.8 Ų50.874%0.73727%0.265SS*.Hα-helixtrans-58.3-48.7178178.1-98.1000111.7C78 Q79 S80F76-C78 PolarHBondContact O-N 3.03Å; F76-Q79 PolarHBondContact O-N 3.27Å; F76-S80 PolarHBondContact O-N 3.33Å; F76-S80 PolarHBondContact O-OG 2.86Å; F76-S80 VanDerWaalsContact O-OG 3.11Å
77G97.7Very high96.5Very high15 Ų1551.9 Ų51.916%0.15527%0.27CS..Hα-helixtrans-60.5-36.1177.100000112.6W71 F73 H75 Y81W71-G77 WeakPolarHBondContact CZ2-O 3.33Å; F73-G77 WeakPolarHBondContact O-CA 3.36Å; F73-G77 PolarHBondContact O-N 3.37Å; F73-G77 VanDerWaalsContact O-N 3.15Å; H75-G77 PolarHBondContact O-N 3.42Å; G77-Y81 WeakPolarHBondContact O-CB 3.38Å; G77-Y81 PolarHBondContact O-N 3.28Å
78C97.9Very high96.8Very high5 Ų549.8 Ų49.83%0.03426%0.263CS..Hα-helixtrans-61.6-49.2175-174.60000111.6G74 H75 F76 Y81 S82 C155G74-C78 WeakPolarHBondContact O-CB 3.41Å; G74-C78 PolarHBondContact O-N 2.95Å; G74-C78 VanDerWaalsContact O-N 3.08Å; H75-C78 VanDerWaalsContact O-CB 3.25Å; H75-C78 WeakPolarHBondContact O-CB 3.45Å; H75-C78 PolarHBondContact O-N 3.07Å; H75-C78 VanDerWaalsContact O-N 3.13Å; F76-C78 PolarHBondContact O-N 3.03Å; C78-Y81 PolarHBondContact O-N 3.35Å; C78-S82 PolarHBondContact O-N 2.84Å; C78-S82 PolarHBondContact O-OG 3.15Å; C78-S82 VanDerWaalsContact O-OG 3.1Å; C78-C155 WeakPolarHBondContact CA-SG 3.37Å; C78-C155 HydrophobicContact CB-CB 3.97Å; C78-C155 WeakPolarHBondContact CB-SG 3.49Å; C78-C155 WeakPolarHBondContact SG-CB 3.4Å; C78-C155 CovalentContact SG-SG 2.02Å; C78-C155 PolarHBondContact SG-SG 3.44Å
79Q98.2Very high97Very high29 Ų2944 Ų4414%0.13624%0.236CC..Hα-helixtrans-62.2-47.2177.4-63-57.4-46.200111.6H75 F76 Y81 S82 F83 L140 Y146H75-Q79 PolarHBondContact CE1-NE2 2.98Å; H75-Q79 VanDerWaalsContact CE1-NE2 3.33Å; H75-Q79 WeakPolarHBondContact O-CG 3.38Å; H75-Q79 PolarHBondContact O-N 3.39Å; F76-Q79 PolarHBondContact O-N 3.27Å; Q79-Y81 PolarHBondContact O-N 3.41Å; Q79-S82 PolarHBondContact O-N 3.5Å; Q79-F83 VanDerWaalsContact O-CB 3.26Å; Q79-F83 WeakPolarHBondContact O-CB 3.39Å; Q79-F83 PolarHBondContact O-N 3.03Å; Q79-L140 HydrophobicContact CB-CD2 4.04Å; Q79-L140 HydrophobicContact CG-CD2 4.49Å; Q79-L140 VanDerWaalsContact OE1-CD2 3.25Å; Q79-Y146 PolarHBondContact NE2-O 3.37Å
80S98Very high97.3Very high47 Ų4739 Ų3933%0.32922%0.215SC..Hα-helixtrans-63.9-40179.3-56.40000112.7F76 A84F76-S80 PolarHBondContact O-N 3.33Å; F76-S80 PolarHBondContact O-OG 2.86Å; F76-S80 VanDerWaalsContact O-OG 3.11Å; S80-A84 VanDerWaalsContact O-CB 3.31Å; S80-A84 WeakPolarHBondContact O-CB 3.34Å; S80-A84 PolarHBondContact O-N 3.37Å
81Y98Very high97.5Very high15 Ų1538 Ų386%0.05921%0.205CC..Hα-helixtrans-62.8-48.3176.5173.4-88.5000111.3I58 F61 S62 W71 G77 C78 Q79 A84 G85 C155 Q255 K259I58-Y81 HydrophobicContact CB-CD2 4.15Å; I58-Y81 HydrophobicContact CB-CE2 4.09Å; I58-Y81 HydrophobicContact CD1-CD2 4.46Å; I58-Y81 HydrophobicContact CD1-CE2 4.16Å; I58-Y81 HydrophobicContact CG1-CE2 4.22Å; I58-Y81 WeakPolarHBondContact O-CE2 3.33Å; F61-Y81 HydrophobicContact CB-CD2 4.07Å; F61-Y81 HydrophobicContact CB-CE2 4.3Å; S62-Y81 PolarHBondContact OG-OH 2.98Å; W71-Y81 HydrophobicContact CH2-CD1 4.23Å; W71-Y81 AromaticContact CH2-CD2 3.7Å; W71-Y81 HydrophobicContact CH2-CD2 3.7Å; W71-Y81 HydrophobicContact CH2-CE2 4.44Å; W71-Y81 AromaticContact CH2-CG 3.59Å; W71-Y81 HydrophobicContact CH2-CG 3.59Å; W71-Y81 HydrophobicContact CZ2-CG 4.17Å; W71-Y81 HydrophobicContact CZ3-CD2 4.38Å; W71-Y81 HydrophobicContact CZ3-CG 4.39Å; G77-Y81 WeakPolarHBondContact O-CB 3.38Å; G77-Y81 PolarHBondContact O-N 3.28Å; C78-Y81 PolarHBondContact O-N 3.35Å; Q79-Y81 PolarHBondContact O-N 3.41Å; Y81-A84 PolarHBondContact O-N 3.23Å; Y81-G85 PolarHBondContact O-N 3.06Å; Y81-C155 HydrophobicContact CD1-CB 4.19Å; Y81-C155 WeakPolarHBondContact CD1-O 3.35Å; Y81-C155 WeakPolarHBondContact CE1-O 3.49Å; Y81-Q255 PolarHBondContact OH-NE2 3.48Å; Y81-K259 VanDerWaalsContact OH-CE 3.24Å; Y81-K259 WeakPolarHBondContact OH-CE 3.46Å; Y81-K259 PolarHBondContact OH-NZ 2.95Å
82S97.7Very high97.6Very high0 Ų036.6 Ų36.60%020%0.199CC..Hα-helixtrans-64.5-43.5178.9-61.20000112.1C78 Q79 G85 M86 Y146 C155 L156C78-S82 PolarHBondContact O-N 2.84Å; C78-S82 PolarHBondContact O-OG 3.15Å; C78-S82 VanDerWaalsContact O-OG 3.1Å; Q79-S82 PolarHBondContact O-N 3.5Å; S82-G85 PolarHBondContact O-N 3.45Å; S82-M86 WeakPolarHBondContact O-CB 3.48Å; S82-M86 PolarHBondContact O-N 2.95Å; S82-Y146 VanDerWaalsContact CB-CD1 3.42Å; S82-C155 WeakPolarHBondContact OG-CB 3.45Å; S82-C155 PolarHBondContact OG-O 3.43Å; S82-L156 WeakPolarHBondContact OG-CA 3.32Å; S82-L156 PolarHBondContact OG-N 3.05Å
83F98.3Very high97.6Very high56 Ų5634.1 Ų34.125%0.24618%0.183CC..Hα-helixtrans-56.5-52174.8170.5-95.6000111.2Q79 G85 M86 L87 A136 I137 L140 Y146Q79-F83 VanDerWaalsContact O-CB 3.26Å; Q79-F83 WeakPolarHBondContact O-CB 3.39Å; Q79-F83 PolarHBondContact O-N 3.03Å; F83-G85 VanDerWaalsContact C-N 3.34Å; F83-G85 PolarHBondContact O-N 3.39Å; F83-M86 PolarHBondContact O-N 3.26Å; F83-L87 HydrophobicContact CE1-CD2 3.99Å; F83-L87 HydrophobicContact CZ-CD2 4.16Å; F83-L87 VanDerWaalsContact O-CB 3.3Å; F83-L87 WeakPolarHBondContact O-CB 3.37Å; F83-L87 PolarHBondContact O-N 2.92Å; F83-A136 HydrophobicContact CD2-CB 3.63Å; F83-A136 WeakPolarHBondContact CD2-O 3.46Å; F83-A136 HydrophobicContact CE2-CB 3.66Å; F83-A136 HydrophobicContact CG-CB 4.44Å; F83-A136 HydrophobicContact CZ-CB 4.49Å; F83-I137 HydrophobicContact CE2-CG1 3.73Å; F83-L140 HydrophobicContact CB-CD1 4.34Å; F83-L140 HydrophobicContact CD2-CD1 3.72Å; F83-L140 HydrophobicContact CE2-CD1 4.45Å; F83-L140 HydrophobicContact CG-CD1 4.27Å; F83-Y146 HydrophobicContact CB-CE2 4.25Å
84A98.2Very high97.7Very high15 Ų1532.4 Ų32.412%0.12418%0.175CC..Hα-helixtrans-62-43.6179.900000111.5I58 S80 Y81 M86 L87 F88I58-A84 HydrophobicContact CD1-CB 4.38Å; I58-A84 HydrophobicContact CG2-CB 3.87Å; S80-A84 VanDerWaalsContact O-CB 3.31Å; S80-A84 WeakPolarHBondContact O-CB 3.34Å; S80-A84 PolarHBondContact O-N 3.37Å; Y81-A84 PolarHBondContact O-N 3.23Å; A84-M86 PolarHBondContact O-N 2.9Å; A84-L87 PolarHBondContact O-N 3.09Å; A84-F88 HydrophobicContact CB-CD2 4.2Å; A84-F88 HydrophobicContact CB-CE2 3.99Å; A84-F88 WeakPolarHBondContact O-CB 3.34Å; A84-F88 WeakPolarHBondContact O-CD2 3.27Å; A84-F88 WeakPolarHBondContact O-CG 3.44Å; A84-F88 PolarHBondContact O-N 3.06Å
85G96.7Very high97.7Very high14 Ų1430.3 Ų30.314%0.14415%0.153CC..Hα-helixtrans-59.7-44.9176.800000112.7I58 Y81 S82 F83 G89I58-G85 VanDerWaalsContact CD1-CA 3.42Å; Y81-G85 PolarHBondContact O-N 3.06Å; S82-G85 PolarHBondContact O-N 3.45Å; F83-G85 VanDerWaalsContact C-N 3.34Å; F83-G85 PolarHBondContact O-N 3.39Å; G85-G89 WeakPolarHBondContact O-CA 3.31Å; G85-G89 PolarHBondContact O-N 3.01Å
86M97Very high97.8Very high18 Ų1823.5 Ų23.59%0.08912%0.122CC..Hα-helixtrans-67.6-46177.5-172.661.472.500111.8S82 F83 A84 G89 M90 A136 Y146 L157 L173S82-M86 WeakPolarHBondContact O-CB 3.48Å; S82-M86 PolarHBondContact O-N 2.95Å; F83-M86 PolarHBondContact O-N 3.26Å; A84-M86 PolarHBondContact O-N 2.9Å; M86-G89 PolarHBondContact O-N 2.91Å; M86-M90 HydrophobicContact CG-CG 4.07Å; M86-M90 VanDerWaalsContact O-CB 3.26Å; M86-M90 WeakPolarHBondContact O-CB 3.34Å; M86-M90 WeakPolarHBondContact O-CG 3.39Å; M86-M90 PolarHBondContact O-N 3.4Å; M86-M90 HydrophobicContact SD-CG 3.48Å; M86-M90 WeakPolarHBondContact SD-CG 3.37Å; M86-M90 HydrophobicContact SD-SD 4.06Å; M86-A136 HydrophobicContact CB-CB 3.92Å; M86-A136 HydrophobicContact CG-CB 3.96Å; M86-Y146 WeakPolarHBondContact CB-OH 3.17Å; M86-Y146 WeakPolarHBondContact CG-OH 3.15Å; M86-L157 HydrophobicContact CE-CD1 4.02Å; M86-L157 HydrophobicContact CE-CD2 4.2Å; M86-L157 HydrophobicContact CE-CG 4.2Å; M86-L173 HydrophobicContact CE-CD1 3.83Å; M86-L173 HydrophobicContact SD-CD1 4.42Å; M86-L173 HydrophobicContact SD-CD2 4.35Å
87L98.4Very high97.8Very high24 Ų2415.7 Ų15.713%0.1269%0.088CC..Hα-helixtrans-55.9-59179.1170.661.7000110.6F83 A84 G89 T91 W129 A133 A136F83-L87 HydrophobicContact CE1-CD2 3.99Å; F83-L87 HydrophobicContact CZ-CD2 4.16Å; F83-L87 VanDerWaalsContact O-CB 3.3Å; F83-L87 WeakPolarHBondContact O-CB 3.37Å; F83-L87 PolarHBondContact O-N 2.92Å; A84-L87 PolarHBondContact O-N 3.09Å; L87-G89 VanDerWaalsContact C-N 3.34Å; L87-G89 PolarHBondContact O-N 3.08Å; L87-T91 VanDerWaalsContact O-CB 3.22Å; L87-T91 WeakPolarHBondContact O-CB 3.38Å; L87-T91 PolarHBondContact O-N 3.46Å; L87-T91 PolarHBondContact O-OG1 3.02Å; L87-W129 HydrophobicContact CD1-CE3 4.02Å; L87-W129 HydrophobicContact CD1-CZ3 4.3Å; L87-W129 HydrophobicContact CD2-CZ3 4.4Å; L87-W129 HydrophobicContact CG-CE3 4.35Å; L87-W129 HydrophobicContact CG-CZ3 4.14Å; L87-A133 HydrophobicContact CD1-CB 3.9Å; L87-A136 HydrophobicContact CB-CB 3.93Å
88F98.1Very high97.8Very high45 Ų4518 Ų1820%0.1979%0.093CC..Hα-helixtrans-67.7-37.4-176-64.1-48.7000111.9A51 G54 C55 A84 S92 W129A51-F88 WeakPolarHBondContact O-CB 3.33Å; G54-F88 VanDerWaalsContact CA-CD2 3.46Å; C55-F88 WeakPolarHBondContact SG-CB 3.43Å; A84-F88 HydrophobicContact CB-CD2 4.2Å; A84-F88 HydrophobicContact CB-CE2 3.99Å; A84-F88 WeakPolarHBondContact O-CB 3.34Å; A84-F88 WeakPolarHBondContact O-CD2 3.27Å; A84-F88 WeakPolarHBondContact O-CG 3.44Å; A84-F88 PolarHBondContact O-N 3.06Å; F88-S92 VanDerWaalsContact O-CB 3.32Å; F88-S92 WeakPolarHBondContact O-CB 3.34Å; F88-S92 PolarHBondContact O-N 3.19Å; F88-S92 PolarHBondContact O-OG 3.09Å; F88-W129 AromaticContact CD1-CH2 3.6Å; F88-W129 HydrophobicContact CD1-CH2 3.6Å; F88-W129 AromaticContact CD1-CZ3 3.55Å; F88-W129 HydrophobicContact CD1-CZ3 3.55Å; F88-W129 AromaticContact CE1-CH2 3.69Å; F88-W129 HydrophobicContact CE1-CH2 3.69Å; F88-W129 AromaticContact CE1-CZ3 3.6Å; F88-W129 HydrophobicContact CE1-CZ3 3.6Å
89G97Very high97.8Very high1 Ų117.8 Ų17.81%0.019%0.092CC..Hα-helixtrans-62.9-55177.200000112.5G85 M86 L87 T91 S92 I93G85-G89 WeakPolarHBondContact O-CA 3.31Å; G85-G89 PolarHBondContact O-N 3.01Å; M86-G89 PolarHBondContact O-N 2.91Å; L87-G89 VanDerWaalsContact C-N 3.34Å; L87-G89 PolarHBondContact O-N 3.08Å; G89-T91 PolarHBondContact O-N 3.11Å; G89-S92 PolarHBondContact O-N 3.36Å; G89-S92 PolarHBondContact O-OG 3.15Å; G89-I93 WeakPolarHBondContact O-CG1 3.16Å; G89-I93 PolarHBondContact O-N 3.44Å; G89-I93 VanDerWaalsContact O-N 3.11Å
90M97.1Very high97.8Very high6 Ų616.4 Ų16.43%0.039%0.086CC..Hα-helixtrans-62-45.2179.3-67.1-62.6-67.800111.4M86 S92 I93 Y94 W135 L173 G177M86-M90 HydrophobicContact CG-CG 4.07Å; M86-M90 VanDerWaalsContact O-CB 3.26Å; M86-M90 WeakPolarHBondContact O-CB 3.34Å; M86-M90 WeakPolarHBondContact O-CG 3.39Å; M86-M90 PolarHBondContact O-N 3.4Å; M86-M90 HydrophobicContact SD-CG 3.48Å; M86-M90 WeakPolarHBondContact SD-CG 3.37Å; M86-M90 HydrophobicContact SD-SD 4.06Å; M90-S92 VanDerWaalsContact C-N 3.3Å; M90-S92 PolarHBondContact O-N 2.88Å; M90-I93 PolarHBondContact O-N 2.93Å; M90-Y94 HydrophobicContact CE-CE2 3.71Å; M90-Y94 WeakPolarHBondContact O-CD2 3.39Å; M90-Y94 PolarHBondContact O-N 2.96Å; M90-W135 HydrophobicContact CE-CB 4.26Å; M90-W135 HydrophobicContact CE-CD2 4.37Å; M90-W135 HydrophobicContact CE-CG 3.8Å; M90-W135 HydrophobicContact CG-CB 4.16Å; M90-L173 HydrophobicContact CE-CD2 3.89Å; M90-L173 HydrophobicContact SD-CD2 4.12Å; M90-G177 VanDerWaalsContact CE-CA 3.43Å
91T98.3Very high97.8Very high0 Ų016.3 Ų16.30%08%0.08CC..Hα-helixtrans-59.2-40.4176.3-66.30000111.8A51 L87 G89 I93 Y94 L95 I128 W129A51-T91 HydrophobicContact CB-CG2 3.96Å; L87-T91 VanDerWaalsContact O-CB 3.22Å; L87-T91 WeakPolarHBondContact O-CB 3.38Å; L87-T91 PolarHBondContact O-N 3.46Å; L87-T91 PolarHBondContact O-OG1 3.02Å; G89-T91 PolarHBondContact O-N 3.11Å; T91-I93 PolarHBondContact O-N 2.99Å; T91-Y94 PolarHBondContact O-N 3.44Å; T91-L95 HydrophobicContact CG2-CD1 3.58Å; T91-L95 HydrophobicContact CG2-CG 4.2Å; T91-L95 VanDerWaalsContact O-CB 3.31Å; T91-L95 WeakPolarHBondContact O-CB 3.47Å; T91-L95 VanDerWaalsContact O-CG 3.27Å; T91-L95 WeakPolarHBondContact O-CG 3.37Å; T91-L95 PolarHBondContact O-N 3.13Å; T91-I128 HydrophobicContact CG2-CG2 4.41Å; T91-W129 HydrophobicContact CG2-CD2 3.65Å; T91-W129 HydrophobicContact CG2-CE3 3.9Å; T91-W129 HydrophobicContact CG2-CG 4.12Å; T91-W129 HydrophobicContact CG2-CH2 4.19Å; T91-W129 HydrophobicContact CG2-CZ2 3.92Å; T91-W129 HydrophobicContact CG2-CZ3 4.17Å
92S97.8Very high97.7Very high0 Ų015.7 Ų15.70%08%0.077CC..Hα-helixtrans-62.4-42.3176.875.60000112.5L48 F88 G89 M90 S96 W228 Q262L48-S92 WeakPolarHBondContact CD1-O 3.38Å; F88-S92 VanDerWaalsContact O-CB 3.32Å; F88-S92 WeakPolarHBondContact O-CB 3.34Å; F88-S92 PolarHBondContact O-N 3.19Å; F88-S92 PolarHBondContact O-OG 3.09Å; G89-S92 PolarHBondContact O-N 3.36Å; G89-S92 PolarHBondContact O-OG 3.15Å; M90-S92 VanDerWaalsContact C-N 3.3Å; M90-S92 PolarHBondContact O-N 2.88Å; S92-S96 WeakPolarHBondContact O-CB 3.43Å; S92-S96 PolarHBondContact O-N 3.41Å; S92-S96 PolarHBondContact O-OG 3.29Å; S92-W228 PolarHBondContact OG-NE1 3.4Å; S92-Q262 PolarHBondContact OG-OE1 2.87Å
93I97.4Very high97.6Very high1 Ų115.7 Ų15.71%0.0058%0.077CC..Hα-helixtrans-62.1-55.1177.1-65.4169.9000109.7G89 M90 T91 L95 S96 C97 P181 F182 W228G89-I93 WeakPolarHBondContact O-CG1 3.16Å; G89-I93 PolarHBondContact O-N 3.44Å; G89-I93 VanDerWaalsContact O-N 3.11Å; M90-I93 PolarHBondContact O-N 2.93Å; T91-I93 PolarHBondContact O-N 2.99Å; I93-L95 PolarHBondContact O-N 3.46Å; I93-S96 PolarHBondContact O-N 3.06Å; I93-S96 PolarHBondContact O-OG 3.47Å; I93-C97 PolarHBondContact O-N 3.29Å; I93-C97 PolarHBondContact O-SG 2.84Å; I93-P181 HydrophobicContact CG2-CB 4.14Å; I93-P181 HydrophobicContact CG2-CG 4.06Å; I93-F182 HydrophobicContact CB-CZ 4.49Å; I93-F182 HydrophobicContact CD1-CZ 4.42Å; I93-F182 HydrophobicContact CG1-CZ 4.1Å; I93-F182 HydrophobicContact CG2-CE1 4.12Å; I93-F182 HydrophobicContact CG2-CE2 3.98Å; I93-F182 HydrophobicContact CG2-CZ 3.73Å; I93-W228 HydrophobicContact CD1-CB 3.97Å; I93-W228 HydrophobicContact CD1-CD2 4.03Å; I93-W228 HydrophobicContact CD1-CG 3.63Å; I93-W228 VanDerWaalsContact CG1-CD1 3.4Å; I93-W228 HydrophobicContact CG1-CD2 4.43Å; I93-W228 HydrophobicContact CG1-CG 3.92Å
94Y98.3Very high97.6Very high35 Ų3513.2 Ų13.214%0.1377%0.066CC..Hα-helixtrans-60.4-43.6-178.5-77.2-69.7000112.3M90 T91 S96 C97 F98 I128 I131 W135 F176 P181M90-Y94 HydrophobicContact CE-CE2 3.71Å; M90-Y94 WeakPolarHBondContact O-CD2 3.39Å; M90-Y94 PolarHBondContact O-N 2.96Å; T91-Y94 PolarHBondContact O-N 3.44Å; Y94-S96 PolarHBondContact O-N 3.48Å; Y94-C97 PolarHBondContact O-N 3.25Å; Y94-F98 WeakPolarHBondContact O-CB 3.36Å; Y94-F98 PolarHBondContact O-N 2.99Å; Y94-I128 VanDerWaalsContact CB-CG2 3.42Å; Y94-I128 HydrophobicContact CG-CG2 4.44Å; Y94-I131 HydrophobicContact CD2-CG2 3.85Å; Y94-I131 HydrophobicContact CE1-CG2 4.2Å; Y94-I131 HydrophobicContact CE2-CG2 3.39Å; Y94-I131 HydrophobicContact CG-CG2 4.43Å; Y94-W135 AromaticContact CE2-CD1 4Å; Y94-W135 AromaticContact CE2-NE1 4Å; Y94-W135 AromaticContact CZ-NE1 3.98Å; Y94-W135 PolarHBondContact OH-NE1 3.47Å; Y94-W135 VanDerWaalsContact OH-NE1 3.09Å; Y94-F176 VanDerWaalsContact CZ-O 3.31Å; Y94-F176 PolarHBondContact OH-O 3.32Å; Y94-P181 HydrophobicContact CD1-CB 4.12Å; Y94-P181 HydrophobicContact CE1-CB 4.15Å; Y94-P181 HydrophobicContact CE1-CG 4.33Å
95L98.1Very high97.5Very high0 Ų012.5 Ų12.50%06%0.06CC..Hα-helixtrans-60.2-45.1176.5-76167.8000111.5F44 H47 L48 A51 T91 I93 C97 F98 I99 P125 I128F44-L95 HydrophobicContact CD1-CD2 3.92Å; H47-L95 HydrophobicContact CB-CD1 3.77Å; H47-L95 HydrophobicContact CB-CD2 4.12Å; L48-L95 HydrophobicContact CB-CB 4.23Å; L48-L95 HydrophobicContact CB-CD1 4.33Å; L48-L95 HydrophobicContact CD1-CB 4.17Å; A51-L95 HydrophobicContact CB-CD1 4.4Å; T91-L95 HydrophobicContact CG2-CD1 3.58Å; T91-L95 HydrophobicContact CG2-CG 4.2Å; T91-L95 VanDerWaalsContact O-CB 3.31Å; T91-L95 WeakPolarHBondContact O-CB 3.47Å; T91-L95 VanDerWaalsContact O-CG 3.27Å; T91-L95 WeakPolarHBondContact O-CG 3.37Å; T91-L95 PolarHBondContact O-N 3.13Å; I93-L95 PolarHBondContact O-N 3.46Å; L95-C97 PolarHBondContact O-N 2.95Å; L95-F98 PolarHBondContact O-N 3.32Å; L95-I99 WeakPolarHBondContact O-CB 3.34Å; L95-I99 WeakPolarHBondContact O-CD1 3.33Å; L95-I99 WeakPolarHBondContact O-CG1 3.28Å; L95-I99 PolarHBondContact O-N 3.28Å; L95-P125 HydrophobicContact CD2-CB 4.45Å; L95-I128 HydrophobicContact CD2-CB 4.32Å; L95-I128 HydrophobicContact CD2-CD1 3.76Å; L95-I128 HydrophobicContact CD2-CG2 4.15Å; L95-I128 HydrophobicContact CG-CD1 4.45Å; L95-I128 HydrophobicContact CG-CG2 3.85Å
96S97.8Very high97.4Very high0 Ų013.2 Ų13.20%06%0.06CC..Hα-helixtrans-61.1-45179.970.90000112.8S92 I93 Y94 C100S92-S96 WeakPolarHBondContact O-CB 3.43Å; S92-S96 PolarHBondContact O-N 3.41Å; S92-S96 PolarHBondContact O-OG 3.29Å; I93-S96 PolarHBondContact O-N 3.06Å; I93-S96 PolarHBondContact O-OG 3.47Å; Y94-S96 PolarHBondContact O-N 3.48Å; S96-C100 PolarHBondContact O-N 2.95Å; S96-C100 PolarHBondContact O-SG 3.34Å
97C98.3Very high97.2Very high3 Ų313.7 Ų13.72%0.026%0.064CC..Hα-helixtrans-71.9-38.3179.7-64.50000111.9I93 Y94 L95 C100 F101 P181I93-C97 PolarHBondContact O-N 3.29Å; I93-C97 PolarHBondContact O-SG 2.84Å; Y94-C97 PolarHBondContact O-N 3.25Å; L95-C97 PolarHBondContact O-N 2.95Å; C97-C100 WeakPolarHBondContact O-CB 3.4Å; C97-C100 PolarHBondContact O-N 3.4Å; C97-F101 PolarHBondContact O-N 3.22Å; C97-F101 VanDerWaalsContact O-N 3.12Å; C97-P181 HydrophobicContact CB-CB 4.16Å; C97-P181 WeakPolarHBondContact CB-O 3.38Å; C97-P181 PolarHBondContact SG-O 2.88Å
98F97.4Very high97.1Very high63 Ų6314.9 Ų14.928%0.2767%0.07SC..Hα-helixtrans-71.5-33.8179-154.9-101.5000112.3F44 Y94 L95 C100 F101 L102 I124 I128F44-F98 HydrophobicContact CD1-CD1 4.25Å; F44-F98 AromaticContact CE1-CD1 3.51Å; F44-F98 HydrophobicContact CE1-CD1 3.51Å; F44-F98 AromaticContact CE1-CE1 3.97Å; F44-F98 HydrophobicContact CE1-CE1 3.97Å; F44-F98 HydrophobicContact CZ-CD1 4.18Å; F44-F98 HydrophobicContact CZ-CE1 4.21Å; Y94-F98 WeakPolarHBondContact O-CB 3.36Å; Y94-F98 PolarHBondContact O-N 2.99Å; L95-F98 PolarHBondContact O-N 3.32Å; F98-C100 VanDerWaalsContact C-N 3.26Å; F98-C100 PolarHBondContact O-N 2.84Å; F98-F101 HydrophobicContact CD2-CD1 4.34Å; F98-F101 HydrophobicContact CE2-CD1 4.01Å; F98-F101 HydrophobicContact CE2-CE1 4.43Å; F98-F101 HydrophobicContact CZ-CD1 4.29Å; F98-F101 PolarHBondContact O-N 3.25Å; F98-L102 HydrophobicContact CD1-CD1 3.46Å; F98-L102 VanDerWaalsContact CD1-CD1 3.46Å; F98-L102 HydrophobicContact CD1-CD2 4.36Å; F98-L102 HydrophobicContact CD1-CG 3.67Å; F98-L102 HydrophobicContact CE1-CD1 3.53Å; F98-L102 HydrophobicContact CE1-CD2 3.78Å; F98-L102 HydrophobicContact CE1-CG 3.61Å; F98-L102 HydrophobicContact CZ-CD2 4.32Å; F98-L102 HydrophobicContact CZ-CG 4.45Å; F98-L102 WeakPolarHBondContact O-CB 3.36Å; F98-L102 WeakPolarHBondContact O-CG 3.39Å; F98-L102 PolarHBondContact O-N 2.9Å; F98-I124 HydrophobicContact CD1-CG2 4.37Å; F98-I124 HydrophobicContact CE1-CG2 3.64Å; F98-I124 HydrophobicContact CZ-CG2 4.19Å; F98-I128 HydrophobicContact CB-CD1 3.96Å; F98-I128 HydrophobicContact CD1-CD1 3.94Å; F98-I128 HydrophobicContact CG-CD1 4Å
99I97.7Very high96.9Very high1 Ų116.8 Ų16.81%0.0058%0.082CC..Hα-helixtrans-56.3-43.4169.1-75.8162.5000110.5F44 L48 L95 L102 T103 N217F44-I99 HydrophobicContact CB-CD1 3.98Å; F44-I99 HydrophobicContact CB-CG1 3.6Å; F44-I99 HydrophobicContact CD1-CG1 4.5Å; F44-I99 HydrophobicContact CG-CG1 4.38Å; L48-I99 HydrophobicContact CB-CD1 4.36Å; L48-I99 HydrophobicContact CD2-CD1 3.92Å; L95-I99 WeakPolarHBondContact O-CB 3.34Å; L95-I99 WeakPolarHBondContact O-CD1 3.33Å; L95-I99 WeakPolarHBondContact O-CG1 3.28Å; L95-I99 PolarHBondContact O-N 3.28Å; I99-L102 PolarHBondContact O-N 2.88Å; I99-T103 WeakPolarHBondContact O-CB 3.43Å; I99-T103 PolarHBondContact O-N 2.89Å; I99-T103 PolarHBondContact O-OG1 3.41Å; I99-N217 WeakPolarHBondContact CG2-OD1 3.38Å
100C98.3Very high96.8Very high0 Ų019.7 Ų19.70%010%0.097CC..Hα-helixtrans-62.4-45.1178.2-64.90000111.8S96 C97 F98 T103 M104 Q189 L221S96-C100 PolarHBondContact O-N 2.95Å; S96-C100 PolarHBondContact O-SG 3.34Å; C97-C100 WeakPolarHBondContact O-CB 3.4Å; C97-C100 PolarHBondContact O-N 3.4Å; F98-C100 VanDerWaalsContact C-N 3.26Å; F98-C100 PolarHBondContact O-N 2.84Å; C100-T103 PolarHBondContact O-N 2.84Å; C100-M104 PolarHBondContact O-N 2.93Å; C100-M104 VanDerWaalsContact O-N 3.1Å; C100-Q189 HydrophobicContact CB-CG 4.11Å; C100-L221 HydrophobicContact CB-CD1 4.37Å; C100-L221 WeakPolarHBondContact SG-CD1 2.93Å; C100-L221 WeakPolarHBondContact SG-CG 3Å
101F97.7Very high96.5Very high46 Ų4623.1 Ų23.120%0.20212%0.118CC..Hα-helixtrans-62.1-49.7176.3173.9-105.6000112.3C97 F98 T103 M104 V105 I113 I184 S188C97-F101 PolarHBondContact O-N 3.22Å; C97-F101 VanDerWaalsContact O-N 3.12Å; F98-F101 HydrophobicContact CD2-CD1 4.34Å; F98-F101 HydrophobicContact CE2-CD1 4.01Å; F98-F101 HydrophobicContact CE2-CE1 4.43Å; F98-F101 HydrophobicContact CZ-CD1 4.29Å; F98-F101 PolarHBondContact O-N 3.25Å; F101-T103 VanDerWaalsContact C-N 3.31Å; F101-T103 PolarHBondContact O-N 3.24Å; F101-M104 HydrophobicContact CD2-CE 4.01Å; F101-M104 HydrophobicContact CE2-CE 4.07Å; F101-M104 WeakPolarHBondContact O-CB 3.28Å; F101-M104 PolarHBondContact O-N 3.47Å; F101-M104 VanDerWaalsContact O-N 3.11Å; F101-V105 HydrophobicContact CD1-CG2 4.29Å; F101-V105 HydrophobicContact CD2-CG2 4.41Å; F101-V105 HydrophobicContact CE1-CG2 3.86Å; F101-V105 HydrophobicContact CE2-CG2 3.99Å; F101-V105 HydrophobicContact CZ-CG2 3.69Å; F101-V105 WeakPolarHBondContact O-CG2 3.44Å; F101-V105 PolarHBondContact O-N 2.97Å; F101-I113 HydrophobicContact CZ-CD1 4.22Å; F101-I184 HydrophobicContact CB-CG2 4.11Å; F101-I184 HydrophobicContact CD2-CG2 4.31Å; F101-I184 HydrophobicContact CG-CG2 4.44Å; F101-S188 WeakPolarHBondContact CA-OG 3.34Å
102L96.2Very high96.3Very high1 Ų132.4 Ų32.41%0.00516%0.155CC..Hα-helixtrans-63.7-37179.3-71.1178.1000112.5L41 F44 F98 I99 M104 V105 E106 I117 Y121L41-L102 HydrophobicContact CD1-CB 3.95Å; L41-L102 HydrophobicContact CD2-CB 4.43Å; L41-L102 HydrophobicContact CG-CB 4.26Å; F44-L102 HydrophobicContact CD1-CD1 4.04Å; F44-L102 HydrophobicContact CD2-CD1 4.09Å; F44-L102 HydrophobicContact CE1-CD1 3.62Å; F44-L102 HydrophobicContact CE2-CD1 3.7Å; F44-L102 HydrophobicContact CG-CD1 4.25Å; F44-L102 HydrophobicContact CZ-CD1 3.4Å; F44-L102 VanDerWaalsContact CZ-CD1 3.4Å; F98-L102 HydrophobicContact CD1-CD1 3.46Å; F98-L102 VanDerWaalsContact CD1-CD1 3.46Å; F98-L102 HydrophobicContact CD1-CD2 4.36Å; F98-L102 HydrophobicContact CD1-CG 3.67Å; F98-L102 HydrophobicContact CE1-CD1 3.53Å; F98-L102 HydrophobicContact CE1-CD2 3.78Å; F98-L102 HydrophobicContact CE1-CG 3.61Å; F98-L102 HydrophobicContact CZ-CD2 4.32Å; F98-L102 HydrophobicContact CZ-CG 4.45Å; F98-L102 WeakPolarHBondContact O-CB 3.36Å; F98-L102 WeakPolarHBondContact O-CG 3.39Å; F98-L102 PolarHBondContact O-N 2.9Å; I99-L102 PolarHBondContact O-N 2.88Å; L102-M104 VanDerWaalsContact C-N 3.3Å; L102-M104 PolarHBondContact O-N 2.7Å; L102-V105 PolarHBondContact O-N 3.18Å; L102-E106 WeakPolarHBondContact O-CG 3.31Å; L102-E106 PolarHBondContact O-N 3.2Å; L102-I117 HydrophobicContact CD2-CD1 3.62Å; L102-Y121 HydrophobicContact CD1-CD1 4.42Å; L102-Y121 HydrophobicContact CD1-CE1 3.96Å; L102-Y121 HydrophobicContact CD2-CE1 4.09Å; L102-Y121 HydrophobicContact CG-CE1 4.48Å
103T96.6Very high96Very high0 Ų034.8 Ų34.80%017%0.167CC..Hα-helixtrans-61.2-44.1173.9-54.80000110.3L41 I99 C100 F101 E106 V107 L192 L213 N217L41-T103 WeakPolarHBondContact CD2-OG1 3.34Å; I99-T103 WeakPolarHBondContact O-CB 3.43Å; I99-T103 PolarHBondContact O-N 2.89Å; I99-T103 PolarHBondContact O-OG1 3.41Å; C100-T103 PolarHBondContact O-N 2.84Å; F101-T103 VanDerWaalsContact C-N 3.31Å; F101-T103 PolarHBondContact O-N 3.24Å; T103-E106 PolarHBondContact O-N 3.39Å; T103-V107 HydrophobicContact CG2-CG2 4.18Å; T103-V107 WeakPolarHBondContact O-CB 3.22Å; T103-V107 VanDerWaalsContact O-CG2 3.24Å; T103-V107 WeakPolarHBondContact O-CG2 3.24Å; T103-V107 PolarHBondContact O-N 3.37Å; T103-L192 HydrophobicContact CG2-CD1 3.8Å; T103-L213 HydrophobicContact CG2-CB 4.16Å; T103-L213 HydrophobicContact CG2-CD1 4.24Å; T103-N217 VanDerWaalsContact CB-ND2 3.34Å; T103-N217 WeakPolarHBondContact CB-ND2 3.23Å; T103-N217 PolarHBondContact OG1-ND2 3.41Å
104M96.7Very high95.8Very high4 Ų438 Ų382%0.0218%0.179CC..Hα-helixtrans-61.5-46.9176.3-175.2-158.566.200111.5C100 F101 L102 E106 V107 L108 L110 W187 K191 L192C100-M104 PolarHBondContact O-N 2.93Å; C100-M104 VanDerWaalsContact O-N 3.1Å; F101-M104 HydrophobicContact CD2-CE 4.01Å; F101-M104 HydrophobicContact CE2-CE 4.07Å; F101-M104 WeakPolarHBondContact O-CB 3.28Å; F101-M104 PolarHBondContact O-N 3.47Å; F101-M104 VanDerWaalsContact O-N 3.11Å; L102-M104 VanDerWaalsContact C-N 3.3Å; L102-M104 PolarHBondContact O-N 2.7Å; M104-E106 VanDerWaalsContact C-N 3.32Å; M104-E106 PolarHBondContact O-N 3.39Å; M104-V107 PolarHBondContact O-N 3.46Å; M104-L108 HydrophobicContact CG-CD1 3.49Å; M104-L108 VanDerWaalsContact CG-CD1 3.49Å; M104-L108 HydrophobicContact CG-CG 3.98Å; M104-L108 VanDerWaalsContact O-CB 3.28Å; M104-L108 WeakPolarHBondContact O-CB 3.5Å; M104-L108 WeakPolarHBondContact O-CG 3.3Å; M104-L108 PolarHBondContact O-N 3.11Å; M104-L108 HydrophobicContact SD-CD1 4.14Å; M104-L110 HydrophobicContact CE-CD1 3.96Å; M104-W187 HydrophobicContact CE-CE3 4.47Å; M104-W187 HydrophobicContact CE-CH2 3.9Å; M104-W187 HydrophobicContact CE-CZ3 3.52Å; M104-W187 HydrophobicContact SD-CE3 4.25Å; M104-W187 HydrophobicContact SD-CH2 4.06Å; M104-W187 HydrophobicContact SD-CZ3 3.72Å; M104-K191 HydrophobicContact CG-CB 4.17Å; M104-K191 HydrophobicContact SD-CB 3.67Å; M104-K191 HydrophobicContact SD-CG 4.01Å; M104-L192 HydrophobicContact CB-CD1 4.24Å; M104-L192 HydrophobicContact CB-CD2 4.32Å; M104-L192 HydrophobicContact CB-CG 4Å; M104-L192 HydrophobicContact CG-CD2 4.42Å; M104-L192 HydrophobicContact CG-CG 4.21Å
105V95.9Very high95.4Very high0 Ų041.9 Ų41.90%020%0.203CC..Hα-helixtrans-56.2-45.8178.3166.20000111.7F101 L102 N109 L110 I113 R114 I117F101-V105 HydrophobicContact CD1-CG2 4.29Å; F101-V105 HydrophobicContact CD2-CG2 4.41Å; F101-V105 HydrophobicContact CE1-CG2 3.86Å; F101-V105 HydrophobicContact CE2-CG2 3.99Å; F101-V105 HydrophobicContact CZ-CG2 3.69Å; F101-V105 WeakPolarHBondContact O-CG2 3.44Å; F101-V105 PolarHBondContact O-N 2.97Å; L102-V105 PolarHBondContact O-N 3.18Å; V105-N109 PolarHBondContact O-N 3.5Å; V105-L110 HydrophobicContact CG1-CB 4.33Å; V105-L110 HydrophobicContact CG2-CD1 4.15Å; V105-L110 PolarHBondContact O-N 2.89Å; V105-I113 HydrophobicContact CG1-CB 3.97Å; V105-I113 HydrophobicContact CG1-CG2 3.86Å; V105-I113 HydrophobicContact CG2-CB 4.45Å; V105-I113 HydrophobicContact CG2-CD1 4.24Å; V105-I113 HydrophobicContact CG2-CG2 4.03Å; V105-R114 HydrophobicContact CG1-CG 3.57Å; V105-I117 HydrophobicContact CG1-CD1 3.91Å
106E94.6Very high95Very high30 Ų3047.9 Ų47.914%0.1423%0.229CC..Hα-helixtrans-71.6-44.3-179.1-71.8-66.8144.400112.7P38 L41 L102 T103 M104 N109 R114 Y121P38-E106 HydrophobicContact CB-CB 3.78Å; P38-E106 HydrophobicContact CB-CG 3.71Å; P38-E106 HydrophobicContact CG-CB 3.8Å; P38-E106 HydrophobicContact CG-CG 4.15Å; L41-E106 HydrophobicContact CD1-CG 4.31Å; L102-E106 WeakPolarHBondContact O-CG 3.31Å; L102-E106 PolarHBondContact O-N 3.2Å; T103-E106 PolarHBondContact O-N 3.39Å; M104-E106 VanDerWaalsContact C-N 3.32Å; M104-E106 PolarHBondContact O-N 3.39Å; E106-N109 PolarHBondContact O-N 3.12Å; E106-R114 PolarHBondContact O-NH1 3.31Å; E106-R114 IonicContact OE1-NE 2.88Å; E106-R114 IonicContact OE2-CZ 3.2Å; E106-R114 IonicContact OE2-NE 3.3Å; E106-R114 PolarHBondContact OE2-NE 3.1Å; E106-R114 IonicContact OE2-NH2 3.59Å; E106-R114 PolarHBondContact OE2-NH2 3.22Å; E106-Y121 VanDerWaalsContact CD-OH 3.27Å; E106-Y121 WeakPolarHBondContact CG-OH 3.41Å; E106-Y121 PolarHBondContact OE1-OH 2.82Å
107V94.7Very high94.6Very high27 Ų2748.3 Ų48.316%0.16423%0.231CC..Hα-helixtrans-71.2-42.6-177.81700000112T103 M104 N109 L192 Y195 I210 L213T103-V107 HydrophobicContact CG2-CG2 4.18Å; T103-V107 WeakPolarHBondContact O-CB 3.22Å; T103-V107 VanDerWaalsContact O-CG2 3.24Å; T103-V107 WeakPolarHBondContact O-CG2 3.24Å; T103-V107 PolarHBondContact O-N 3.37Å; M104-V107 PolarHBondContact O-N 3.46Å; V107-N109 PolarHBondContact O-N 3.33Å; V107-L192 HydrophobicContact CB-CD2 3.61Å; V107-L192 HydrophobicContact CG1-CD2 3.59Å; V107-L192 HydrophobicContact CG2-CD2 4.15Å; V107-Y195 HydrophobicContact CG1-CD1 4.09Å; V107-Y195 HydrophobicContact CG1-CE1 4.1Å; V107-I210 HydrophobicContact CG1-CD1 3.63Å; V107-I210 HydrophobicContact CG1-CG1 3.87Å; V107-I210 HydrophobicContact CG1-CG2 4.14Å; V107-I210 HydrophobicContact CG2-CG1 4.27Å; V107-L213 HydrophobicContact CG2-CD1 4.4Å
108L95.7Very high93.9Very high49 Ų4950.9 Ų50.926%0.25725%0.249SC..THydrogen-bonded Turntrans-801.1178-57.6-172.7000112.8M104 L110 K191 L192 Y195M104-L108 HydrophobicContact CG-CD1 3.49Å; M104-L108 VanDerWaalsContact CG-CD1 3.49Å; M104-L108 HydrophobicContact CG-CG 3.98Å; M104-L108 VanDerWaalsContact O-CB 3.28Å; M104-L108 WeakPolarHBondContact O-CB 3.5Å; M104-L108 WeakPolarHBondContact O-CG 3.3Å; M104-L108 PolarHBondContact O-N 3.11Å; M104-L108 HydrophobicContact SD-CD1 4.14Å; L108-L110 HydrophobicContact CB-CD2 4.11Å; L108-L110 HydrophobicContact CB-CG 4.16Å; L108-L110 PolarHBondContact O-N 3.47Å; L108-K191 HydrophobicContact CD1-CB 4.27Å; L108-L192 HydrophobicContact CG-CD2 4.5Å; L108-Y195 HydrophobicContact CD2-CD1 4.23Å; L108-Y195 HydrophobicContact CD2-CD2 3.41Å; L108-Y195 VanDerWaalsContact CD2-CD2 3.41Å; L108-Y195 HydrophobicContact CD2-CE2 4.14Å; L108-Y195 HydrophobicContact CD2-CG 3.45Å; L108-Y195 VanDerWaalsContact CD2-CG 3.45Å
109N93.5Very high93.4Very high86 Ų8654.8 Ų54.846%0.4627%0.273SS..THydrogen-bonded Turntrans52.150.7-179.1-168.827.6000113.3V105 E106 V107 T111 R114V105-N109 PolarHBondContact O-N 3.5Å; E106-N109 PolarHBondContact O-N 3.12Å; V107-N109 PolarHBondContact O-N 3.33Å; N109-T111 PolarHBondContact O-N 2.9Å; N109-T111 PolarHBondContact O-OG1 3.46Å; N109-R114 PolarHBondContact OD1-NH1 3.01Å
110L94.7Very high93Very high62 Ų6260.3 Ų60.333%0.32529%0.294SS..  trans-7578.7177.7-56.6-175000110M104 V105 L108 Y112 I113 R114M104-L110 HydrophobicContact CE-CD1 3.96Å; V105-L110 HydrophobicContact CG1-CB 4.33Å; V105-L110 HydrophobicContact CG2-CD1 4.15Å; V105-L110 PolarHBondContact O-N 2.89Å; L108-L110 HydrophobicContact CB-CD2 4.11Å; L108-L110 HydrophobicContact CB-CG 4.16Å; L108-L110 PolarHBondContact O-N 3.47Å; L110-Y112 VanDerWaalsContact C-N 3.29Å; L110-Y112 PolarHBondContact O-N 2.87Å; L110-Y112 VanDerWaalsContact O-N 3.15Å; L110-I113 HydrophobicContact CB-CD1 4.44Å; L110-I113 HydrophobicContact CD1-CD1 4.26Å; L110-I113 PolarHBondContact O-N 3.27Å; L110-R114 WeakPolarHBondContact O-CG 3.34Å; L110-R114 PolarHBondContact O-N 3.23Å
111T91.8Very high92.5Very high77 Ų7760.9 Ų60.947%0.47230%0.296SS..Hα-helixtrans-54.2-40.2-164-9.80000113.7N109 I113 R114 N115N109-T111 PolarHBondContact O-N 2.9Å; N109-T111 PolarHBondContact O-OG1 3.46Å; T111-I113 PolarHBondContact O-N 3.15Å; T111-R114 PolarHBondContact O-N 3.45Å; T111-N115 VanDerWaalsContact O-CB 3.31Å; T111-N115 WeakPolarHBondContact O-CB 3.4Å; T111-N115 PolarHBondContact O-N 2.96Å; T111-N115 PolarHBondContact O-ND2 3.2Å
112Y92.9Very high92.1Very high196 Ų19663.2 Ų63.277%0.76931%0.31SS*.Hα-helixtrans-57.9-50177.7178.3-98.4000111.9L110 F116L110-Y112 VanDerWaalsContact C-N 3.29Å; L110-Y112 PolarHBondContact O-N 2.87Å; L110-Y112 VanDerWaalsContact O-N 3.15Å; Y112-F116 PolarHBondContact O-N 3.38Å
113I92.6Very high91.9Very high50 Ų5071.2 Ų71.226%0.25634%0.341SS..Hα-helixtrans-70.4-42.7-179.6-54.1176.8000109.8F101 V105 L110 T111 N115 F116 I117F101-I113 HydrophobicContact CZ-CD1 4.22Å; V105-I113 HydrophobicContact CG1-CB 3.97Å; V105-I113 HydrophobicContact CG1-CG2 3.86Å; V105-I113 HydrophobicContact CG2-CB 4.45Å; V105-I113 HydrophobicContact CG2-CD1 4.24Å; V105-I113 HydrophobicContact CG2-CG2 4.03Å; L110-I113 HydrophobicContact CB-CD1 4.44Å; L110-I113 HydrophobicContact CD1-CD1 4.26Å; L110-I113 PolarHBondContact O-N 3.27Å; T111-I113 PolarHBondContact O-N 3.15Å; I113-N115 VanDerWaalsContact C-N 3.35Å; I113-N115 PolarHBondContact O-N 2.92Å; I113-F116 CarbonylContact O-C 3.45Å; I113-F116 WeakPolarHBondContact O-CA 3.43Å; I113-F116 WeakPolarHBondContact O-CB 3.35Å; I113-F116 PolarHBondContact O-N 2.82Å; I113-I117 HydrophobicContact CG2-CD1 4.31Å; I113-I117 HydrophobicContact CG2-CG2 4.38Å; I113-I117 VanDerWaalsContact O-CG1 3.3Å; I113-I117 WeakPolarHBondContact O-CG1 3.39Å; I113-I117 PolarHBondContact O-N 3.44Å
114R91.7Very high91.8Very high68 Ų6873 Ų7326%0.25735%0.351SS..Hα-helixtrans-56.3-47.1177.6-70.218072.1166.411.2112.1V105 E106 N109 L110 T111 F116 I117 S118V105-R114 HydrophobicContact CG1-CG 3.57Å; E106-R114 PolarHBondContact O-NH1 3.31Å; E106-R114 IonicContact OE1-NE 2.88Å; E106-R114 IonicContact OE2-CZ 3.2Å; E106-R114 IonicContact OE2-NE 3.3Å; E106-R114 PolarHBondContact OE2-NE 3.1Å; E106-R114 IonicContact OE2-NH2 3.59Å; E106-R114 PolarHBondContact OE2-NH2 3.22Å; N109-R114 PolarHBondContact OD1-NH1 3.01Å; L110-R114 WeakPolarHBondContact O-CG 3.34Å; L110-R114 PolarHBondContact O-N 3.23Å; T111-R114 PolarHBondContact O-N 3.45Å; R114-F116 VanDerWaalsContact C-N 3.26Å; R114-F116 PolarHBondContact O-N 3.46Å; R114-I117 WeakPolarHBondContact O-CG1 3.25Å; R114-I117 PolarHBondContact O-N 3.17Å; R114-S118 WeakPolarHBondContact O-CB 3.29Å; R114-S118 PolarHBondContact O-N 2.93Å
115N90.7Very high91.8Very high117 Ų11772.9 Ų72.963%0.62635%0.35SS*.Hα-helixtrans-64.8-33.9177.7-70.1-10000111.6T111 I113T111-N115 VanDerWaalsContact O-CB 3.31Å; T111-N115 WeakPolarHBondContact O-CB 3.4Å; T111-N115 PolarHBondContact O-N 2.96Å; T111-N115 PolarHBondContact O-ND2 3.2Å; I113-N115 VanDerWaalsContact C-N 3.35Å; I113-N115 PolarHBondContact O-N 2.92Å
116F89.4Confident91.8Very high125 Ų12578.3 Ų78.355%0.54837%0.374SS..Hα-helixtrans-68.5-36.4173.9-176.3-97.4000112.5Y112 I113 R114 R120Y112-F116 PolarHBondContact O-N 3.38Å; I113-F116 CarbonylContact O-C 3.45Å; I113-F116 WeakPolarHBondContact O-CA 3.43Å; I113-F116 WeakPolarHBondContact O-CB 3.35Å; I113-F116 PolarHBondContact O-N 2.82Å; R114-F116 VanDerWaalsContact C-N 3.26Å; R114-F116 PolarHBondContact O-N 3.46Å; F116-R120 PolarHBondContact O-NH1 2.9Å
117I90.1Very high91.9Very high9 Ų978.5 Ų78.55%0.04638%0.384CS..Hα-helixtrans-97-16.8-173.764.2-172.1000114.7L102 V105 I113 R114 N119 R120 Y121 I124L102-I117 HydrophobicContact CD2-CD1 3.62Å; V105-I117 HydrophobicContact CG1-CD1 3.91Å; I113-I117 HydrophobicContact CG2-CD1 4.31Å; I113-I117 HydrophobicContact CG2-CG2 4.38Å; I113-I117 VanDerWaalsContact O-CG1 3.3Å; I113-I117 WeakPolarHBondContact O-CG1 3.39Å; I113-I117 PolarHBondContact O-N 3.44Å; R114-I117 WeakPolarHBondContact O-CG1 3.25Å; R114-I117 PolarHBondContact O-N 3.17Å; I117-N119 VanDerWaalsContact C-N 3.3Å; I117-N119 PolarHBondContact O-N 3.44Å; I117-N119 VanDerWaalsContact O-N 3.14Å; I117-R120 WeakPolarHBondContact O-CA 3.43Å; I117-R120 PolarHBondContact O-N 2.88Å; I117-Y121 HydrophobicContact CB-CE2 4.35Å; I117-Y121 HydrophobicContact CD1-CE1 4.19Å; I117-Y121 HydrophobicContact CD1-CE2 4.06Å; I117-Y121 WeakPolarHBondContact CD1-OH 3.4Å; I117-Y121 HydrophobicContact CG1-CD2 4.49Å; I117-Y121 HydrophobicContact CG1-CE2 3.69Å; I117-Y121 VanDerWaalsContact O-CD2 3.31Å; I117-Y121 WeakPolarHBondContact O-CD2 3.28Å; I117-Y121 PolarHBondContact O-N 3.3Å; I117-I124 HydrophobicContact CB-CD1 4.08Å; I117-I124 HydrophobicContact CG2-CD1 4.07Å
118S83.9Confident92.1Very high57 Ų5777.7 Ų77.740%0.39938%0.378SS..THydrogen-bonded Turntrans-51.5-44.3-168.264.10000113.8R114 R120R114-S118 WeakPolarHBondContact O-CB 3.29Å; R114-S118 PolarHBondContact O-N 2.93Å; S118-R120 VanDerWaalsContact C-N 3.32Å; S118-R120 PolarHBondContact O-N 2.86Å
119N85.7Confident92.2Very high145 Ų14577.8 Ų77.878%0.77538%0.375SS*.THydrogen-bonded Turntrans-89.64.3-179-64.9-18.4000113.5I117I117-N119 VanDerWaalsContact C-N 3.3Å; I117-N119 PolarHBondContact O-N 3.44Å; I117-N119 VanDerWaalsContact O-N 3.14Å
120R90.2Very high92.4Very high118 Ų11879.3 Ų79.345%0.44538%0.382SS..THydrogen-bonded Turntrans-120.4-4.8-170.1-60179.9179.5119.20.5113.6F116 I117 S118 N122 Y123 I124F116-R120 PolarHBondContact O-NH1 2.9Å; I117-R120 WeakPolarHBondContact O-CA 3.43Å; I117-R120 PolarHBondContact O-N 2.88Å; S118-R120 VanDerWaalsContact C-N 3.32Å; S118-R120 PolarHBondContact O-N 2.86Å; R120-N122 PolarHBondContact O-N 3.21Å; R120-N122 VanDerWaalsContact O-N 3.08Å; R120-Y123 PolarHBondContact O-N 3.26Å; R120-I124 HydrophobicContact CB-CD1 3.94Å; R120-I124 HydrophobicContact CB-CG1 4.07Å; R120-I124 VanDerWaalsContact O-CG1 3.31Å; R120-I124 WeakPolarHBondContact O-CG1 3.41Å; R120-I124 PolarHBondContact O-N 2.96Å
121Y88.2Confident92.6Very high12 Ų1279.7 Ų79.75%0.04738%0.384CS..THydrogen-bonded Turntrans-52.8-34.2-177.2-86.4-75.7000114.7G40 L41 F44 L102 E106 I117 Y123 P125G40-Y121 VanDerWaalsContact CA-CD1 3.49Å; G40-Y121 VanDerWaalsContact CA-CG 3.45Å; L41-Y121 HydrophobicContact CD1-CE1 3.89Å; F44-Y121 AromaticContact CE2-CD1 3.78Å; F44-Y121 HydrophobicContact CE2-CD1 3.78Å; F44-Y121 WeakPolarHBondContact CE2-O 3.44Å; L102-Y121 HydrophobicContact CD1-CD1 4.42Å; L102-Y121 HydrophobicContact CD1-CE1 3.96Å; L102-Y121 HydrophobicContact CD2-CE1 4.09Å; L102-Y121 HydrophobicContact CG-CE1 4.48Å; E106-Y121 VanDerWaalsContact CD-OH 3.27Å; E106-Y121 WeakPolarHBondContact CG-OH 3.41Å; E106-Y121 PolarHBondContact OE1-OH 2.82Å; I117-Y121 HydrophobicContact CB-CE2 4.35Å; I117-Y121 HydrophobicContact CD1-CE1 4.19Å; I117-Y121 HydrophobicContact CD1-CE2 4.06Å; I117-Y121 WeakPolarHBondContact CD1-OH 3.4Å; I117-Y121 HydrophobicContact CG1-CD2 4.49Å; I117-Y121 HydrophobicContact CG1-CE2 3.69Å; I117-Y121 VanDerWaalsContact O-CD2 3.31Å; I117-Y121 WeakPolarHBondContact O-CD2 3.28Å; I117-Y121 PolarHBondContact O-N 3.3Å; Y121-Y123 VanDerWaalsContact C-N 3.35Å; Y121-P125 WeakPolarHBondContact O-CD 3.19Å
122N88.3Confident92.9Very high94 Ų9476 Ų7650%0.50336%0.362SS..THydrogen-bonded Turntrans-77.8-20.1178.6-65.9-30.2000113.5T43 R120 F126T43-N122 PolarHBondContact OG1-OD1 2.92Å; T43-N122 VanDerWaalsContact OG1-OD1 3.09Å; R120-N122 PolarHBondContact O-N 3.21Å; R120-N122 VanDerWaalsContact O-N 3.08Å; N122-F126 WeakPolarHBondContact O-CE2 3.31Å
123Y92.1Very high93.2Very high169 Ų16967.9 Ų67.966%0.66333%0.334SS*.THydrogen-bonded Turntrans-100.2-31-176.3-57.9-66.3000113.1R120 Y121 P125 F126R120-Y123 PolarHBondContact O-N 3.26Å; Y121-Y123 VanDerWaalsContact C-N 3.35Å; Y123-P125 VanDerWaalsContact C-CD 3.45Å; Y123-P125 VanDerWaalsContact C-N 3.33Å; Y123-F126 WeakPolarHBondContact O-CB 3.35Å; Y123-F126 PolarHBondContact O-N 3.32Å
124I94.6Very high93.5Very high39 Ų3970.7 Ų70.720%0.235%0.345CS..Hα-helixtrans-55-40.2-179.2-67.5162000112.9F44 F98 I117 R120 F126 G127 I128F44-I124 HydrophobicContact CE1-CB 4.46Å; F44-I124 HydrophobicContact CE1-CG2 3.89Å; F44-I124 HydrophobicContact CZ-CB 3.75Å; F44-I124 HydrophobicContact CZ-CG2 3.59Å; F98-I124 HydrophobicContact CD1-CG2 4.37Å; F98-I124 HydrophobicContact CE1-CG2 3.64Å; F98-I124 HydrophobicContact CZ-CG2 4.19Å; I117-I124 HydrophobicContact CB-CD1 4.08Å; I117-I124 HydrophobicContact CG2-CD1 4.07Å; R120-I124 HydrophobicContact CB-CD1 3.94Å; R120-I124 HydrophobicContact CB-CG1 4.07Å; R120-I124 VanDerWaalsContact O-CG1 3.31Å; R120-I124 WeakPolarHBondContact O-CG1 3.41Å; R120-I124 PolarHBondContact O-N 2.96Å; I124-F126 PolarHBondContact O-N 3.07Å; I124-G127 WeakPolarHBondContact O-CA 3.35Å; I124-G127 PolarHBondContact O-N 3.39Å; I124-I128 PolarHBondContact O-N 3.01Å
125P96.1Very high93.8Very high0 Ų068.3 Ų68.30%034%0.336CS..Hα-helixtrans-56.6-35.6176-28.136.3000113.7T43 F44 H47 L95 Y121 Y123 G127 I128 W129T43-P125 HydrophobicContact CG2-CG 4.3Å; F44-P125 HydrophobicContact CD1-CG 4.04Å; F44-P125 HydrophobicContact CD2-CG 3.94Å; F44-P125 HydrophobicContact CE1-CG 3.87Å; F44-P125 HydrophobicContact CE2-CG 3.72Å; F44-P125 HydrophobicContact CG-CG 4.08Å; F44-P125 HydrophobicContact CZ-CG 3.73Å; H47-P125 HydrophobicContact CB-CB 4.23Å; H47-P125 WeakPolarHBondContact CD2-CB 3.36Å; L95-P125 HydrophobicContact CD2-CB 4.45Å; Y121-P125 WeakPolarHBondContact O-CD 3.19Å; Y123-P125 VanDerWaalsContact C-CD 3.45Å; Y123-P125 VanDerWaalsContact C-N 3.33Å; P125-G127 VanDerWaalsContact C-N 3.3Å; P125-G127 PolarHBondContact O-N 2.97Å; P125-I128 WeakPolarHBondContact O-CA 3.3Å; P125-I128 WeakPolarHBondContact O-CB 3.18Å; P125-I128 PolarHBondContact O-N 2.93Å; P125-W129 PolarHBondContact O-N 3.39Å
126F96.6Very high94.1Very high115 Ų11562.7 Ų62.750%0.50431%0.306SS..Hα-helixtrans-64.6-35.5175.6-64.9-81.3000112.1N122 Y123 I124 I128 W129 I130N122-F126 WeakPolarHBondContact O-CE2 3.31Å; Y123-F126 WeakPolarHBondContact O-CB 3.35Å; Y123-F126 PolarHBondContact O-N 3.32Å; I124-F126 PolarHBondContact O-N 3.07Å; F126-I128 VanDerWaalsContact C-N 3.25Å; F126-I128 PolarHBondContact O-N 3.11Å; F126-W129 WeakPolarHBondContact O-CB 3.39Å; F126-W129 PolarHBondContact O-N 3.23Å; F126-I130 WeakPolarHBondContact O-CG1 3.29Å; F126-I130 PolarHBondContact O-N 3.41Å
127G97Very high94.6Very high33 Ų3360.1 Ų60.134%0.3430%0.297SS..Hα-helixtrans-58.5-38.5169.700000112.3I124 P125 I130 I131I124-G127 WeakPolarHBondContact O-CA 3.35Å; I124-G127 PolarHBondContact O-N 3.39Å; P125-G127 VanDerWaalsContact C-N 3.3Å; P125-G127 PolarHBondContact O-N 2.97Å; G127-I130 WeakPolarHBondContact O-CB 3.32Å; G127-I130 PolarHBondContact O-N 3.08Å; G127-I131 WeakPolarHBondContact O-CG1 2.99Å; G127-I131 PolarHBondContact O-N 3.38Å
128I98Very high94.9Very high10 Ų1061.1 Ų61.15%0.05130%0.302CS..Hα-helixtrans-69.3-36.2176-62.2170.8000111.7F44 T91 Y94 L95 F98 I124 P125 F126 I130 I131 G132F44-I128 HydrophobicContact CD1-CD1 4.26Å; F44-I128 HydrophobicContact CE1-CD1 3.82Å; T91-I128 HydrophobicContact CG2-CG2 4.41Å; Y94-I128 VanDerWaalsContact CB-CG2 3.42Å; Y94-I128 HydrophobicContact CG-CG2 4.44Å; L95-I128 HydrophobicContact CD2-CB 4.32Å; L95-I128 HydrophobicContact CD2-CD1 3.76Å; L95-I128 HydrophobicContact CD2-CG2 4.15Å; L95-I128 HydrophobicContact CG-CD1 4.45Å; L95-I128 HydrophobicContact CG-CG2 3.85Å; F98-I128 HydrophobicContact CB-CD1 3.96Å; F98-I128 HydrophobicContact CD1-CD1 3.94Å; F98-I128 HydrophobicContact CG-CD1 4Å; I124-I128 PolarHBondContact O-N 3.01Å; P125-I128 WeakPolarHBondContact O-CA 3.3Å; P125-I128 WeakPolarHBondContact O-CB 3.18Å; P125-I128 PolarHBondContact O-N 2.93Å; F126-I128 VanDerWaalsContact C-N 3.25Å; F126-I128 PolarHBondContact O-N 3.11Å; I128-I130 VanDerWaalsContact C-N 3.34Å; I128-I131 PolarHBondContact O-N 2.7Å; I128-G132 PolarHBondContact O-N 3.15Å
129W98.5Very high95.6Very high51 Ų5158.7 Ų58.719%0.19329%0.286CS..Hα-helixtrans-62.3-41170.7-7996.1000111.9H47 A50 A51 L87 F88 T91 P125 F126 I131 G132 A133H47-W129 AromaticContact CG-NE1 3.82Å; H47-W129 AromaticContact ND1-CD1 3.74Å; H47-W129 AromaticContact ND1-NE1 3.12Å; H47-W129 PolarHBondContact ND1-NE1 3.5Å; H47-W129 VanDerWaalsContact ND1-NE1 3.12Å; A50-W129 HydrophobicContact CB-CZ2 4.41Å; A51-W129 HydrophobicContact CB-CH2 4.07Å; A51-W129 HydrophobicContact CB-CZ2 4.09Å; L87-W129 HydrophobicContact CD1-CE3 4.02Å; L87-W129 HydrophobicContact CD1-CZ3 4.3Å; L87-W129 HydrophobicContact CD2-CZ3 4.4Å; L87-W129 HydrophobicContact CG-CE3 4.35Å; L87-W129 HydrophobicContact CG-CZ3 4.14Å; F88-W129 AromaticContact CD1-CH2 3.6Å; F88-W129 HydrophobicContact CD1-CH2 3.6Å; F88-W129 AromaticContact CD1-CZ3 3.55Å; F88-W129 HydrophobicContact CD1-CZ3 3.55Å; F88-W129 AromaticContact CE1-CH2 3.69Å; F88-W129 HydrophobicContact CE1-CH2 3.69Å; F88-W129 AromaticContact CE1-CZ3 3.6Å; F88-W129 HydrophobicContact CE1-CZ3 3.6Å; T91-W129 HydrophobicContact CG2-CD2 3.65Å; T91-W129 HydrophobicContact CG2-CE3 3.9Å; T91-W129 HydrophobicContact CG2-CG 4.12Å; T91-W129 HydrophobicContact CG2-CH2 4.19Å; T91-W129 HydrophobicContact CG2-CZ2 3.92Å; T91-W129 HydrophobicContact CG2-CZ3 4.17Å; P125-W129 PolarHBondContact O-N 3.39Å; F126-W129 WeakPolarHBondContact O-CB 3.39Å; F126-W129 PolarHBondContact O-N 3.23Å; W129-I131 VanDerWaalsContact C-N 3.32Å; W129-I131 PolarHBondContact O-N 3.49Å; W129-G132 PolarHBondContact O-N 3.04Å; W129-A133 WeakPolarHBondContact O-CB 3.43Å; W129-A133 PolarHBondContact O-N 3.29Å
130I98.5Very high96.1Very high119 Ų11955.6 Ų55.661%0.6127%0.269SS*.Hα-helixtrans-61.4-41.8175-68.1165.8000110.7F126 G127 I128 A133 F134F126-I130 WeakPolarHBondContact O-CG1 3.29Å; F126-I130 PolarHBondContact O-N 3.41Å; G127-I130 WeakPolarHBondContact O-CB 3.32Å; G127-I130 PolarHBondContact O-N 3.08Å; I128-I130 VanDerWaalsContact C-N 3.34Å; I130-A133 PolarHBondContact O-N 3.38Å; I130-F134 WeakPolarHBondContact O-CB 3.49Å; I130-F134 PolarHBondContact O-N 3.45Å
131I98.1Very high96.4Very high70 Ų7055.9 Ų55.936%0.35928%0.278SS..Hα-helixtrans-63.1-44.5175.2-65.1166.7000110.9Y94 G127 I128 W129 A133 F134 W135Y94-I131 HydrophobicContact CD2-CG2 3.85Å; Y94-I131 HydrophobicContact CE1-CG2 4.2Å; Y94-I131 HydrophobicContact CE2-CG2 3.39Å; Y94-I131 HydrophobicContact CG-CG2 4.43Å; G127-I131 WeakPolarHBondContact O-CG1 2.99Å; G127-I131 PolarHBondContact O-N 3.38Å; I128-I131 PolarHBondContact O-N 2.7Å; W129-I131 VanDerWaalsContact C-N 3.32Å; W129-I131 PolarHBondContact O-N 3.49Å; I131-A133 VanDerWaalsContact C-N 3.34Å; I131-A133 PolarHBondContact O-N 3.11Å; I131-F134 WeakPolarHBondContact O-CB 3.46Å; I131-F134 PolarHBondContact O-N 3.46Å; I131-W135 PolarHBondContact O-N 3.01Å
132G98.3Very high96.7Very high0 Ų057.5 Ų57.50%030%0.299CS..Hα-helixtrans-60.9-42.3175.300000112.7I128 W129 W135 A136I128-G132 PolarHBondContact O-N 3.15Å; W129-G132 PolarHBondContact O-N 3.04Å; G132-W135 PolarHBondContact O-N 3.44Å; G132-A136 WeakPolarHBondContact O-CB 3.5Å; G132-A136 PolarHBondContact O-N 2.86Å; G132-A136 VanDerWaalsContact O-N 3.08Å
133A98.6Very high97Very high24 Ų2460 Ų6020%0.19830%0.302CS..Hα-helixtrans-65.5-41.3176.700000112L87 W129 I130 I131 W135 A136 I137L87-A133 HydrophobicContact CD1-CB 3.9Å; W129-A133 WeakPolarHBondContact O-CB 3.43Å; W129-A133 PolarHBondContact O-N 3.29Å; I130-A133 PolarHBondContact O-N 3.38Å; I131-A133 VanDerWaalsContact C-N 3.34Å; I131-A133 PolarHBondContact O-N 3.11Å; A133-W135 VanDerWaalsContact C-N 3.32Å; A133-W135 PolarHBondContact O-N 2.95Å; A133-A136 PolarHBondContact O-N 3.42Å; A133-A136 VanDerWaalsContact O-N 3.11Å; A133-I137 HydrophobicContact CB-CD1 4.48Å; A133-I137 WeakPolarHBondContact O-CB 3.47Å; A133-I137 WeakPolarHBondContact O-CG1 3.39Å; A133-I137 PolarHBondContact O-N 2.94Å
134F98.4Very high97.2Very high109 Ų10952 Ų5248%0.47827%0.27SS..Hα-helixtrans-52.5-52175169.8-97.2000110.9I130 I131 A136 I137 L138I130-F134 WeakPolarHBondContact O-CB 3.49Å; I130-F134 PolarHBondContact O-N 3.45Å; I131-F134 WeakPolarHBondContact O-CB 3.46Å; I131-F134 PolarHBondContact O-N 3.46Å; F134-A136 VanDerWaalsContact C-N 3.33Å; F134-A136 PolarHBondContact O-N 3.41Å; F134-I137 PolarHBondContact O-N 2.66Å; F134-L138 HydrophobicContact CD1-CD1 4.34Å; F134-L138 HydrophobicContact CE1-CD1 3.73Å; F134-L138 HydrophobicContact CE2-CD1 4.38Å; F134-L138 HydrophobicContact CE2-CD2 4.33Å; F134-L138 HydrophobicContact CE2-CG 4.44Å; F134-L138 HydrophobicContact CZ-CD1 3.76Å; F134-L138 HydrophobicContact CZ-CD2 4.37Å; F134-L138 HydrophobicContact CZ-CG 4.3Å; F134-L138 WeakPolarHBondContact O-CG 3.38Å; F134-L138 PolarHBondContact O-N 3.45Å
135W97.8Very high97.3Very high18 Ų1852.9 Ų52.97%0.06827%0.271CS..Hα-helixtrans-64.7-35.3178.3-69.3113.3000113.4M90 Y94 I131 G132 A133 L138 P139 Y169 L173 F176M90-W135 HydrophobicContact CE-CB 4.26Å; M90-W135 HydrophobicContact CE-CD2 4.37Å; M90-W135 HydrophobicContact CE-CG 3.8Å; M90-W135 HydrophobicContact CG-CB 4.16Å; Y94-W135 AromaticContact CE2-CD1 4Å; Y94-W135 AromaticContact CE2-NE1 4Å; Y94-W135 AromaticContact CZ-NE1 3.98Å; Y94-W135 PolarHBondContact OH-NE1 3.47Å; Y94-W135 VanDerWaalsContact OH-NE1 3.09Å; I131-W135 PolarHBondContact O-N 3.01Å; G132-W135 PolarHBondContact O-N 3.44Å; A133-W135 VanDerWaalsContact C-N 3.32Å; A133-W135 PolarHBondContact O-N 2.95Å; W135-L138 HydrophobicContact CE3-CD1 3.97Å; W135-L138 HydrophobicContact CZ3-CD1 4.09Å; W135-P139 WeakPolarHBondContact O-CD 3.22Å; W135-Y169 HydrophobicContact CE3-CE2 4.11Å; W135-Y169 PolarHBondContact O-OH 2.98Å; W135-L173 HydrophobicContact CB-CD2 4.17Å; W135-L173 HydrophobicContact CD2-CD2 3.8Å; W135-L173 HydrophobicContact CE3-CD2 3.53Å; W135-L173 HydrophobicContact CE3-CG 4.2Å; W135-L173 HydrophobicContact CG-CD2 4.08Å; W135-L173 HydrophobicContact CZ3-CD2 4.25Å; W135-F176 HydrophobicContact CH2-CB 3.96Å; W135-F176 AromaticContact CH2-CD2 3.93Å; W135-F176 HydrophobicContact CH2-CD2 3.93Å; W135-F176 HydrophobicContact CH2-CG 4.25Å; W135-F176 HydrophobicContact CZ2-CB 3.39Å; W135-F176 HydrophobicContact CZ2-CD2 4.12Å; W135-F176 AromaticContact CZ2-CG 3.95Å; W135-F176 HydrophobicContact CZ2-CG 3.95Å
136A98.3Very high97.3Very high0 Ų053.4 Ų53.40%027%0.273CS..Hα-helixtrans-73-30.5178.700000113.7F83 M86 L87 G132 A133 F134 Y146F83-A136 HydrophobicContact CD2-CB 3.63Å; F83-A136 WeakPolarHBondContact CD2-O 3.46Å; F83-A136 HydrophobicContact CE2-CB 3.66Å; F83-A136 HydrophobicContact CG-CB 4.44Å; F83-A136 HydrophobicContact CZ-CB 4.49Å; M86-A136 HydrophobicContact CB-CB 3.92Å; M86-A136 HydrophobicContact CG-CB 3.96Å; L87-A136 HydrophobicContact CB-CB 3.93Å; G132-A136 WeakPolarHBondContact O-CB 3.5Å; G132-A136 PolarHBondContact O-N 2.86Å; G132-A136 VanDerWaalsContact O-N 3.08Å; A133-A136 PolarHBondContact O-N 3.42Å; A133-A136 VanDerWaalsContact O-N 3.11Å; F134-A136 VanDerWaalsContact C-N 3.33Å; F134-A136 PolarHBondContact O-N 3.41Å; A136-Y146 WeakPolarHBondContact CA-OH 3.33Å; A136-Y146 WeakPolarHBondContact O-CE2 3.22Å; A136-Y146 PolarHBondContact O-OH 2.91Å
137I98.4Very high97.3Very high70 Ų7050.2 Ų50.236%0.35926%0.264SS..Hα-helixtrans-78.9-36-178.4-70.2171.7000111.4F83 A133 F134 L140 L141F83-I137 HydrophobicContact CE2-CG1 3.73Å; A133-I137 HydrophobicContact CB-CD1 4.48Å; A133-I137 WeakPolarHBondContact O-CB 3.47Å; A133-I137 WeakPolarHBondContact O-CG1 3.39Å; A133-I137 PolarHBondContact O-N 2.94Å; F134-I137 PolarHBondContact O-N 2.66Å; I137-L140 WeakPolarHBondContact O-CA 3.32Å; I137-L140 VanDerWaalsContact O-CB 3.28Å; I137-L140 WeakPolarHBondContact O-CB 3.45Å; I137-L140 PolarHBondContact O-N 3.35Å; I137-L141 HydrophobicContact CG2-CD1 3.6Å; I137-L141 HydrophobicContact CG2-CD2 4.49Å; I137-L141 HydrophobicContact CG2-CG 3.78Å; I137-L141 PolarHBondContact O-N 3.11Å
138L97.8Very high97.2Very high30 Ų3052.3 Ų52.316%0.15727%0.266CS..G310 helixtrans-49.9-46.1-173.7-78.7176.4000114.2F134 W135 L140 L141 G142 Y143 Y169F134-L138 HydrophobicContact CD1-CD1 4.34Å; F134-L138 HydrophobicContact CE1-CD1 3.73Å; F134-L138 HydrophobicContact CE2-CD1 4.38Å; F134-L138 HydrophobicContact CE2-CD2 4.33Å; F134-L138 HydrophobicContact CE2-CG 4.44Å; F134-L138 HydrophobicContact CZ-CD1 3.76Å; F134-L138 HydrophobicContact CZ-CD2 4.37Å; F134-L138 HydrophobicContact CZ-CG 4.3Å; F134-L138 WeakPolarHBondContact O-CG 3.38Å; F134-L138 PolarHBondContact O-N 3.45Å; W135-L138 HydrophobicContact CE3-CD1 3.97Å; W135-L138 HydrophobicContact CZ3-CD1 4.09Å; L138-L140 VanDerWaalsContact C-N 3.26Å; L138-L140 PolarHBondContact O-N 3.45Å; L138-L141 CarbonylContact O-C 3.56Å; L138-L141 PolarHBondContact O-N 3.27Å; L138-G142 PolarHBondContact O-N 3.46Å; L138-Y143 CarbonylContact C-O 3.31Å; L138-Y143 HydrophobicContact CD2-CD2 4.33Å; L138-Y143 HydrophobicContact CD2-CG 4.34Å; L138-Y143 PolarHBondContact O-N 3.18Å; L138-Y169 HydrophobicContact CB-CD2 4.06Å; L138-Y169 HydrophobicContact CB-CE2 3.67Å; L138-Y169 HydrophobicContact CD1-CD2 4.14Å; L138-Y169 HydrophobicContact CD1-CE2 3.97Å; L138-Y169 HydrophobicContact CG-CE2 4.5Å
139P97.3Very high96.9Very high7 Ų751.9 Ų51.95%0.04526%0.264CS..G310 helixtrans-64.9-26.3176.9-26.938.7000114.7W135 L141 G142 Y143 G144 Y146 L157 Y169W135-P139 WeakPolarHBondContact O-CD 3.22Å; P139-L141 VanDerWaalsContact C-N 3.27Å; P139-G142 PolarHBondContact O-N 2.94Å; P139-Y143 WeakPolarHBondContact CA-O 3.34Å; P139-G144 WeakPolarHBondContact CA-O 3.3Å; P139-Y146 HydrophobicContact CB-CD1 3.94Å; P139-Y146 HydrophobicContact CB-CD2 3.91Å; P139-Y146 HydrophobicContact CB-CE1 3.86Å; P139-Y146 HydrophobicContact CB-CE2 3.82Å; P139-Y146 HydrophobicContact CB-CG 3.96Å; P139-Y146 HydrophobicContact CG-CD1 4.27Å; P139-Y146 HydrophobicContact CG-CE1 3.73Å; P139-Y146 HydrophobicContact CG-CE2 4.15Å; P139-L157 HydrophobicContact CG-CD2 4.25Å; P139-Y169 HydrophobicContact CG-CD1 4.45Å; P139-Y169 HydrophobicContact CG-CE1 3.74Å; P139-Y169 HydrophobicContact CG-CE2 3.85Å; P139-Y169 WeakPolarHBondContact CG-OH 3.46Å
140L97.3Very high96.5Very high80 Ų8050.7 Ų50.742%0.41926%0.263SS..G310 helixtrans-73.1-24.7174.3-56.3177.7000111.7Q79 F83 I137 L138 Y146Q79-L140 HydrophobicContact CB-CD2 4.04Å; Q79-L140 HydrophobicContact CG-CD2 4.49Å; Q79-L140 VanDerWaalsContact OE1-CD2 3.25Å; F83-L140 HydrophobicContact CB-CD1 4.34Å; F83-L140 HydrophobicContact CD2-CD1 3.72Å; F83-L140 HydrophobicContact CE2-CD1 4.45Å; F83-L140 HydrophobicContact CG-CD1 4.27Å; I137-L140 WeakPolarHBondContact O-CA 3.32Å; I137-L140 VanDerWaalsContact O-CB 3.28Å; I137-L140 WeakPolarHBondContact O-CB 3.45Å; I137-L140 PolarHBondContact O-N 3.35Å; L138-L140 VanDerWaalsContact C-N 3.26Å; L138-L140 PolarHBondContact O-N 3.45Å; L140-Y146 HydrophobicContact CD2-CD2 3.74Å; L140-Y146 HydrophobicContact CD2-CE2 4.03Å; L140-Y146 HydrophobicContact CG-CD2 4.35Å; L140-Y146 HydrophobicContact CG-CE2 4.18Å
141L96.7Very high96Very high124 Ų12446.2 Ų46.265%0.64924%0.239SC*.G310 helixtrans-93.42.7177.2-59-178.7000113.1I137 L138 P139I137-L141 HydrophobicContact CG2-CD1 3.6Å; I137-L141 HydrophobicContact CG2-CD2 4.49Å; I137-L141 HydrophobicContact CG2-CG 3.78Å; I137-L141 PolarHBondContact O-N 3.11Å; L138-L141 CarbonylContact O-C 3.56Å; L138-L141 PolarHBondContact O-N 3.27Å; P139-L141 VanDerWaalsContact C-N 3.27Å
142G93.7Very high95.7Very high46 Ų4649.7 Ų49.747%0.47425%0.252SS..THydrogen-bonded Turntrans892.8178.800000115.6L138 P139 G144 S165L138-G142 PolarHBondContact O-N 3.46Å; P139-G142 PolarHBondContact O-N 2.94Å; G142-G144 CarbonylContact C-O 3.49Å; G142-G144 VanDerWaalsContact C-O 3.31Å; G142-G144 PolarHBondContact O-N 2.71Å; G142-S165 PolarHBondContact O-OG 3.33Å
143Y95Very high95.5Very high146 Ų14649.9 Ų49.957%0.57325%0.253SS*.SBendtrans-88.989.2167-74.5-82.5000109.1L138 P139 S165 Y169L138-Y143 CarbonylContact C-O 3.31Å; L138-Y143 HydrophobicContact CD2-CD2 4.33Å; L138-Y143 HydrophobicContact CD2-CG 4.34Å; L138-Y143 PolarHBondContact O-N 3.18Å; P139-Y143 WeakPolarHBondContact CA-O 3.34Å; Y143-S165 WeakPolarHBondContact CA-OG 3.29Å; Y143-Y169 WeakPolarHBondContact O-CD2 3.47Å
144G95.2Very high95.3Very high0 Ų048.7 Ų48.70%024%0.244CC..SBendtrans82179.5-157.800000112P139 G142 S165 M166P139-G144 WeakPolarHBondContact CA-O 3.3Å; G142-G144 CarbonylContact C-O 3.49Å; G142-G144 VanDerWaalsContact C-O 3.31Å; G142-G144 PolarHBondContact O-N 2.71Å; G144-S165 PolarHBondContact N-OG 3.5Å; G144-M166 VanDerWaalsContact C-SD 3.58Å; G144-M166 WeakPolarHBondContact CA-SD 3.48Å
145R96.6Very high95.1Very high58 Ų5843.5 Ų43.522%0.21922%0.221CC..  trans-149.8139.5-173.7-46.6-169-60.3-97.7-0.9110.6D158 N161 D163 M166R145-D158 HydrophobicContact CB-CB 4.38Å; R145-D158 IonicContact CZ-OD2 2.66Å; R145-D158 IonicContact NE-OD2 3.9Å; R145-D158 PolarHBondContact NE-OD2 3.22Å; R145-D158 IonicContact NH2-OD1 3.94Å; R145-D158 IonicContact NH2-OD2 3.35Å; R145-D158 PolarHBondContact NH2-OD2 2.96Å; R145-D158 PolarHBondContact O-N 2.99Å; R145-N161 VanDerWaalsContact NH2-CB 3.32Å; R145-N161 PolarHBondContact NH2-O 2.89Å; R145-D163 IonicContact CZ-OD2 2.68Å; R145-D163 IonicContact NH1-OD1 2.68Å; R145-D163 PolarHBondContact NH1-OD1 2.87Å; R145-D163 VanDerWaalsContact NH1-OD1 3.15Å; R145-D163 IonicContact NH1-OD2 3.15Å; R145-D163 PolarHBondContact NH1-OD2 3.21Å; R145-M166 HydrophobicContact CB-SD 3.75Å; R145-M166 HydrophobicContact CG-CG 4.26Å; R145-M166 HydrophobicContact CG-SD 3.73Å; R145-M166 PolarHBondContact N-SD 3.2Å
146Y97Very high95Very high11 Ų1143.5 Ų43.54%0.04322%0.222CC..EExtended strand (participates in β ladder)trans-95.2137.2163.9-62.6-44.6000111.9Q79 S82 F83 M86 A136 P139 L140 L156 L157Q79-Y146 PolarHBondContact NE2-O 3.37Å; S82-Y146 VanDerWaalsContact CB-CD1 3.42Å; F83-Y146 HydrophobicContact CB-CE2 4.25Å; M86-Y146 WeakPolarHBondContact CB-OH 3.17Å; M86-Y146 WeakPolarHBondContact CG-OH 3.15Å; A136-Y146 WeakPolarHBondContact CA-OH 3.33Å; A136-Y146 WeakPolarHBondContact O-CE2 3.22Å; A136-Y146 PolarHBondContact O-OH 2.91Å; P139-Y146 HydrophobicContact CB-CD1 3.94Å; P139-Y146 HydrophobicContact CB-CD2 3.91Å; P139-Y146 HydrophobicContact CB-CE1 3.86Å; P139-Y146 HydrophobicContact CB-CE2 3.82Å; P139-Y146 HydrophobicContact CB-CG 3.96Å; P139-Y146 HydrophobicContact CG-CD1 4.27Å; P139-Y146 HydrophobicContact CG-CE1 3.73Å; P139-Y146 HydrophobicContact CG-CE2 4.15Å; L140-Y146 HydrophobicContact CD2-CD2 3.74Å; L140-Y146 HydrophobicContact CD2-CE2 4.03Å; L140-Y146 HydrophobicContact CG-CD2 4.35Å; L140-Y146 HydrophobicContact CG-CE2 4.18Å; Y146-L156 CarbonylContact C-O 3.6Å; Y146-L156 WeakPolarHBondContact CA-O 3.35Å; Y146-L156 WeakPolarHBondContact CB-O 3.45Å; Y146-L156 WeakPolarHBondContact CD1-O 3.39Å; Y146-L157 HydrophobicContact CD1-CD2 3.78Å; Y146-L157 HydrophobicContact CE1-CD2 3.62Å
147T95.8Very high94.8Very high49 Ų4943.8 Ų43.830%0.30122%0.224SC..EExtended strand (participates in β ladder)trans-150.4174.9178.8-1660000111.1E149 C155 L156 D158T147-E149 PolarHBondContact O-N 2.84Å; T147-C155 VanDerWaalsContact O-CA 3.24Å; T147-C155 WeakPolarHBondContact O-CA 3.2Å; T147-C155 WeakPolarHBondContact O-CB 3.4Å; T147-L156 PolarHBondContact N-O 3.26Å; T147-L156 PolarHBondContact O-N 3.21Å; T147-D158 VanDerWaalsContact CG2-CA 3.44Å; T147-D158 HydrophobicContact CG2-CB 3.51Å
148L94.8Very high94.5Very high76 Ų7641.2 Ų41.240%0.39821%0.21SC..EExtended strand (participates in β ladder)trans-61.2127.2169.9-97.5139.7000110.4W71 K152W71-L148 HydrophobicContact CB-CD2 3.69Å; W71-L148 HydrophobicContact CB-CG 4.47Å; L148-K152 VanDerWaalsContact CD2-C 3.46Å; L148-K152 VanDerWaalsContact CD2-CA 3.49Å; L148-K152 HydrophobicContact CD2-CB 4Å; L148-K152 VanDerWaalsContact CD2-O 3.23Å; L148-K152 WeakPolarHBondContact CD2-O 3.31Å
149E92.6Very high94.1Very high2 Ų240 Ų401%0.00920%0.204CC..  trans-63.8159173.2-65.6-140103.100110.6T147 H151 K152 S154 L156 W159T147-E149 PolarHBondContact O-N 2.84Å; E149-H151 PolarHBondContact O-N 2.97Å; E149-H151 IonicContact OE2-NE2 2.8Å; E149-K152 WeakPolarHBondContact O-CA 3.18Å; E149-K152 PolarHBondContact O-N 2.92Å; E149-S154 PolarHBondContact N-O 3.17Å; E149-S154 PolarHBondContact OE2-OG 3.38Å; E149-L156 HydrophobicContact CG-CB 4.06Å; E149-W159 PolarHBondContact OE1-NE1 2.96Å
150P89.6Confident93.4Very high25 Ų2542.9 Ų42.916%0.16222%0.221CC..THydrogen-bonded Turntrans-55.6-28.5-174.1-30.537.5000115.3K152 L244 P248 Y251P150-K152 VanDerWaalsContact C-N 3.28Å; P150-L244 HydrophobicContact CB-CD1 4.07Å; P150-L244 HydrophobicContact CB-CD2 4.04Å; P150-L244 HydrophobicContact CG-CD1 3.44Å; P150-L244 VanDerWaalsContact CG-CD1 3.44Å; P150-L244 HydrophobicContact CG-CD2 4.25Å; P150-P248 HydrophobicContact CB-CB 4.25Å; P150-P248 HydrophobicContact CB-CG 4.31Å; P150-Y251 HydrophobicContact CB-CD2 4.15Å; P150-Y251 HydrophobicContact CB-CE2 4.4Å; P150-Y251 HydrophobicContact CG-CD1 4.14Å; P150-Y251 HydrophobicContact CG-CD2 3.82Å; P150-Y251 HydrophobicContact CG-CE1 4.25Å; P150-Y251 HydrophobicContact CG-CE2 3.92Å; P150-Y251 HydrophobicContact CG-CG 3.95Å
151H89.1Confident92.8Very high25 Ų2543.1 Ų43.112%0.11622%0.223CC..THydrogen-bonded Turntrans-81.4-3.8175.85976.4000113.8E149 T153 S154 P248E149-H151 PolarHBondContact O-N 2.97Å; E149-H151 IonicContact OE2-NE2 2.8Å; H151-T153 VanDerWaalsContact C-N 3.28Å; H151-T153 PolarHBondContact CE1-OG1 3.45Å; H151-T153 PolarHBondContact ND1-N 2.99Å; H151-T153 PolarHBondContact ND1-OG1 2.86Å; H151-T153 WeakPolarHBondContact O-CG2 3.4Å; H151-T153 PolarHBondContact O-N 3.49Å; H151-S154 PolarHBondContact CE1-OG 2.86Å; H151-P248 HydrophobicContact CB-CB 4.06Å
152K92.1Very high92.5Very high143 Ų14337.6 Ų37.662%0.62219%0.194SC*.SBendtrans64.814.1172.2-53.3-174.8179.2-175.60117.2G70 W71 L148 E149 P150G70-K152 CarbonylContact C-O 3.56Å; G70-K152 WeakPolarHBondContact CA-O 3.2Å; W71-K152 PolarHBondContact N-O 3.32Å; L148-K152 VanDerWaalsContact CD2-C 3.46Å; L148-K152 VanDerWaalsContact CD2-CA 3.49Å; L148-K152 HydrophobicContact CD2-CB 4Å; L148-K152 VanDerWaalsContact CD2-O 3.23Å; L148-K152 WeakPolarHBondContact CD2-O 3.31Å; E149-K152 WeakPolarHBondContact O-CA 3.18Å; E149-K152 PolarHBondContact O-N 2.92Å; P150-K152 VanDerWaalsContact C-N 3.28Å
153T92.4Very high92.4Very high4 Ų438.3 Ų38.33%0.02519%0.187CC..SBendtrans-113.5-2-175.864.60000113.8G65 V66 H151G65-T153 WeakPolarHBondContact O-CG2 3.36Å; V66-T153 HydrophobicContact CB-CG2 4.48Å; V66-T153 HydrophobicContact CG2-CG2 4.07Å; V66-T153 WeakPolarHBondContact CG2-OG1 3.29Å; H151-T153 VanDerWaalsContact C-N 3.28Å; H151-T153 PolarHBondContact CE1-OG1 3.45Å; H151-T153 PolarHBondContact ND1-N 2.99Å; H151-T153 PolarHBondContact ND1-OG1 2.86Å; H151-T153 WeakPolarHBondContact O-CG2 3.4Å; H151-T153 PolarHBondContact O-N 3.49Å
154S94.3Very high92.4Very high0 Ų039.5 Ų39.50%020%0.198CC..SBendtrans-153.2174.1173.874.40000109.2E149 H151 Q255E149-S154 PolarHBondContact N-O 3.17Å; E149-S154 PolarHBondContact OE2-OG 3.38Å; H151-S154 PolarHBondContact CE1-OG 2.86Å; S154-Q255 VanDerWaalsContact CB-OE1 3.31Å; S154-Q255 VanDerWaalsContact OG-CD 3.25Å; S154-Q255 PolarHBondContact OG-NE2 2.76Å; S154-Q255 PolarHBondContact OG-OE1 3.02Å
155C95.8Very high92.4Very high0 Ų041.1 Ų41.10%021%0.209CC..EExtended strand (participates in β ladder)trans-125.3144.3179.7-63.80000111.2C78 Y81 S82 T147C78-C155 WeakPolarHBondContact CA-SG 3.37Å; C78-C155 HydrophobicContact CB-CB 3.97Å; C78-C155 WeakPolarHBondContact CB-SG 3.49Å; C78-C155 WeakPolarHBondContact SG-CB 3.4Å; C78-C155 CovalentContact SG-SG 2.02Å; C78-C155 PolarHBondContact SG-SG 3.44Å; Y81-C155 HydrophobicContact CD1-CB 4.19Å; Y81-C155 WeakPolarHBondContact CD1-O 3.35Å; Y81-C155 WeakPolarHBondContact CE1-O 3.49Å; S82-C155 WeakPolarHBondContact OG-CB 3.45Å; S82-C155 PolarHBondContact OG-O 3.43Å; T147-C155 VanDerWaalsContact O-CA 3.24Å; T147-C155 WeakPolarHBondContact O-CA 3.2Å; T147-C155 WeakPolarHBondContact O-CB 3.4Å
156L94.1Very high92.3Very high17 Ų1738.4 Ų38.49%0.08920%0.199CC..EExtended strand (participates in β ladder)trans-158.3-130.8167.6-163.863.4000107.9S82 Y146 T147 E149 W159 Y231S82-L156 WeakPolarHBondContact OG-CA 3.32Å; S82-L156 PolarHBondContact OG-N 3.05Å; Y146-L156 CarbonylContact C-O 3.6Å; Y146-L156 WeakPolarHBondContact CA-O 3.35Å; Y146-L156 WeakPolarHBondContact CB-O 3.45Å; Y146-L156 WeakPolarHBondContact CD1-O 3.39Å; T147-L156 PolarHBondContact N-O 3.26Å; T147-L156 PolarHBondContact O-N 3.21Å; E149-L156 HydrophobicContact CG-CB 4.06Å; L156-W159 HydrophobicContact CD2-CZ2 4.19Å; L156-Y231 HydrophobicContact CD2-CD1 3.87Å; L156-Y231 HydrophobicContact CD2-CE1 3.17Å; L156-Y231 HydrophobicContact CD2-CE2 4.34Å; L156-Y231 VanDerWaalsContact CD2-CZ 3.43Å
157L94.1Very high92.1Very high7 Ų742.4 Ų42.44%0.03722%0.217CC..EExtended strand (participates in β ladder)trans-82.8152.9-178.6-62.8175.9000111.2M86 P139 Y146 W159 M166 Y169 M170 L173M86-L157 HydrophobicContact CE-CD1 4.02Å; M86-L157 HydrophobicContact CE-CD2 4.2Å; M86-L157 HydrophobicContact CE-CG 4.2Å; P139-L157 HydrophobicContact CG-CD2 4.25Å; Y146-L157 HydrophobicContact CD1-CD2 3.78Å; Y146-L157 HydrophobicContact CE1-CD2 3.62Å; L157-W159 HydrophobicContact CB-CH2 4.38Å; L157-W159 HydrophobicContact CB-CZ2 4.11Å; L157-W159 HydrophobicContact CD1-CH2 4.24Å; L157-W159 PolarHBondContact O-N 3.36Å; L157-W159 VanDerWaalsContact O-N 3.11Å; L157-W159 PolarHBondContact O-NE1 3.05Å; L157-M166 HydrophobicContact CB-CE 4.31Å; L157-Y169 HydrophobicContact CD1-CE1 4.04Å; L157-Y169 HydrophobicContact CD2-CD1 4.17Å; L157-Y169 HydrophobicContact CD2-CE1 3.48Å; L157-Y169 VanDerWaalsContact CD2-CE1 3.48Å; L157-Y169 HydrophobicContact CG-CE1 4.43Å; L157-M170 HydrophobicContact CB-CE 4.1Å; L157-L173 HydrophobicContact CD1-CD1 3.81Å
158D92.3Very high92.1Very high15 Ų1545.1 Ų45.18%0.0823%0.229CC..  trans-75.698.9174.8-166.1-23.6000111.9R145 T147 T160 N161 M162 M166 M170R145-D158 HydrophobicContact CB-CB 4.38Å; R145-D158 IonicContact CZ-OD2 2.66Å; R145-D158 IonicContact NE-OD2 3.9Å; R145-D158 PolarHBondContact NE-OD2 3.22Å; R145-D158 IonicContact NH2-OD1 3.94Å; R145-D158 IonicContact NH2-OD2 3.35Å; R145-D158 PolarHBondContact NH2-OD2 2.96Å; R145-D158 PolarHBondContact O-N 2.99Å; T147-D158 VanDerWaalsContact CG2-CA 3.44Å; T147-D158 HydrophobicContact CG2-CB 3.51Å; D158-T160 VanDerWaalsContact C-N 3.29Å; D158-T160 WeakPolarHBondContact OD1-CA 3.23Å; D158-T160 WeakPolarHBondContact OD1-CB 3.42Å; D158-T160 PolarHBondContact OD1-N 3.42Å; D158-T160 PolarHBondContact OD1-OG1 3.41Å; D158-N161 PolarHBondContact OD1-N 3.01Å; D158-M162 WeakPolarHBondContact O-CE 3.21Å; D158-M166 HydrophobicContact CB-CE 4.12Å; D158-M166 HydrophobicContact CB-SD 4.19Å; D158-M166 WeakPolarHBondContact O-CE 3.36Å; D158-M170 WeakPolarHBondContact O-CE 3.11Å
159W89.2Confident92.1Very high5 Ų541.9 Ų41.92%0.01921%0.211CC..  trans-79.7-9.5176.2-49.2106.6000114E149 L156 L157 M170 Y231 L234 A235 Y251E149-W159 PolarHBondContact OE1-NE1 2.96Å; L156-W159 HydrophobicContact CD2-CZ2 4.19Å; L157-W159 HydrophobicContact CB-CH2 4.38Å; L157-W159 HydrophobicContact CB-CZ2 4.11Å; L157-W159 HydrophobicContact CD1-CH2 4.24Å; L157-W159 PolarHBondContact O-N 3.36Å; L157-W159 VanDerWaalsContact O-N 3.11Å; L157-W159 PolarHBondContact O-NE1 3.05Å; W159-M170 HydrophobicContact CD2-CE 4.31Å; W159-M170 HydrophobicContact CE3-CE 3.57Å; W159-M170 HydrophobicContact CE3-SD 4.16Å; W159-M170 HydrophobicContact CZ3-CE 3.73Å; W159-M170 HydrophobicContact CZ3-SD 3.97Å; W159-Y231 HydrophobicContact CH2-CD1 4.01Å; W159-Y231 AromaticContact CZ2-CD1 3.75Å; W159-Y231 HydrophobicContact CZ2-CD1 3.75Å; W159-Y231 AromaticContact CZ2-CE1 3.87Å; W159-Y231 HydrophobicContact CZ2-CE1 3.87Å; W159-L234 HydrophobicContact CH2-CB 4.4Å; W159-L234 HydrophobicContact CZ3-CB 4.25Å; W159-A235 HydrophobicContact CZ3-CB 4.18Å; W159-Y251 HydrophobicContact CB-CD1 4.45Å; W159-Y251 HydrophobicContact CB-CE1 3.67Å; W159-Y251 AromaticContact CD1-CD1 3.57Å; W159-Y251 AromaticContact CD1-CE1 3.67Å; W159-Y251 HydrophobicContact CD2-CD1 4.34Å; W159-Y251 HydrophobicContact CD2-CE1 4.03Å; W159-Y251 AromaticContact CG-CD1 3.87Å; W159-Y251 HydrophobicContact CG-CD1 3.87Å; W159-Y251 AromaticContact CG-CE1 3.49Å; W159-Y251 HydrophobicContact CG-CE1 3.49Å; W159-Y251 VanDerWaalsContact CG-CE1 3.49Å; W159-Y251 AromaticContact NE1-CD1 3.83Å
160T83.3Confident92.2Very high67 Ų6741.8 Ų41.841%0.41121%0.211SC..SBendtrans-94.3-30.3-166.766.10000113.2D158 L244D158-T160 VanDerWaalsContact C-N 3.29Å; D158-T160 WeakPolarHBondContact OD1-CA 3.23Å; D158-T160 WeakPolarHBondContact OD1-CB 3.42Å; D158-T160 PolarHBondContact OD1-N 3.42Å; D158-T160 PolarHBondContact OD1-OG1 3.41Å; T160-L244 HydrophobicContact CG2-CB 4.34Å; T160-L244 HydrophobicContact CG2-CD1 4.15Å; T160-L244 HydrophobicContact CG2-CD2 4.47Å
161N85.1Confident92.4Very high86 Ų8646.3 Ų46.346%0.4623%0.228SC..  trans-133100.3-175.7174.316.7000111R145 D158 D163R145-N161 VanDerWaalsContact NH2-CB 3.32Å; R145-N161 PolarHBondContact NH2-O 2.89Å; D158-N161 PolarHBondContact OD1-N 3.01Å; N161-D163 PolarHBondContact O-N 3.29Å
162M90.1Very high92.7Very high8 Ų846.3 Ų46.34%0.03923%0.231CC..  trans-89.564-177.5-67-71.1149.600111.9D158 M166 K167 M170 S238D158-M162 WeakPolarHBondContact O-CE 3.21Å; M162-M166 HydrophobicContact SD-CB 4.46Å; M162-K167 HydrophobicContact CB-CG 4.07Å; M162-K167 WeakPolarHBondContact O-CD 3.46Å; M162-K167 WeakPolarHBondContact O-CE 3.35Å; M162-K167 PolarHBondContact O-NZ 2.87Å; M162-M170 HydrophobicContact CE-CE 3.2Å; M162-M170 HydrophobicContact CE-SD 3.45Å; M162-M170 WeakPolarHBondContact CE-SD 3.45Å; M162-M170 HydrophobicContact SD-CE 4.06Å; M162-M170 HydrophobicContact SD-SD 3.76Å; M162-S238 VanDerWaalsContact CE-CB 3.41Å
163D92.5Very high92.8Very high60 Ų6040 Ų4032%0.32120%0.204SC..  trans-66.5175166.8705.4000111.4R145 N161 S165 M166 K167R145-D163 IonicContact CZ-OD2 2.68Å; R145-D163 IonicContact NH1-OD1 2.68Å; R145-D163 PolarHBondContact NH1-OD1 2.87Å; R145-D163 VanDerWaalsContact NH1-OD1 3.15Å; R145-D163 IonicContact NH1-OD2 3.15Å; R145-D163 PolarHBondContact NH1-OD2 3.21Å; N161-D163 PolarHBondContact O-N 3.29Å; D163-S165 VanDerWaalsContact C-N 3.29Å; D163-S165 PolarHBondContact O-N 3.48Å; D163-S165 PolarHBondContact OD1-N 2.89Å; D163-M166 PolarHBondContact O-N 3.01Å; D163-M166 WeakPolarHBondContact OD1-CB 3.31Å; D163-M166 WeakPolarHBondContact OD1-CG 3.48Å; D163-M166 PolarHBondContact OD1-N 3.45Å; D163-K167 WeakPolarHBondContact O-CB 3.29Å; D163-K167 WeakPolarHBondContact O-CG 3.46Å; D163-K167 PolarHBondContact O-N 3.28Å
164E93.6Very high92.8Very high172 Ų17242 Ų4280%0.80421%0.213SC*.Hα-helixtrans-59.7-39.4-176.4-64.9-171.6154.500112.7K167 L168E164-K167 PolarHBondContact O-N 3.47Å; E164-L168 WeakPolarHBondContact O-CB 3.48Å; E164-L168 PolarHBondContact O-N 3.27Å
165S95.1Very high92.9Very high34 Ų3444.7 Ų44.724%0.23823%0.226CC..Hα-helixtrans-63.3-48.6178.1-178.70000111.6G142 Y143 G144 D163 L168 Y169G142-S165 PolarHBondContact O-OG 3.33Å; Y143-S165 WeakPolarHBondContact CA-OG 3.29Å; G144-S165 PolarHBondContact N-OG 3.5Å; D163-S165 VanDerWaalsContact C-N 3.29Å; D163-S165 PolarHBondContact O-N 3.48Å; D163-S165 PolarHBondContact OD1-N 2.89Å; S165-L168 PolarHBondContact O-N 3.12Å; S165-Y169 WeakPolarHBondContact O-CB 3.24Å; S165-Y169 PolarHBondContact O-N 3.39Å
166M94.6Very high92.9Very high0 Ų049.1 Ų49.10%025%0.245CC..Hα-helixtrans-62.7-43.1176-75.9-57.1-5200112.2G144 R145 L157 D158 M162 D163 Y169 M170G144-M166 VanDerWaalsContact C-SD 3.58Å; G144-M166 WeakPolarHBondContact CA-SD 3.48Å; R145-M166 HydrophobicContact CB-SD 3.75Å; R145-M166 HydrophobicContact CG-CG 4.26Å; R145-M166 HydrophobicContact CG-SD 3.73Å; R145-M166 PolarHBondContact N-SD 3.2Å; L157-M166 HydrophobicContact CB-CE 4.31Å; D158-M166 HydrophobicContact CB-CE 4.12Å; D158-M166 HydrophobicContact CB-SD 4.19Å; D158-M166 WeakPolarHBondContact O-CE 3.36Å; M162-M166 HydrophobicContact SD-CB 4.46Å; D163-M166 PolarHBondContact O-N 3.01Å; D163-M166 WeakPolarHBondContact OD1-CB 3.31Å; D163-M166 WeakPolarHBondContact OD1-CG 3.48Å; D163-M166 PolarHBondContact OD1-N 3.45Å; M166-Y169 PolarHBondContact O-N 2.96Å; M166-M170 HydrophobicContact CE-CE 3.34Å; M166-M170 HydrophobicContact CE-CG 4.3Å; M166-M170 WeakPolarHBondContact O-CB 3.08Å; M166-M170 WeakPolarHBondContact O-CG 3.4Å; M166-M170 PolarHBondContact O-N 3.35Å
167K94.1Very high92.9Very high96 Ų9648.3 Ų48.342%0.41724%0.241SC..Hα-helixtrans-60.3-49.4178.1-78.4170.7172.1158.20111.5M162 D163 E164 Y169 M170 F171 L239M162-K167 HydrophobicContact CB-CG 4.07Å; M162-K167 WeakPolarHBondContact O-CD 3.46Å; M162-K167 WeakPolarHBondContact O-CE 3.35Å; M162-K167 PolarHBondContact O-NZ 2.87Å; D163-K167 WeakPolarHBondContact O-CB 3.29Å; D163-K167 WeakPolarHBondContact O-CG 3.46Å; D163-K167 PolarHBondContact O-N 3.28Å; E164-K167 PolarHBondContact O-N 3.47Å; K167-Y169 PolarHBondContact O-N 3.11Å; K167-M170 PolarHBondContact O-N 2.81Å; K167-F171 VanDerWaalsContact O-CB 3.26Å; K167-F171 WeakPolarHBondContact O-CB 3.19Å; K167-F171 PolarHBondContact O-N 3Å; K167-L239 HydrophobicContact CB-CD2 4.11Å; K167-L239 HydrophobicContact CG-CD2 4.05Å
168L94.9Very high92.8Very high106 Ų10649.4 Ų49.456%0.55525%0.245SC*.Hα-helixtrans-62.7-43.8179.7-17861.8000111.3E164 S165 S172E164-L168 WeakPolarHBondContact O-CB 3.48Å; E164-L168 PolarHBondContact O-N 3.27Å; S165-L168 PolarHBondContact O-N 3.12Å; L168-S172 VanDerWaalsContact O-CB 3.27Å; L168-S172 WeakPolarHBondContact O-CB 3.43Å; L168-S172 PolarHBondContact O-N 2.83Å; L168-S172 PolarHBondContact O-OG 3.42Å
169Y95.6Very high93Very high7 Ų753 Ų533%0.02726%0.264CS..Hα-helixtrans-64-47.6178.3-179.8-100.5000112.1W135 L138 P139 Y143 L157 S165 M166 K167 S172 L173W135-Y169 HydrophobicContact CE3-CE2 4.11Å; W135-Y169 PolarHBondContact O-OH 2.98Å; L138-Y169 HydrophobicContact CB-CD2 4.06Å; L138-Y169 HydrophobicContact CB-CE2 3.67Å; L138-Y169 HydrophobicContact CD1-CD2 4.14Å; L138-Y169 HydrophobicContact CD1-CE2 3.97Å; L138-Y169 HydrophobicContact CG-CE2 4.5Å; P139-Y169 HydrophobicContact CG-CD1 4.45Å; P139-Y169 HydrophobicContact CG-CE1 3.74Å; P139-Y169 HydrophobicContact CG-CE2 3.85Å; P139-Y169 WeakPolarHBondContact CG-OH 3.46Å; Y143-Y169 WeakPolarHBondContact O-CD2 3.47Å; L157-Y169 HydrophobicContact CD1-CE1 4.04Å; L157-Y169 HydrophobicContact CD2-CD1 4.17Å; L157-Y169 HydrophobicContact CD2-CE1 3.48Å; L157-Y169 VanDerWaalsContact CD2-CE1 3.48Å; L157-Y169 HydrophobicContact CG-CE1 4.43Å; S165-Y169 WeakPolarHBondContact O-CB 3.24Å; S165-Y169 PolarHBondContact O-N 3.39Å; M166-Y169 PolarHBondContact O-N 2.96Å; K167-Y169 PolarHBondContact O-N 3.11Å; Y169-S172 PolarHBondContact O-N 3.11Å; Y169-L173 HydrophobicContact CD1-CD1 3.93Å; Y169-L173 HydrophobicContact CD1-CG 4.37Å; Y169-L173 HydrophobicContact CE1-CD1 3.21Å; Y169-L173 HydrophobicContact CE1-CG 3.87Å; Y169-L173 HydrophobicContact CE2-CD1 4.48Å; Y169-L173 HydrophobicContact CE2-CG 4.33Å; Y169-L173 PolarHBondContact O-N 3.37Å
170M93.5Very high93.3Very high1 Ų156.9 Ų56.91%0.00528%0.284CS..Hα-helixtrans-64.5-42178.4-73.6-161.3-173.800112.5L157 D158 W159 M162 M166 K167 S172 L173 F174 L239L157-M170 HydrophobicContact CB-CE 4.1Å; D158-M170 WeakPolarHBondContact O-CE 3.11Å; W159-M170 HydrophobicContact CD2-CE 4.31Å; W159-M170 HydrophobicContact CE3-CE 3.57Å; W159-M170 HydrophobicContact CE3-SD 4.16Å; W159-M170 HydrophobicContact CZ3-CE 3.73Å; W159-M170 HydrophobicContact CZ3-SD 3.97Å; M162-M170 HydrophobicContact CE-CE 3.2Å; M162-M170 HydrophobicContact CE-SD 3.45Å; M162-M170 WeakPolarHBondContact CE-SD 3.45Å; M162-M170 HydrophobicContact SD-CE 4.06Å; M162-M170 HydrophobicContact SD-SD 3.76Å; M166-M170 HydrophobicContact CE-CE 3.34Å; M166-M170 HydrophobicContact CE-CG 4.3Å; M166-M170 WeakPolarHBondContact O-CB 3.08Å; M166-M170 WeakPolarHBondContact O-CG 3.4Å; M166-M170 PolarHBondContact O-N 3.35Å; K167-M170 PolarHBondContact O-N 2.81Å; M170-S172 VanDerWaalsContact C-N 3.31Å; M170-S172 PolarHBondContact O-N 3.47Å; M170-L173 PolarHBondContact O-N 3.27Å; M170-F174 WeakPolarHBondContact O-CB 3.18Å; M170-F174 PolarHBondContact O-N 2.68Å; M170-L239 HydrophobicContact CB-CD1 4.16Å; M170-L239 HydrophobicContact CB-CD2 4.03Å; M170-L239 HydrophobicContact CB-CG 4.12Å
171F94Very high94Very high119 Ų11954 Ų5452%0.52227%0.266SS..Hα-helixtrans-61.9-42.4175.8-178.2-99.7000111.1K167 F174 I175 L239K167-F171 VanDerWaalsContact O-CB 3.26Å; K167-F171 WeakPolarHBondContact O-CB 3.19Å; K167-F171 PolarHBondContact O-N 3Å; F171-F174 WeakPolarHBondContact O-CB 3.18Å; F171-F174 PolarHBondContact O-N 2.93Å; F171-I175 HydrophobicContact CE1-CG1 4.08Å; F171-I175 HydrophobicContact CE2-CG1 4.45Å; F171-I175 HydrophobicContact CZ-CD1 4.37Å; F171-I175 HydrophobicContact CZ-CG1 4.05Å; F171-I175 WeakPolarHBondContact O-CG1 3.42Å; F171-I175 PolarHBondContact O-N 3.24Å; F171-L239 HydrophobicContact CB-CD1 4.4Å
172S95.4Very high94.6Very high25 Ų2550.7 Ų50.718%0.17525%0.248CC..Hα-helixtrans-62.8-46176-59.50000111.8L168 Y169 M170 F174 I175 F176L168-S172 VanDerWaalsContact O-CB 3.27Å; L168-S172 WeakPolarHBondContact O-CB 3.43Å; L168-S172 PolarHBondContact O-N 2.83Å; L168-S172 PolarHBondContact O-OG 3.42Å; Y169-S172 PolarHBondContact O-N 3.11Å; M170-S172 VanDerWaalsContact C-N 3.31Å; M170-S172 PolarHBondContact O-N 3.47Å; S172-F174 VanDerWaalsContact C-N 3.29Å; S172-F174 PolarHBondContact O-N 2.84Å; S172-I175 PolarHBondContact O-N 3.32Å; S172-F176 WeakPolarHBondContact O-CB 3.25Å; S172-F176 VanDerWaalsContact O-CD2 3.29Å; S172-F176 WeakPolarHBondContact O-CD2 3.26Å; S172-F176 PolarHBondContact O-N 3.08Å
173L94.2Very high94.9Very high12 Ų1252 Ų526%0.06326%0.264CS..Iπ-helixtrans-59.3-40.7174-81-176.9000112M86 M90 W135 L157 Y169 M170 G177 Y178M86-L173 HydrophobicContact CE-CD1 3.83Å; M86-L173 HydrophobicContact SD-CD1 4.42Å; M86-L173 HydrophobicContact SD-CD2 4.35Å; M90-L173 HydrophobicContact CE-CD2 3.89Å; M90-L173 HydrophobicContact SD-CD2 4.12Å; W135-L173 HydrophobicContact CB-CD2 4.17Å; W135-L173 HydrophobicContact CD2-CD2 3.8Å; W135-L173 HydrophobicContact CE3-CD2 3.53Å; W135-L173 HydrophobicContact CE3-CG 4.2Å; W135-L173 HydrophobicContact CG-CD2 4.08Å; W135-L173 HydrophobicContact CZ3-CD2 4.25Å; L157-L173 HydrophobicContact CD1-CD1 3.81Å; Y169-L173 HydrophobicContact CD1-CD1 3.93Å; Y169-L173 HydrophobicContact CD1-CG 4.37Å; Y169-L173 HydrophobicContact CE1-CD1 3.21Å; Y169-L173 HydrophobicContact CE1-CG 3.87Å; Y169-L173 HydrophobicContact CE2-CD1 4.48Å; Y169-L173 HydrophobicContact CE2-CG 4.33Å; Y169-L173 PolarHBondContact O-N 3.37Å; M170-L173 PolarHBondContact O-N 3.27Å; L173-G177 CarbonylContact O-C 3.51Å; L173-G177 WeakPolarHBondContact O-CA 3.46Å; L173-G177 PolarHBondContact O-N 3.4Å; L173-Y178 WeakPolarHBondContact O-CD2 3.5Å; L173-Y178 PolarHBondContact O-N 2.93Å
174F93.4Very high95.2Very high46 Ų4652.5 Ų52.520%0.20227%0.266CS..Iπ-helixtrans-61.2-47.6178.1-178.1-113.2000111.7M170 F171 S172 Y178 I179 I236M170-F174 WeakPolarHBondContact O-CB 3.18Å; M170-F174 PolarHBondContact O-N 2.68Å; F171-F174 WeakPolarHBondContact O-CB 3.18Å; F171-F174 PolarHBondContact O-N 2.93Å; S172-F174 VanDerWaalsContact C-N 3.29Å; S172-F174 PolarHBondContact O-N 2.84Å; F174-Y178 VanDerWaalsContact O-CB 3.27Å; F174-Y178 WeakPolarHBondContact O-CB 3.35Å; F174-Y178 PolarHBondContact O-N 3.09Å; F174-I179 HydrophobicContact CD1-CG1 4.23Å; F174-I179 HydrophobicContact CE1-CD1 4.08Å; F174-I179 HydrophobicContact CE1-CG1 3.78Å; F174-I179 HydrophobicContact CE2-CD1 4.18Å; F174-I179 HydrophobicContact CE2-CG1 4.29Å; F174-I179 HydrophobicContact CZ-CD1 3.66Å; F174-I179 HydrophobicContact CZ-CG1 3.82Å; F174-I179 PolarHBondContact O-N 3.48Å; F174-I236 HydrophobicContact CD2-CD1 4.22Å; F174-I236 HydrophobicContact CD2-CG1 4.01Å; F174-I236 HydrophobicContact CE1-CD1 4.35Å; F174-I236 HydrophobicContact CE1-CG1 4.44Å; F174-I236 HydrophobicContact CE2-CD1 3.48Å; F174-I236 VanDerWaalsContact CE2-CD1 3.48Å; F174-I236 HydrophobicContact CE2-CG1 3.79Å; F174-I236 HydrophobicContact CG-CG1 4.46Å; F174-I236 HydrophobicContact CZ-CD1 3.54Å; F174-I236 HydrophobicContact CZ-CG1 4Å
175I95.2Very high95.4Very high55 Ų5544.3 Ų44.328%0.28223%0.227SC..Iπ-helixtrans-70.7-54.1-179.8-60.3-56.8000111.6F171 S172 I179 L180F171-I175 HydrophobicContact CE1-CG1 4.08Å; F171-I175 HydrophobicContact CE2-CG1 4.45Å; F171-I175 HydrophobicContact CZ-CD1 4.37Å; F171-I175 HydrophobicContact CZ-CG1 4.05Å; F171-I175 WeakPolarHBondContact O-CG1 3.42Å; F171-I175 PolarHBondContact O-N 3.24Å; S172-I175 PolarHBondContact O-N 3.32Å; I175-I179 HydrophobicContact CD1-CG1 4.42Å; I175-I179 PolarHBondContact O-N 2.85Å; I175-L180 WeakPolarHBondContact O-CB 3.43Å; I175-L180 PolarHBondContact O-N 3.41Å
176F96.2Very high95.6Very high93 Ų9347.2 Ų47.241%0.40824%0.239SC..Iπ-helixtrans-86.9-25.1-170.1-65.2-72.9000113.8Y94 W135 S172 L180 P181Y94-F176 VanDerWaalsContact CZ-O 3.31Å; Y94-F176 PolarHBondContact OH-O 3.32Å; W135-F176 HydrophobicContact CH2-CB 3.96Å; W135-F176 AromaticContact CH2-CD2 3.93Å; W135-F176 HydrophobicContact CH2-CD2 3.93Å; W135-F176 HydrophobicContact CH2-CG 4.25Å; W135-F176 HydrophobicContact CZ2-CB 3.39Å; W135-F176 HydrophobicContact CZ2-CD2 4.12Å; W135-F176 AromaticContact CZ2-CG 3.95Å; W135-F176 HydrophobicContact CZ2-CG 3.95Å; S172-F176 WeakPolarHBondContact O-CB 3.25Å; S172-F176 VanDerWaalsContact O-CD2 3.29Å; S172-F176 WeakPolarHBondContact O-CD2 3.26Å; S172-F176 PolarHBondContact O-N 3.08Å; F176-L180 HydrophobicContact CD1-CD2 3.95Å; F176-L180 HydrophobicContact CE1-CD2 4.42Å; F176-P181 WeakPolarHBondContact O-CD 3.19Å; F176-P181 WeakPolarHBondContact O-CG 3.48Å
177G93.8Very high95.8Very high0 Ų053.3 Ų53.30%026%0.263CS..Iπ-helixtrans-93.3-22.1177.600000114.3M90 L173 P181M90-G177 VanDerWaalsContact CE-CA 3.43Å; L173-G177 CarbonylContact O-C 3.51Å; L173-G177 WeakPolarHBondContact O-CA 3.46Å; L173-G177 PolarHBondContact O-N 3.4Å; G177-P181 VanDerWaalsContact C-CG 3.43Å; G177-P181 VanDerWaalsContact O-CG 3.25Å; G177-P181 WeakPolarHBondContact O-CG 3.41Å
178Y93.4Very high96Very high30 Ų3048.8 Ų48.812%0.11824%0.243CC..Iπ-helixtrans-120.4-68.8179.8-64.7-94.6000112.8L173 F174 L180 P181 F182 W228 Y231 G232L173-Y178 WeakPolarHBondContact O-CD2 3.5Å; L173-Y178 PolarHBondContact O-N 2.93Å; F174-Y178 VanDerWaalsContact O-CB 3.27Å; F174-Y178 WeakPolarHBondContact O-CB 3.35Å; F174-Y178 PolarHBondContact O-N 3.09Å; Y178-L180 PolarHBondContact O-N 3.47Å; Y178-P181 WeakPolarHBondContact O-CD 3.31Å; Y178-F182 HydrophobicContact CD1-CD2 4.25Å; Y178-F182 AromaticContact CD1-CE2 3.81Å; Y178-F182 HydrophobicContact CD1-CE2 3.81Å; Y178-F182 HydrophobicContact CE1-CE2 4.44Å; Y178-F182 VanDerWaalsContact O-CB 3.29Å; Y178-F182 WeakPolarHBondContact O-CB 3.49Å; Y178-F182 VanDerWaalsContact O-CD2 3.24Å; Y178-F182 WeakPolarHBondContact O-CD2 3.48Å; Y178-F182 PolarHBondContact O-N 3.5Å; Y178-W228 HydrophobicContact CE1-CB 3.75Å; Y178-W228 WeakPolarHBondContact CE1-O 3.35Å; Y178-W228 PolarHBondContact OH-O 3.36Å; Y178-W228 VanDerWaalsContact OH-O 3.1Å; Y178-Y231 VanDerWaalsContact OH-CB 3.27Å; Y178-Y231 WeakPolarHBondContact OH-CB 3.44Å; Y178-G232 PolarHBondContact OH-N 2.89Å
179I95Very high96.2Very high92 Ų9243.9 Ų43.947%0.47222%0.217SC..Iπ-helixtrans-60.8-52.5-168-62.4-60000111.8F174 I175 G183F174-I179 HydrophobicContact CD1-CG1 4.23Å; F174-I179 HydrophobicContact CE1-CD1 4.08Å; F174-I179 HydrophobicContact CE1-CG1 3.78Å; F174-I179 HydrophobicContact CE2-CD1 4.18Å; F174-I179 HydrophobicContact CE2-CG1 4.29Å; F174-I179 HydrophobicContact CZ-CD1 3.66Å; F174-I179 HydrophobicContact CZ-CG1 3.82Å; F174-I179 PolarHBondContact O-N 3.48Å; I175-I179 HydrophobicContact CD1-CG1 4.42Å; I175-I179 PolarHBondContact O-N 2.85Å; I179-G183 WeakPolarHBondContact O-CA 3.2Å; I179-G183 PolarHBondContact O-N 3.4Å
180L96.9Very high96.3Very high86 Ų8648 Ų4845%0.4524%0.236SC..Hα-helixtrans-64-55.3-178-176.766.6000112.6I175 F176 Y178 G183 I184I175-L180 WeakPolarHBondContact O-CB 3.43Å; I175-L180 PolarHBondContact O-N 3.41Å; F176-L180 HydrophobicContact CD1-CD2 3.95Å; F176-L180 HydrophobicContact CE1-CD2 4.42Å; Y178-L180 PolarHBondContact O-N 3.47Å; L180-G183 PolarHBondContact O-N 3.43Å; L180-I184 HydrophobicContact CD1-CD1 4.02Å; L180-I184 HydrophobicContact CG-CD1 4.12Å; L180-I184 VanDerWaalsContact O-CG1 3.32Å; L180-I184 WeakPolarHBondContact O-CG1 3.25Å; L180-I184 PolarHBondContact O-N 2.69Å
181P97.2Very high96.5Very high5 Ų551.7 Ų51.73%0.03225%0.252CS..Hα-helixtrans-65.1-48-177.123.1-32.8000111.7I93 Y94 C97 F176 G177 Y178 G183 I184 G185I93-P181 HydrophobicContact CG2-CB 4.14Å; I93-P181 HydrophobicContact CG2-CG 4.06Å; Y94-P181 HydrophobicContact CD1-CB 4.12Å; Y94-P181 HydrophobicContact CE1-CB 4.15Å; Y94-P181 HydrophobicContact CE1-CG 4.33Å; C97-P181 HydrophobicContact CB-CB 4.16Å; C97-P181 WeakPolarHBondContact CB-O 3.38Å; C97-P181 PolarHBondContact SG-O 2.88Å; F176-P181 WeakPolarHBondContact O-CD 3.19Å; F176-P181 WeakPolarHBondContact O-CG 3.48Å; G177-P181 VanDerWaalsContact C-CG 3.43Å; G177-P181 VanDerWaalsContact O-CG 3.25Å; G177-P181 WeakPolarHBondContact O-CG 3.41Å; Y178-P181 WeakPolarHBondContact O-CD 3.31Å; P181-G183 VanDerWaalsContact C-N 3.33Å; P181-G183 PolarHBondContact O-N 3.28Å; P181-I184 PolarHBondContact O-N 2.99Å; P181-G185 PolarHBondContact O-N 3.45Å
182F97.4Very high96.7Very high17 Ų1746 Ų468%0.07523%0.228CC..Hα-helixtrans-66.9-35.9179.1-70-58.1000112I93 Y178 I184 G185 I186 L221 N224 I225I93-F182 HydrophobicContact CB-CZ 4.49Å; I93-F182 HydrophobicContact CD1-CZ 4.42Å; I93-F182 HydrophobicContact CG1-CZ 4.1Å; I93-F182 HydrophobicContact CG2-CE1 4.12Å; I93-F182 HydrophobicContact CG2-CE2 3.98Å; I93-F182 HydrophobicContact CG2-CZ 3.73Å; Y178-F182 HydrophobicContact CD1-CD2 4.25Å; Y178-F182 AromaticContact CD1-CE2 3.81Å; Y178-F182 HydrophobicContact CD1-CE2 3.81Å; Y178-F182 HydrophobicContact CE1-CE2 4.44Å; Y178-F182 VanDerWaalsContact O-CB 3.29Å; Y178-F182 WeakPolarHBondContact O-CB 3.49Å; Y178-F182 VanDerWaalsContact O-CD2 3.24Å; Y178-F182 WeakPolarHBondContact O-CD2 3.48Å; Y178-F182 PolarHBondContact O-N 3.5Å; F182-I184 PolarHBondContact O-N 3.15Å; F182-G185 PolarHBondContact O-N 3.12Å; F182-I186 WeakPolarHBondContact O-CB 3.24Å; F182-I186 VanDerWaalsContact O-CG1 3.27Å; F182-I186 WeakPolarHBondContact O-CG1 3.29Å; F182-I186 PolarHBondContact O-N 2.99Å; F182-L221 HydrophobicContact CD1-CD2 4.38Å; F182-N224 HydrophobicContact CE1-CB 3.98Å; F182-N224 HydrophobicContact CZ-CB 4.19Å; F182-I225 HydrophobicContact CD1-CD1 4.11Å; F182-I225 HydrophobicContact CD1-CG1 3.45Å; F182-I225 VanDerWaalsContact CD1-CG1 3.45Å; F182-I225 HydrophobicContact CE1-CB 4.49Å; F182-I225 HydrophobicContact CE1-CG1 3.5Å; F182-I225 VanDerWaalsContact CE1-CG1 3.5Å; F182-I225 HydrophobicContact CG-CG1 4.03Å; F182-I225 HydrophobicContact CZ-CG1 4.1Å
183G98Very high96.8Very high37 Ų3748 Ų4838%0.38124%0.236SC..Hα-helixtrans-57.5-47.4173.500000112.2I179 L180 P181 W187I179-G183 WeakPolarHBondContact O-CA 3.2Å; I179-G183 PolarHBondContact O-N 3.4Å; L180-G183 PolarHBondContact O-N 3.43Å; P181-G183 VanDerWaalsContact C-N 3.33Å; P181-G183 PolarHBondContact O-N 3.28Å; G183-W187 VanDerWaalsContact O-CB 3.23Å; G183-W187 WeakPolarHBondContact O-CB 3.26Å; G183-W187 PolarHBondContact O-N 3.4Å
184I98.2Very high97Very high69 Ų6951.5 Ų51.535%0.35425%0.251SS..Hα-helixtrans-62.5-44.9175.1-67.5166.1000110.9F101 L180 P181 F182 S188F101-I184 HydrophobicContact CB-CG2 4.11Å; F101-I184 HydrophobicContact CD2-CG2 4.31Å; F101-I184 HydrophobicContact CG-CG2 4.44Å; L180-I184 HydrophobicContact CD1-CD1 4.02Å; L180-I184 HydrophobicContact CG-CD1 4.12Å; L180-I184 VanDerWaalsContact O-CG1 3.32Å; L180-I184 WeakPolarHBondContact O-CG1 3.25Å; L180-I184 PolarHBondContact O-N 2.69Å; P181-I184 PolarHBondContact O-N 2.99Å; F182-I184 PolarHBondContact O-N 3.15Å; I184-S188 VanDerWaalsContact O-CB 3.31Å; I184-S188 WeakPolarHBondContact O-CB 3.27Å; I184-S188 PolarHBondContact O-N 2.73Å; I184-S188 PolarHBondContact O-OG 3.3Å
185G98.4Very high97.2Very high0 Ų053 Ų530%026%0.256CS..Hα-helixtrans-59.7-50.8179.600000112.5P181 F182 S188 Q189P181-G185 PolarHBondContact O-N 3.45Å; F182-G185 PolarHBondContact O-N 3.12Å; G185-S188 PolarHBondContact O-N 3.16Å; G185-Q189 WeakPolarHBondContact O-CG 3.4Å; G185-Q189 PolarHBondContact O-N 3.19Å
186I98.5Very high97.2Very high95 Ų9551.1 Ų51.149%0.48725%0.249SC..Hα-helixtrans-63.5-47179.3-68.3166.1000110.6F182 S188 Q189 H190 I225F182-I186 WeakPolarHBondContact O-CB 3.24Å; F182-I186 VanDerWaalsContact O-CG1 3.27Å; F182-I186 WeakPolarHBondContact O-CG1 3.29Å; F182-I186 PolarHBondContact O-N 2.99Å; I186-S188 VanDerWaalsContact C-N 3.31Å; I186-S188 PolarHBondContact O-N 2.89Å; I186-Q189 PolarHBondContact O-N 3.45Å; I186-H190 WeakPolarHBondContact O-CB 3.5Å; I186-H190 PolarHBondContact O-N 3.15Å; I186-I225 HydrophobicContact CD1-CD1 4.19Å; I186-I225 HydrophobicContact CG1-CD1 4.44Å
187W98.7Very high97.2Very high129 Ų12951.7 Ų51.749%0.48926%0.26SS..Hα-helixtrans-59.7-42.5177.8173.985.7000112M104 G183 Q189 H190 K191M104-W187 HydrophobicContact CE-CE3 4.47Å; M104-W187 HydrophobicContact CE-CH2 3.9Å; M104-W187 HydrophobicContact CE-CZ3 3.52Å; M104-W187 HydrophobicContact SD-CE3 4.25Å; M104-W187 HydrophobicContact SD-CH2 4.06Å; M104-W187 HydrophobicContact SD-CZ3 3.72Å; G183-W187 VanDerWaalsContact O-CB 3.23Å; G183-W187 WeakPolarHBondContact O-CB 3.26Å; G183-W187 PolarHBondContact O-N 3.4Å; W187-Q189 PolarHBondContact O-N 3.43Å; W187-H190 WeakPolarHBondContact O-CB 3.28Å; W187-H190 PolarHBondContact O-N 3.02Å; W187-K191 HydrophobicContact CD2-CG 4.39Å; W187-K191 HydrophobicContact CZ2-CG 4.14Å; W187-K191 WeakPolarHBondContact O-CG 3.42Å; W187-K191 PolarHBondContact O-N 2.9Å
188S98.6Very high97.2Very high0 Ų056.3 Ų56.30%029%0.293CS..Hα-helixtrans-63.1-42.8178.4-57.40000111.8F101 I184 G185 I186 K191 L192F101-S188 WeakPolarHBondContact CA-OG 3.34Å; I184-S188 VanDerWaalsContact O-CB 3.31Å; I184-S188 WeakPolarHBondContact O-CB 3.27Å; I184-S188 PolarHBondContact O-N 2.73Å; I184-S188 PolarHBondContact O-OG 3.3Å; G185-S188 PolarHBondContact O-N 3.16Å; I186-S188 VanDerWaalsContact C-N 3.31Å; I186-S188 PolarHBondContact O-N 2.89Å; S188-K191 PolarHBondContact O-N 3.01Å; S188-L192 PolarHBondContact O-N 2.83Å; S188-L192 VanDerWaalsContact O-N 3.12Å
189Q98.4Very high97.2Very high3 Ų356 Ų561%0.01429%0.293CS..Hα-helixtrans-67.5-38.9176.1-70.4-56.7-57.600112.2C100 G185 I186 W187 K191 L192 I193 N217 N218 L221C100-Q189 HydrophobicContact CB-CG 4.11Å; G185-Q189 WeakPolarHBondContact O-CG 3.4Å; G185-Q189 PolarHBondContact O-N 3.19Å; I186-Q189 PolarHBondContact O-N 3.45Å; W187-Q189 PolarHBondContact O-N 3.43Å; Q189-K191 VanDerWaalsContact C-N 3.33Å; Q189-K191 PolarHBondContact O-N 3.39Å; Q189-L192 PolarHBondContact O-N 2.99Å; Q189-I193 VanDerWaalsContact O-CG1 3.29Å; Q189-I193 WeakPolarHBondContact O-CG1 3.38Å; Q189-I193 PolarHBondContact O-N 3.37Å; Q189-N217 HydrophobicContact CG-CB 4.48Å; Q189-N217 PolarHBondContact NE2-ND2 3.29Å; Q189-N218 VanDerWaalsContact CB-OD1 3.32Å; Q189-N218 WeakPolarHBondContact CB-OD1 3.47Å; Q189-N218 WeakPolarHBondContact CG-OD1 3.43Å; Q189-L221 HydrophobicContact CG-CD1 3.78Å
190H98.5Very high96.9Very high94 Ų9454 Ų5444%0.43529%0.29SS..Hα-helixtrans-59.2-43.9174.4178.1-117.8000111.8I186 W187 L192 I193 Q194I186-H190 WeakPolarHBondContact O-CB 3.5Å; I186-H190 PolarHBondContact O-N 3.15Å; W187-H190 WeakPolarHBondContact O-CB 3.28Å; W187-H190 PolarHBondContact O-N 3.02Å; H190-L192 PolarHBondContact O-N 3.13Å; H190-I193 PolarHBondContact O-N 3.36Å; H190-Q194 PolarHBondContact CE1-NE2 3.04Å; H190-Q194 PolarHBondContact NE2-NE2 3.19Å; H190-Q194 WeakPolarHBondContact O-CG 3.43Å; H190-Q194 PolarHBondContact O-N 3.29Å
191K98.4Very high96.6Very high78 Ų7855.3 Ų55.334%0.33931%0.307SS..Hα-helixtrans-62.2-40.4175-71.6-65.1-178.9-173.70113.1M104 L108 W187 S188 Q189 Q194 Y195M104-K191 HydrophobicContact CG-CB 4.17Å; M104-K191 HydrophobicContact SD-CB 3.67Å; M104-K191 HydrophobicContact SD-CG 4.01Å; L108-K191 HydrophobicContact CD1-CB 4.27Å; W187-K191 HydrophobicContact CD2-CG 4.39Å; W187-K191 HydrophobicContact CZ2-CG 4.14Å; W187-K191 WeakPolarHBondContact O-CG 3.42Å; W187-K191 PolarHBondContact O-N 2.9Å; S188-K191 PolarHBondContact O-N 3.01Å; Q189-K191 VanDerWaalsContact C-N 3.33Å; Q189-K191 PolarHBondContact O-N 3.39Å; K191-Q194 PolarHBondContact O-N 3.13Å; K191-Y195 PolarHBondContact O-N 3.08Å
192L97.6Very high96.1Very high1 Ų161 Ų611%0.00533%0.331CS..Hα-helixtrans-65.3-40.4174.9-76.2177.4000112.7T103 M104 V107 L108 S188 Q189 H190 Y195 A196 I214T103-L192 HydrophobicContact CG2-CD1 3.8Å; M104-L192 HydrophobicContact CB-CD1 4.24Å; M104-L192 HydrophobicContact CB-CD2 4.32Å; M104-L192 HydrophobicContact CB-CG 4Å; M104-L192 HydrophobicContact CG-CD2 4.42Å; M104-L192 HydrophobicContact CG-CG 4.21Å; V107-L192 HydrophobicContact CB-CD2 3.61Å; V107-L192 HydrophobicContact CG1-CD2 3.59Å; V107-L192 HydrophobicContact CG2-CD2 4.15Å; L108-L192 HydrophobicContact CG-CD2 4.5Å; S188-L192 PolarHBondContact O-N 2.83Å; S188-L192 VanDerWaalsContact O-N 3.12Å; Q189-L192 PolarHBondContact O-N 2.99Å; H190-L192 PolarHBondContact O-N 3.13Å; L192-Y195 PolarHBondContact O-N 3.45Å; L192-A196 WeakPolarHBondContact O-CB 3.13Å; L192-A196 PolarHBondContact O-N 2.87Å; L192-I214 HydrophobicContact CB-CD1 3.92Å; L192-I214 HydrophobicContact CB-CG1 3.82Å; L192-I214 HydrophobicContact CD1-CG1 4.38Å
193I98Very high95.4Very high67 Ų6764.9 Ų64.934%0.34435%0.352SS..Hα-helixtrans-62.5-46.8175.8-69.3163.3000110.1Q189 H190 Y195 A196 V197 I214Q189-I193 VanDerWaalsContact O-CG1 3.29Å; Q189-I193 WeakPolarHBondContact O-CG1 3.38Å; Q189-I193 PolarHBondContact O-N 3.37Å; H190-I193 PolarHBondContact O-N 3.36Å; I193-Y195 VanDerWaalsContact C-N 3.32Å; I193-Y195 PolarHBondContact O-N 3.44Å; I193-A196 PolarHBondContact O-N 3.17Å; I193-V197 HydrophobicContact CG2-CG2 4.35Å; I193-V197 WeakPolarHBondContact O-CG2 3.44Å; I193-V197 PolarHBondContact O-N 2.89Å; I193-I214 HydrophobicContact CD1-CG2 4.33Å; I193-I214 HydrophobicContact CG1-CD1 4.37Å; I193-I214 HydrophobicContact CG1-CG2 3.77Å
194Q97.6Very high95Very high84 Ų8466.3 Ų66.339%0.39335%0.351SS..Hα-helixtrans-55.7-48175.2-72.4-175.6-23.900111.2H190 K191 A196 V197 S198H190-Q194 PolarHBondContact CE1-NE2 3.04Å; H190-Q194 PolarHBondContact NE2-NE2 3.19Å; H190-Q194 WeakPolarHBondContact O-CG 3.43Å; H190-Q194 PolarHBondContact O-N 3.29Å; K191-Q194 PolarHBondContact O-N 3.13Å; Q194-A196 PolarHBondContact O-N 2.98Å; Q194-V197 PolarHBondContact O-N 2.88Å; Q194-S198 PolarHBondContact O-N 3.1Å; Q194-S198 PolarHBondContact O-OG 3.06Å; Q194-S198 VanDerWaalsContact O-OG 3.11Å
195Y96.8Very high94.6Very high77 Ų7765.3 Ų65.330%0.30234%0.344SS..Hα-helixtrans-61-42.9177.5179.5-90.2000113.1V107 L108 K191 L192 I193 S198 N199 I210V107-Y195 HydrophobicContact CG1-CD1 4.09Å; V107-Y195 HydrophobicContact CG1-CE1 4.1Å; L108-Y195 HydrophobicContact CD2-CD1 4.23Å; L108-Y195 HydrophobicContact CD2-CD2 3.41Å; L108-Y195 VanDerWaalsContact CD2-CD2 3.41Å; L108-Y195 HydrophobicContact CD2-CE2 4.14Å; L108-Y195 HydrophobicContact CD2-CG 3.45Å; L108-Y195 VanDerWaalsContact CD2-CG 3.45Å; K191-Y195 PolarHBondContact O-N 3.08Å; L192-Y195 PolarHBondContact O-N 3.45Å; I193-Y195 VanDerWaalsContact C-N 3.32Å; I193-Y195 PolarHBondContact O-N 3.44Å; Y195-S198 PolarHBondContact O-N 2.9Å; Y195-N199 PolarHBondContact O-N 3.34Å; Y195-N199 VanDerWaalsContact O-N 3.15Å; Y195-N199 PolarHBondContact O-ND2 3.45Å; Y195-I210 HydrophobicContact CD1-CD1 4.27Å; Y195-I210 HydrophobicContact CE1-CD1 3.72Å
196A95.8Very high94.3Very high16 Ų1669.5 Ų69.513%0.13237%0.366CS..Hα-helixtrans-64.9-43.2179.200000111.5L192 I193 Q194 N199 A200 I210 I214L192-A196 WeakPolarHBondContact O-CB 3.13Å; L192-A196 PolarHBondContact O-N 2.87Å; I193-A196 PolarHBondContact O-N 3.17Å; Q194-A196 PolarHBondContact O-N 2.98Å; A196-N199 CarbonylContact O-C 3.57Å; A196-N199 PolarHBondContact O-N 3.47Å; A196-A200 PolarHBondContact O-N 3.44Å; A196-I210 HydrophobicContact CB-CG2 4.35Å; A196-I214 HydrophobicContact CB-CD1 3.78Å
197V95.5Very high94Very high105 Ų10565.4 Ų65.464%0.63635%0.346SS*.Hα-helixtrans-62.1-46.3176.3171.50000110.8I193 Q194 N199 A200I193-V197 HydrophobicContact CG2-CG2 4.35Å; I193-V197 WeakPolarHBondContact O-CG2 3.44Å; I193-V197 PolarHBondContact O-N 2.89Å; Q194-V197 PolarHBondContact O-N 2.88Å; V197-N199 PolarHBondContact O-N 3.38Å; V197-A200 WeakPolarHBondContact O-CB 3.32Å; V197-A200 PolarHBondContact O-N 3.31Å
198S95Very high93.8Very high98 Ų9862 Ų6269%0.68534%0.335SS*.Hα-helixtrans-63.4-23.5177.8-60.50000113.8Q194 Y195Q194-S198 PolarHBondContact O-N 3.1Å; Q194-S198 PolarHBondContact O-OG 3.06Å; Q194-S198 VanDerWaalsContact O-OG 3.11Å; Y195-S198 PolarHBondContact O-N 2.9Å
199N93.9Very high93.6Very high22 Ų2264.7 Ų64.712%0.11835%0.347CS..THydrogen-bonded Turntrans-105.55.8178.7-72.4-83.6000113.5Y195 A196 V197 S201 K202 T207Y195-N199 PolarHBondContact O-N 3.34Å; Y195-N199 VanDerWaalsContact O-N 3.15Å; Y195-N199 PolarHBondContact O-ND2 3.45Å; A196-N199 CarbonylContact O-C 3.57Å; A196-N199 PolarHBondContact O-N 3.47Å; V197-N199 PolarHBondContact O-N 3.38Å; N199-S201 PolarHBondContact O-N 2.92Å; N199-S201 VanDerWaalsContact O-N 3.17Å; N199-K202 HydrophobicContact CB-CD 4.47Å; N199-K202 WeakPolarHBondContact O-CB 3.34Å; N199-K202 PolarHBondContact O-N 2.93Å; N199-K202 VanDerWaalsContact O-N 3.07Å; N199-K202 WeakPolarHBondContact OD1-CE 3.06Å; N199-K202 PolarHBondContact OD1-NZ 2.89Å; N199-T207 HydrophobicContact CB-CG2 4.04Å; N199-T207 WeakPolarHBondContact O-CG2 3.29Å
200A88.8Confident93.4Very high50 Ų5064.9 Ų64.941%0.41335%0.348SS..G310 helixtrans-59-33.6-172.900000112.8A196 V197 K202 N203A196-A200 PolarHBondContact O-N 3.44Å; V197-A200 WeakPolarHBondContact O-CB 3.32Å; V197-A200 PolarHBondContact O-N 3.31Å; A200-K202 PolarHBondContact O-N 2.78Å; A200-N203 PolarHBondContact O-N 3.02Å; A200-N203 VanDerWaalsContact O-N 3.16Å
201S89.7Confident93.3Very high115 Ų11563.1 Ų63.180%0.80434%0.339SS*.G310 helixtrans-61.9-24.617960.30000114.1N199 N203N199-S201 PolarHBondContact O-N 2.92Å; N199-S201 VanDerWaalsContact O-N 3.17Å; S201-N203 VanDerWaalsContact C-N 3.27Å; S201-N203 PolarHBondContact O-N 3Å
202K86.9Confident93.2Very high124 Ų12459.9 Ų59.954%0.53933%0.326SS..G310 helixtrans-70.6-23.6178.9-66.4176.3179.1166.10112.8N199 A200 N204 T207N199-K202 HydrophobicContact CB-CD 4.47Å; N199-K202 WeakPolarHBondContact O-CB 3.34Å; N199-K202 PolarHBondContact O-N 2.93Å; N199-K202 VanDerWaalsContact O-N 3.07Å; N199-K202 WeakPolarHBondContact OD1-CE 3.06Å; N199-K202 PolarHBondContact OD1-NZ 2.89Å; A200-K202 PolarHBondContact O-N 2.78Å; K202-N204 WeakPolarHBondContact O-CB 3.23Å; K202-N204 PolarHBondContact O-N 3.46Å; K202-T207 HydrophobicContact CB-CG2 4.27Å
203N81.8Confident93.2Very high99 Ų9960 Ų6053%0.52933%0.326SS..  trans32.449.2179.5-16433.2000115.2A200 S201 K208A200-N203 PolarHBondContact O-N 3.02Å; A200-N203 VanDerWaalsContact O-N 3.16Å; S201-N203 VanDerWaalsContact C-N 3.27Å; S201-N203 PolarHBondContact O-N 3Å; N203-K208 WeakPolarHBondContact OD1-CE 3.43Å
204N89.6Confident93.1Very high66 Ų6657.5 Ų57.535%0.35331%0.314SS..  trans-111.5175-172.169.224.6000112.4K202 N206 T207 K208K202-N204 WeakPolarHBondContact O-CB 3.23Å; K202-N204 PolarHBondContact O-N 3.46Å; N204-N206 PolarHBondContact O-N 2.95Å; N204-N206 VanDerWaalsContact O-N 3.12Å; N204-N206 PolarHBondContact OD1-N 3.24Å; N204-N206 VanDerWaalsContact OD1-N 3.09Å; N204-T207 PolarHBondContact N-OG1 3.33Å; N204-T207 PolarHBondContact O-N 2.84Å; N204-T207 PolarHBondContact O-OG1 3.47Å; N204-T207 PolarHBondContact OD1-N 3.37Å; N204-T207 PolarHBondContact OD1-OG1 3.06Å; N204-K208 PolarHBondContact O-N 3.39Å; N204-K208 VanDerWaalsContact O-N 3.13Å
205K90.8Very high93.1Very high49 Ų4958.4 Ų58.421%0.21332%0.316CS..Hα-helixtrans-48.3-41.3178.6-178.8174.5179.5174.70112.1K209 W279 Y283 E287K205-K209 WeakPolarHBondContact O-CB 3.35Å; K205-K209 PolarHBondContact O-N 3.01Å; K205-K209 VanDerWaalsContact O-N 3.11Å; K205-W279 HydrophobicContact CD-CH2 4.4Å; K205-W279 HydrophobicContact CD-CZ2 3.98Å; K205-W279 VanDerWaalsContact CE-CZ2 3.43Å; K205-W279 HydrophobicContact CG-CH2 4.25Å; K205-W279 HydrophobicContact CG-CZ2 3.36Å; K205-W279 PolarHBondContact O-NE1 3.2Å; K205-Y283 HydrophobicContact CB-CD1 3.77Å; K205-Y283 HydrophobicContact CB-CE1 4.27Å; K205-Y283 HydrophobicContact CB-CG 3.98Å; K205-Y283 HydrophobicContact CG-CD1 4.31Å; K205-Y283 HydrophobicContact CG-CG 4.02Å; K205-E287 IonicContact NZ-OE1 3.19Å; K205-E287 PolarHBondContact NZ-OE1 3.4Å
206N91.5Very high93.2Very high87 Ų8754.8 Ų54.847%0.46530%0.302SS..Hα-helixtrans-76.3-41.7-177-166.346.2000113.2N204 K208 K209 I210N204-N206 PolarHBondContact O-N 2.95Å; N204-N206 VanDerWaalsContact O-N 3.12Å; N204-N206 PolarHBondContact OD1-N 3.24Å; N204-N206 VanDerWaalsContact OD1-N 3.09Å; N206-K208 VanDerWaalsContact C-N 3.33Å; N206-K208 PolarHBondContact O-N 2.87Å; N206-K209 WeakPolarHBondContact O-CB 3.42Å; N206-K209 PolarHBondContact O-N 2.67Å; N206-I210 WeakPolarHBondContact O-CG1 3.47Å; N206-I210 PolarHBondContact O-N 2.64Å
207T92.8Very high93.3Very high10 Ų1054 Ų546%0.06130%0.296CS..Hα-helixtrans-63.9-40.5177.6560000111.1N199 K202 N204 I210 E211N199-T207 HydrophobicContact CB-CG2 4.04Å; N199-T207 WeakPolarHBondContact O-CG2 3.29Å; K202-T207 HydrophobicContact CB-CG2 4.27Å; N204-T207 PolarHBondContact N-OG1 3.33Å; N204-T207 PolarHBondContact O-N 2.84Å; N204-T207 PolarHBondContact O-OG1 3.47Å; N204-T207 PolarHBondContact OD1-N 3.37Å; N204-T207 PolarHBondContact OD1-OG1 3.06Å; T207-I210 PolarHBondContact O-N 2.75Å; T207-E211 WeakPolarHBondContact O-CG 3.39Å; T207-E211 PolarHBondContact O-N 3.29Å
208K93.5Very high93.4Very high58 Ų5851.2 Ų51.225%0.25228%0.277SS..Hα-helixtrans-65-37.8173.1-66.9-52.6-178.5-163.80113.5N203 N204 N206 I210 E211 I212 Y283N203-K208 WeakPolarHBondContact OD1-CE 3.43Å; N204-K208 PolarHBondContact O-N 3.39Å; N204-K208 VanDerWaalsContact O-N 3.13Å; N206-K208 VanDerWaalsContact C-N 3.33Å; N206-K208 PolarHBondContact O-N 2.87Å; K208-I210 VanDerWaalsContact C-N 3.33Å; K208-I210 PolarHBondContact O-N 3.26Å; K208-E211 VanDerWaalsContact CD-OE2 3.31Å; K208-E211 WeakPolarHBondContact CD-OE2 3.35Å; K208-E211 VanDerWaalsContact NZ-CD 3.27Å; K208-E211 IonicContact NZ-OE1 3.42Å; K208-E211 PolarHBondContact NZ-OE1 2.85Å; K208-E211 IonicContact NZ-OE2 3.54Å; K208-E211 PolarHBondContact NZ-OE2 3.03Å; K208-E211 PolarHBondContact O-N 3.33Å; K208-I212 WeakPolarHBondContact O-CG1 3.37Å; K208-I212 PolarHBondContact O-N 3.39Å; K208-I212 VanDerWaalsContact O-N 3.11Å; K208-Y283 HydrophobicContact CB-CE2 4.1Å; K208-Y283 HydrophobicContact CG-CE2 4.05Å
209K94.1Very high93.5Very high56 Ų5648.4 Ų48.424%0.24326%0.258CS..Hα-helixtrans-58.9-44.9172.3-179.9178.1176.5167.90111.4I36 K205 N206 I212 L213 W279I36-K209 HydrophobicContact CB-CG 4.24Å; I36-K209 WeakPolarHBondContact O-CE 3.08Å; I36-K209 PolarHBondContact O-NZ 3.09Å; K205-K209 WeakPolarHBondContact O-CB 3.35Å; K205-K209 PolarHBondContact O-N 3.01Å; K205-K209 VanDerWaalsContact O-N 3.11Å; N206-K209 WeakPolarHBondContact O-CB 3.42Å; N206-K209 PolarHBondContact O-N 2.67Å; K209-I212 PolarHBondContact O-N 3.06Å; K209-L213 WeakPolarHBondContact O-CG 3.11Å; K209-L213 PolarHBondContact O-N 3.44Å; K209-L213 VanDerWaalsContact O-N 3.1Å; K209-W279 HydrophobicContact CB-CZ2 4.39Å
210I95.5Very high93.7Very high7 Ų747.4 Ų47.44%0.03625%0.252CS..Hα-helixtrans-64.3-43.1177.8-66.3165.4000111.5V107 Y195 A196 N206 T207 K208 I212 L213 I214V107-I210 HydrophobicContact CG1-CD1 3.63Å; V107-I210 HydrophobicContact CG1-CG1 3.87Å; V107-I210 HydrophobicContact CG1-CG2 4.14Å; V107-I210 HydrophobicContact CG2-CG1 4.27Å; Y195-I210 HydrophobicContact CD1-CD1 4.27Å; Y195-I210 HydrophobicContact CE1-CD1 3.72Å; A196-I210 HydrophobicContact CB-CG2 4.35Å; N206-I210 WeakPolarHBondContact O-CG1 3.47Å; N206-I210 PolarHBondContact O-N 2.64Å; T207-I210 PolarHBondContact O-N 2.75Å; K208-I210 VanDerWaalsContact C-N 3.33Å; K208-I210 PolarHBondContact O-N 3.26Å; I210-I212 VanDerWaalsContact C-N 3.28Å; I210-I212 PolarHBondContact O-N 2.95Å; I210-L213 PolarHBondContact O-N 3.47Å; I210-L213 VanDerWaalsContact O-N 3.16Å; I210-I214 HydrophobicContact CG2-CD1 3.86Å; I210-I214 HydrophobicContact CG2-CG1 4.36Å; I210-I214 WeakPolarHBondContact O-CG1 3.48Å; I210-I214 PolarHBondContact O-N 3.17Å
211E95.9Very high94.1Very high56 Ų5645.2 Ų45.226%0.26223%0.234SC..Hα-helixtrans-56.6-41.5175-73.7174.7-156.800112T207 K208 I214 K215T207-E211 WeakPolarHBondContact O-CG 3.39Å; T207-E211 PolarHBondContact O-N 3.29Å; K208-E211 VanDerWaalsContact CD-OE2 3.31Å; K208-E211 WeakPolarHBondContact CD-OE2 3.35Å; K208-E211 VanDerWaalsContact NZ-CD 3.27Å; K208-E211 IonicContact NZ-OE1 3.42Å; K208-E211 PolarHBondContact NZ-OE1 2.85Å; K208-E211 IonicContact NZ-OE2 3.54Å; K208-E211 PolarHBondContact NZ-OE2 3.03Å; K208-E211 PolarHBondContact O-N 3.33Å; E211-I214 PolarHBondContact O-N 3.43Å; E211-K215 WeakPolarHBondContact O-CG 3.08Å; E211-K215 PolarHBondContact O-N 3.42Å
212I96Very high94.5Very high10 Ų1044.1 Ų44.15%0.05122%0.218CC..Hα-helixtrans-65.5-42.8177.4-64.6168.9000110.9I36 K208 K209 I210 K215 L216 T272 Q275 I276 W279I36-I212 HydrophobicContact CD1-CB 4.3Å; I36-I212 HydrophobicContact CD1-CG2 3.49Å; I36-I212 VanDerWaalsContact CD1-CG2 3.49Å; K208-I212 WeakPolarHBondContact O-CG1 3.37Å; K208-I212 PolarHBondContact O-N 3.39Å; K208-I212 VanDerWaalsContact O-N 3.11Å; K209-I212 PolarHBondContact O-N 3.06Å; I210-I212 VanDerWaalsContact C-N 3.28Å; I210-I212 PolarHBondContact O-N 2.95Å; I212-K215 PolarHBondContact O-N 2.9Å; I212-L216 PolarHBondContact O-N 3.48Å; I212-T272 HydrophobicContact CG2-CG2 3.74Å; I212-Q275 HydrophobicContact CD1-CB 4.14Å; I212-Q275 HydrophobicContact CG1-CB 4.07Å; I212-Q275 HydrophobicContact CG2-CB 4.29Å; I212-I276 HydrophobicContact CG2-CG1 4.43Å; I212-W279 HydrophobicContact CD1-CB 3.87Å; I212-W279 HydrophobicContact CD1-CG 4.11Å
213L96.9Very high94.9Very high4 Ų440.9 Ų40.92%0.02120%0.204CC..Hα-helixtrans-62.3-43.5177-68174000112I36 L37 T103 V107 K209 I210 K215 L216 N217I36-L213 HydrophobicContact CD1-CD2 4.07Å; I36-L213 HydrophobicContact CG1-CD2 4.37Å; L37-L213 HydrophobicContact CD2-CD2 3.78Å; T103-L213 HydrophobicContact CG2-CB 4.16Å; T103-L213 HydrophobicContact CG2-CD1 4.24Å; V107-L213 HydrophobicContact CG2-CD1 4.4Å; K209-L213 WeakPolarHBondContact O-CG 3.11Å; K209-L213 PolarHBondContact O-N 3.44Å; K209-L213 VanDerWaalsContact O-N 3.1Å; I210-L213 PolarHBondContact O-N 3.47Å; I210-L213 VanDerWaalsContact O-N 3.16Å; L213-K215 PolarHBondContact O-N 2.86Å; L213-L216 PolarHBondContact O-N 3.46Å; L213-N217 WeakPolarHBondContact O-CB 3.5Å; L213-N217 PolarHBondContact O-N 3.08Å
214I97.8Very high95.6Very high15 Ų1536.1 Ų36.18%0.07718%0.179CC..Hα-helixtrans-59.2-47.2175.7-69.3167.5000110.3L192 I193 A196 I210 E211 L216 N217 N218L192-I214 HydrophobicContact CB-CD1 3.92Å; L192-I214 HydrophobicContact CB-CG1 3.82Å; L192-I214 HydrophobicContact CD1-CG1 4.38Å; I193-I214 HydrophobicContact CD1-CG2 4.33Å; I193-I214 HydrophobicContact CG1-CD1 4.37Å; I193-I214 HydrophobicContact CG1-CG2 3.77Å; A196-I214 HydrophobicContact CB-CD1 3.78Å; I210-I214 HydrophobicContact CG2-CD1 3.86Å; I210-I214 HydrophobicContact CG2-CG1 4.36Å; I210-I214 WeakPolarHBondContact O-CG1 3.48Å; I210-I214 PolarHBondContact O-N 3.17Å; E211-I214 PolarHBondContact O-N 3.43Å; I214-L216 PolarHBondContact O-N 3.22Å; I214-N217 PolarHBondContact O-N 2.99Å; I214-N218 WeakPolarHBondContact CG2-ND2 3.39Å; I214-N218 VanDerWaalsContact O-CB 3.29Å; I214-N218 WeakPolarHBondContact O-CB 3.34Å; I214-N218 PolarHBondContact O-N 3.21Å
215K97.6Very high95.9Very high103 Ų10334.9 Ų34.945%0.44817%0.172SC..Hα-helixtrans-62.3-42.3178.8-73.4171.5-178176.30112.2E211 I212 L213 S219E211-K215 WeakPolarHBondContact O-CG 3.08Å; E211-K215 PolarHBondContact O-N 3.42Å; I212-K215 PolarHBondContact O-N 2.9Å; L213-K215 PolarHBondContact O-N 2.86Å; K215-S219 VanDerWaalsContact O-CB 3.3Å; K215-S219 WeakPolarHBondContact O-CB 3.16Å; K215-S219 PolarHBondContact O-N 3.32Å; K215-S219 PolarHBondContact O-OG 2.86Å
216L97.4Very high95.9Very high0 Ų039.6 Ų39.60%019%0.192CC..Hα-helixtrans-60.2-53.3176.3174.862.5000110.8I33 L37 I212 L213 I214 S219 I220 A268 Y269 T272I33-L216 HydrophobicContact CD1-CD2 4.41Å; L37-L216 HydrophobicContact CD2-CD2 4.5Å; I212-L216 PolarHBondContact O-N 3.48Å; L213-L216 PolarHBondContact O-N 3.46Å; I214-L216 PolarHBondContact O-N 3.22Å; L216-S219 PolarHBondContact O-N 2.94Å; L216-I220 HydrophobicContact CD1-CD1 3.77Å; L216-I220 HydrophobicContact CD1-CG1 4.27Å; L216-I220 HydrophobicContact CG-CD1 3.95Å; L216-I220 WeakPolarHBondContact O-CG1 3.18Å; L216-I220 PolarHBondContact O-N 3.32Å; L216-A268 HydrophobicContact CD1-CB 4.42Å; L216-Y269 HydrophobicContact CD1-CD1 3.6Å; L216-Y269 HydrophobicContact CD1-CE1 3.84Å; L216-Y269 HydrophobicContact CD1-CG 4.33Å; L216-Y269 HydrophobicContact CD2-CD1 4.47Å; L216-Y269 HydrophobicContact CD2-CE1 4.32Å; L216-T272 HydrophobicContact CB-CG2 4.24Å; L216-T272 HydrophobicContact CD1-CG2 4.38Å; L216-T272 WeakPolarHBondContact CD1-OG1 3.28Å; L216-T272 HydrophobicContact CD2-CG2 4.27Å
217N98Very high96Very high1 Ų135.5 Ų35.51%0.00517%0.171CC..Hα-helixtrans-64.5-45-175.7-74.1-2.5000112.1I99 T103 Q189 L213 I214 S219 I220 L221I99-N217 WeakPolarHBondContact CG2-OD1 3.38Å; T103-N217 VanDerWaalsContact CB-ND2 3.34Å; T103-N217 WeakPolarHBondContact CB-ND2 3.23Å; T103-N217 PolarHBondContact OG1-ND2 3.41Å; Q189-N217 HydrophobicContact CG-CB 4.48Å; Q189-N217 PolarHBondContact NE2-ND2 3.29Å; L213-N217 WeakPolarHBondContact O-CB 3.5Å; L213-N217 PolarHBondContact O-N 3.08Å; I214-N217 PolarHBondContact O-N 2.99Å; N217-S219 VanDerWaalsContact C-N 3.32Å; N217-S219 PolarHBondContact O-N 3Å; N217-I220 PolarHBondContact O-N 3.36Å; N217-L221 WeakPolarHBondContact O-CB 3.38Å; N217-L221 PolarHBondContact O-N 2.8Å
218N98.1Very high96Very high46 Ų4636.4 Ų36.425%0.24617%0.173CC..Hα-helixtrans-61.4-40.8174.8-79.2-23.4000111.9Q189 I214 I220 L221 L222Q189-N218 VanDerWaalsContact CB-OD1 3.32Å; Q189-N218 WeakPolarHBondContact CB-OD1 3.47Å; Q189-N218 WeakPolarHBondContact CG-OD1 3.43Å; I214-N218 WeakPolarHBondContact CG2-ND2 3.39Å; I214-N218 VanDerWaalsContact O-CB 3.29Å; I214-N218 WeakPolarHBondContact O-CB 3.34Å; I214-N218 PolarHBondContact O-N 3.21Å; N218-I220 PolarHBondContact O-N 3.46Å; N218-L221 PolarHBondContact O-N 2.9Å; N218-L222 WeakPolarHBondContact O-CB 3.4Å; N218-L222 WeakPolarHBondContact O-CG 3.44Å; N218-L222 PolarHBondContact O-N 2.93Å
219S97.5Very high95.9Very high39 Ų3937.4 Ų37.427%0.27318%0.181SC..Hα-helixtrans-62.1-45.9176.9-59.50000111.4K215 L216 N217 L222 F223K215-S219 VanDerWaalsContact O-CB 3.3Å; K215-S219 WeakPolarHBondContact O-CB 3.16Å; K215-S219 PolarHBondContact O-N 3.32Å; K215-S219 PolarHBondContact O-OG 2.86Å; L216-S219 PolarHBondContact O-N 2.94Å; N217-S219 VanDerWaalsContact C-N 3.32Å; N217-S219 PolarHBondContact O-N 3Å; S219-L222 PolarHBondContact O-N 3.1Å; S219-F223 WeakPolarHBondContact O-CD2 3.35Å; S219-F223 PolarHBondContact O-N 3.43Å; S219-F223 VanDerWaalsContact O-N 3.08Å
220I97.9Very high95.7Very high1 Ų135.5 Ų35.51%0.00518%0.175CC..Hα-helixtrans-62-45177.1-70.2170.9000111.4L48 L216 N217 N218 F223 N224 L265 A268 Y269L48-I220 HydrophobicContact CD2-CD1 4.34Å; L48-I220 HydrophobicContact CD2-CG2 3.7Å; L216-I220 HydrophobicContact CD1-CD1 3.77Å; L216-I220 HydrophobicContact CD1-CG1 4.27Å; L216-I220 HydrophobicContact CG-CD1 3.95Å; L216-I220 WeakPolarHBondContact O-CG1 3.18Å; L216-I220 PolarHBondContact O-N 3.32Å; N217-I220 PolarHBondContact O-N 3.36Å; N218-I220 PolarHBondContact O-N 3.46Å; I220-F223 PolarHBondContact O-N 3.16Å; I220-N224 PolarHBondContact O-N 3.17Å; I220-N224 VanDerWaalsContact O-N 3.15Å; I220-N224 PolarHBondContact O-ND2 2.92Å; I220-L265 HydrophobicContact CG1-CD2 4.44Å; I220-L265 HydrophobicContact CG2-CD1 4.26Å; I220-A268 HydrophobicContact CG1-CB 4.05Å; I220-Y269 HydrophobicContact CD1-CE1 3.96Å; I220-Y269 HydrophobicContact CD1-CE2 4.39Å
221L97.5Very high95.5Very high4 Ų435.8 Ų35.82%0.02118%0.175CC..Hα-helixtrans-61.1-46.5176.9-82.4179.3000111.2C100 F182 Q189 N217 N218 F223 N224 I225C100-L221 HydrophobicContact CB-CD1 4.37Å; C100-L221 WeakPolarHBondContact SG-CD1 2.93Å; C100-L221 WeakPolarHBondContact SG-CG 3Å; F182-L221 HydrophobicContact CD1-CD2 4.38Å; Q189-L221 HydrophobicContact CG-CD1 3.78Å; N217-L221 WeakPolarHBondContact O-CB 3.38Å; N217-L221 PolarHBondContact O-N 2.8Å; N218-L221 PolarHBondContact O-N 2.9Å; L221-F223 PolarHBondContact O-N 3.41Å; L221-N224 PolarHBondContact O-N 3.11Å; L221-N224 VanDerWaalsContact O-N 3.13Å; L221-I225 WeakPolarHBondContact O-CB 3.4Å; L221-I225 VanDerWaalsContact O-CG1 3.31Å; L221-I225 WeakPolarHBondContact O-CG1 3.11Å; L221-I225 PolarHBondContact O-N 2.02Å
222L96.8Very high95.2Very high91 Ų9133.2 Ų33.248%0.47616%0.164SC..Hα-helixtrans-60.8-44.8-179.5-73.8170.1000111.3N218 S219 N224 I225 F226N218-L222 WeakPolarHBondContact O-CB 3.4Å; N218-L222 WeakPolarHBondContact O-CG 3.44Å; N218-L222 PolarHBondContact O-N 2.93Å; S219-L222 PolarHBondContact O-N 3.1Å; L222-N224 VanDerWaalsContact C-N 3.32Å; L222-N224 PolarHBondContact O-N 2.81Å; L222-I225 PolarHBondContact O-N 2.94Å; L222-F226 HydrophobicContact CB-CD2 4.36Å; L222-F226 HydrophobicContact CB-CE2 4.48Å; L222-F226 HydrophobicContact CD2-CE2 4.15Å; L222-F226 WeakPolarHBondContact O-CB 3.39Å; L222-F226 WeakPolarHBondContact O-CD2 3.19Å; L222-F226 PolarHBondContact O-N 3.11Å
223F96.4Very high95Very high56 Ų5637.5 Ų37.525%0.24619%0.186CC..Hα-helixtrans-55.9-47.4173.5-83.4-66.9000111.5S219 I220 L221 G227 S261 F264 L265 I267 A268S219-F223 WeakPolarHBondContact O-CD2 3.35Å; S219-F223 PolarHBondContact O-N 3.43Å; S219-F223 VanDerWaalsContact O-N 3.08Å; I220-F223 PolarHBondContact O-N 3.16Å; L221-F223 PolarHBondContact O-N 3.41Å; F223-G227 PolarHBondContact O-N 2.97Å; F223-S261 WeakPolarHBondContact O-CB 3.38Å; F223-F264 HydrophobicContact CE1-CB 4.12Å; F223-L265 HydrophobicContact CB-CD1 4.46Å; F223-I267 HydrophobicContact CZ-CB 4.29Å; F223-A268 HydrophobicContact CD2-CB 4.43Å; F223-A268 HydrophobicContact CE2-CB 4.3Å
224N95.9Very high94.7Very high0 Ų037.7 Ų37.70%019%0.187CC..Hα-helixtrans-65.9-44.3179.4-82.3-76000112.8F182 I220 L221 L222 G227 W228 Q262 L265F182-N224 HydrophobicContact CE1-CB 3.98Å; F182-N224 HydrophobicContact CZ-CB 4.19Å; I220-N224 PolarHBondContact O-N 3.17Å; I220-N224 VanDerWaalsContact O-N 3.15Å; I220-N224 PolarHBondContact O-ND2 2.92Å; L221-N224 PolarHBondContact O-N 3.11Å; L221-N224 VanDerWaalsContact O-N 3.13Å; L222-N224 VanDerWaalsContact C-N 3.32Å; L222-N224 PolarHBondContact O-N 2.81Å; N224-G227 PolarHBondContact O-N 2.93Å; N224-W228 WeakPolarHBondContact O-CB 3.47Å; N224-W228 PolarHBondContact O-N 3.33Å; N224-W228 PolarHBondContact OD1-NE1 3.47Å; N224-Q262 PolarHBondContact OD1-NE2 3.45Å; N224-L265 WeakPolarHBondContact ND2-CD1 3.37Å
225I95.5Very high94.2Very high39 Ų3937.4 Ų37.420%0.219%0.187CC..Hα-helixtrans-59.1-54.7176.7-68.6167.8000109.2F182 I186 L221 L222 G227 W228 L229F182-I225 HydrophobicContact CD1-CD1 4.11Å; F182-I225 HydrophobicContact CD1-CG1 3.45Å; F182-I225 VanDerWaalsContact CD1-CG1 3.45Å; F182-I225 HydrophobicContact CE1-CB 4.49Å; F182-I225 HydrophobicContact CE1-CG1 3.5Å; F182-I225 VanDerWaalsContact CE1-CG1 3.5Å; F182-I225 HydrophobicContact CG-CG1 4.03Å; F182-I225 HydrophobicContact CZ-CG1 4.1Å; I186-I225 HydrophobicContact CD1-CD1 4.19Å; I186-I225 HydrophobicContact CG1-CD1 4.44Å; L221-I225 WeakPolarHBondContact O-CB 3.4Å; L221-I225 VanDerWaalsContact O-CG1 3.31Å; L221-I225 WeakPolarHBondContact O-CG1 3.11Å; L221-I225 PolarHBondContact O-N 2.02Å; L222-I225 PolarHBondContact O-N 2.94Å; I225-G227 VanDerWaalsContact C-N 3.34Å; I225-G227 PolarHBondContact O-N 3.23Å; I225-W228 PolarHBondContact O-N 3.05Å; I225-L229 HydrophobicContact CG2-CD2 4.49Å; I225-L229 WeakPolarHBondContact O-CA 3.24Å; I225-L229 WeakPolarHBondContact O-CB 3.27Å; I225-L229 PolarHBondContact O-N 2.82Å
226F92.3Very high93.9Very high148 Ų14835.1 Ų35.165%0.64918%0.179SC*.Hα-helixtrans-60.1-41.9-177.7-82.6-66.4000113.1L222L222-F226 HydrophobicContact CB-CD2 4.36Å; L222-F226 HydrophobicContact CB-CE2 4.48Å; L222-F226 HydrophobicContact CD2-CE2 4.15Å; L222-F226 WeakPolarHBondContact O-CB 3.39Å; L222-F226 WeakPolarHBondContact O-CD2 3.19Å; L222-F226 PolarHBondContact O-N 3.11Å
227G92.4Very high93.7Very high2 Ų238.2 Ų38.22%0.02119%0.193CC..Hα-helixtrans-68.2-51.1179.600000112.7F223 N224 I225 S230 S261F223-G227 PolarHBondContact O-N 2.97Å; N224-G227 PolarHBondContact O-N 2.93Å; I225-G227 VanDerWaalsContact C-N 3.34Å; I225-G227 PolarHBondContact O-N 3.23Å; G227-S230 PolarHBondContact O-OG 3.15Å; G227-S261 WeakPolarHBondContact CA-OG 3.39Å
228W93.3Very high93.2Very high28 Ų2838.1 Ų38.111%0.10619%0.193CC..Hα-helixtrans-84.5-26.6-171.2-63.4115.6000113.5S92 I93 Y178 N224 I225 S230 Y231 G232 A258 Q262S92-W228 PolarHBondContact OG-NE1 3.4Å; I93-W228 HydrophobicContact CD1-CB 3.97Å; I93-W228 HydrophobicContact CD1-CD2 4.03Å; I93-W228 HydrophobicContact CD1-CG 3.63Å; I93-W228 VanDerWaalsContact CG1-CD1 3.4Å; I93-W228 HydrophobicContact CG1-CD2 4.43Å; I93-W228 HydrophobicContact CG1-CG 3.92Å; Y178-W228 HydrophobicContact CE1-CB 3.75Å; Y178-W228 WeakPolarHBondContact CE1-O 3.35Å; Y178-W228 PolarHBondContact OH-O 3.36Å; Y178-W228 VanDerWaalsContact OH-O 3.1Å; N224-W228 WeakPolarHBondContact O-CB 3.47Å; N224-W228 PolarHBondContact O-N 3.33Å; N224-W228 PolarHBondContact OD1-NE1 3.47Å; I225-W228 PolarHBondContact O-N 3.05Å; W228-S230 PolarHBondContact O-N 3.16Å; W228-S230 VanDerWaalsContact O-N 3.15Å; W228-Y231 HydrophobicContact CE3-CD2 4.14Å; W228-Y231 HydrophobicContact CZ3-CD2 4.29Å; W228-Y231 WeakPolarHBondContact O-CB 3.14Å; W228-Y231 PolarHBondContact O-N 3.46Å; W228-G232 PolarHBondContact O-N 3.1Å; W228-G232 VanDerWaalsContact O-N 3.13Å; W228-A258 HydrophobicContact CD2-CB 4.42Å; W228-A258 HydrophobicContact CE3-CB 3.94Å; W228-A258 HydrophobicContact CH2-CB 4.2Å; W228-A258 HydrophobicContact CZ3-CB 3.83Å; W228-Q262 HydrophobicContact CZ2-CG 3.99Å
229L90.7Very high92.8Very high80 Ų8038 Ų3842%0.41919%0.192SC..Hα-helixtrans-54.8-35.4179.7176.863.4000111.5I225 Y231 G232 L233I225-L229 HydrophobicContact CG2-CD2 4.49Å; I225-L229 WeakPolarHBondContact O-CA 3.24Å; I225-L229 WeakPolarHBondContact O-CB 3.27Å; I225-L229 PolarHBondContact O-N 2.82Å; L229-Y231 VanDerWaalsContact C-N 3.29Å; L229-Y231 PolarHBondContact O-N 3.13Å; L229-G232 WeakPolarHBondContact O-CA 3.45Å; L229-G232 PolarHBondContact O-N 3.33Å; L229-L233 HydrophobicContact CD1-CG 4.19Å; L229-L233 HydrophobicContact CG-CD1 4.2Å; L229-L233 HydrophobicContact CG-CG 4.26Å; L229-L233 WeakPolarHBondContact O-CG 3.27Å; L229-L233 PolarHBondContact O-N 3.25Å
230S90.9Very high92.5Very high15 Ų1542.9 Ų42.911%0.10521%0.214CC..Hα-helixtrans-55.7-43175.561.90000112.3G227 W228 L234 T254G227-S230 PolarHBondContact O-OG 3.15Å; W228-S230 PolarHBondContact O-N 3.16Å; W228-S230 VanDerWaalsContact O-N 3.15Å; S230-L234 WeakPolarHBondContact O-CG 3.41Å; S230-L234 PolarHBondContact O-N 3.46Å; S230-L234 VanDerWaalsContact O-N 3.08Å; S230-T254 WeakPolarHBondContact OG-CG2 2.9Å
231Y90.2Very high92.1Very high14 Ų1444.5 Ų44.56%0.05523%0.225CC..Hα-helixtrans-69.8-37.7173.3-86.8-66.8000112.8L156 W159 Y178 W228 L229 L233 L234 A235 T254 Q255 A258L156-Y231 HydrophobicContact CD2-CD1 3.87Å; L156-Y231 HydrophobicContact CD2-CE1 3.17Å; L156-Y231 HydrophobicContact CD2-CE2 4.34Å; L156-Y231 VanDerWaalsContact CD2-CZ 3.43Å; W159-Y231 HydrophobicContact CH2-CD1 4.01Å; W159-Y231 AromaticContact CZ2-CD1 3.75Å; W159-Y231 HydrophobicContact CZ2-CD1 3.75Å; W159-Y231 AromaticContact CZ2-CE1 3.87Å; W159-Y231 HydrophobicContact CZ2-CE1 3.87Å; Y178-Y231 VanDerWaalsContact OH-CB 3.27Å; Y178-Y231 WeakPolarHBondContact OH-CB 3.44Å; W228-Y231 HydrophobicContact CE3-CD2 4.14Å; W228-Y231 HydrophobicContact CZ3-CD2 4.29Å; W228-Y231 WeakPolarHBondContact O-CB 3.14Å; W228-Y231 PolarHBondContact O-N 3.46Å; L229-Y231 VanDerWaalsContact C-N 3.29Å; L229-Y231 PolarHBondContact O-N 3.13Å; Y231-L233 VanDerWaalsContact C-N 3.31Å; Y231-L233 PolarHBondContact O-N 2.94Å; Y231-L234 HydrophobicContact CD1-CD1 4.47Å; Y231-L234 PolarHBondContact O-N 3.05Å; Y231-A235 PolarHBondContact O-N 3.45Å; Y231-T254 HydrophobicContact CD1-CG2 3.46Å; Y231-T254 VanDerWaalsContact CD1-CG2 3.46Å; Y231-T254 HydrophobicContact CD2-CG2 3.54Å; Y231-T254 HydrophobicContact CE1-CG2 3.63Å; Y231-T254 HydrophobicContact CE2-CG2 3.75Å; Y231-T254 HydrophobicContact CG-CG2 3.4Å; Y231-T254 VanDerWaalsContact CG-CG2 3.4Å; Y231-Q255 WeakPolarHBondContact OH-CA 3.49Å; Y231-Q255 WeakPolarHBondContact OH-CB 3.35Å; Y231-Q255 WeakPolarHBondContact OH-CG 3.49Å; Y231-A258 HydrophobicContact CD2-CB 3.91Å; Y231-A258 HydrophobicContact CE2-CB 3.71Å
232G90.5Very high91.4Very high1 Ų145.8 Ų45.81%0.0124%0.24CC..Hα-helixtrans-59.8-42.9174.800000112Y178 W228 L229 A235 I236Y178-G232 PolarHBondContact OH-N 2.89Å; W228-G232 PolarHBondContact O-N 3.1Å; W228-G232 VanDerWaalsContact O-N 3.13Å; L229-G232 WeakPolarHBondContact O-CA 3.45Å; L229-G232 PolarHBondContact O-N 3.33Å; G232-A235 PolarHBondContact O-N 2.92Å; G232-I236 WeakPolarHBondContact O-CG1 3.42Å; G232-I236 PolarHBondContact O-N 3.04Å
233L91.8Very high90.5Very high100 Ų10047.3 Ų47.352%0.52424%0.244SC..Hα-helixtrans-66.5-40.6175.8-67.2175.7000112.1L229 Y231 A235 I236 H237L229-L233 HydrophobicContact CD1-CG 4.19Å; L229-L233 HydrophobicContact CG-CD1 4.2Å; L229-L233 HydrophobicContact CG-CG 4.26Å; L229-L233 WeakPolarHBondContact O-CG 3.27Å; L229-L233 PolarHBondContact O-N 3.25Å; Y231-L233 VanDerWaalsContact C-N 3.31Å; Y231-L233 PolarHBondContact O-N 2.94Å; L233-A235 VanDerWaalsContact C-N 3.31Å; L233-A235 PolarHBondContact O-N 3.24Å; L233-I236 PolarHBondContact O-N 3.39Å; L233-H237 VanDerWaalsContact O-CB 3.28Å; L233-H237 WeakPolarHBondContact O-CB 3.22Å; L233-H237 PolarHBondContact O-N 3.45Å
234L89.4Confident89.8Confident9 Ų948 Ų485%0.04725%0.25CS..Hα-helixtrans-60.5-41.1172.5-74.3-172.4000111.8W159 S230 Y231 H237 S238 L246 Y251 T254W159-L234 HydrophobicContact CH2-CB 4.4Å; W159-L234 HydrophobicContact CZ3-CB 4.25Å; S230-L234 WeakPolarHBondContact O-CG 3.41Å; S230-L234 PolarHBondContact O-N 3.46Å; S230-L234 VanDerWaalsContact O-N 3.08Å; Y231-L234 HydrophobicContact CD1-CD1 4.47Å; Y231-L234 PolarHBondContact O-N 3.05Å; L234-H237 PolarHBondContact O-N 3.05Å; L234-S238 WeakPolarHBondContact O-CB 3.32Å; L234-S238 PolarHBondContact O-N 3.28Å; L234-S238 PolarHBondContact O-OG 2.9Å; L234-L246 HydrophobicContact CD2-CD1 3.42Å; L234-L246 VanDerWaalsContact CD2-CD1 3.42Å; L234-Y251 HydrophobicContact CD1-CD1 3.83Å; L234-Y251 HydrophobicContact CD1-CE1 4.22Å; L234-Y251 HydrophobicContact CD1-CG 4.48Å; L234-Y251 HydrophobicContact CD2-CE1 4.42Å; L234-T254 HydrophobicContact CD1-CG2 3.47Å; L234-T254 VanDerWaalsContact CD1-CG2 3.47Å; L234-T254 WeakPolarHBondContact CD1-OG1 3.37Å; L234-T254 HydrophobicContact CG-CG2 4.16Å
235A89.1Confident89.3Confident9 Ų951.5 Ų51.57%0.07427%0.271CS..Hα-helixtrans-62.8-47.4177.600000112.1W159 Y231 G232 L233 H237 S238 L239W159-A235 HydrophobicContact CZ3-CB 4.18Å; Y231-A235 PolarHBondContact O-N 3.45Å; G232-A235 PolarHBondContact O-N 2.92Å; L233-A235 VanDerWaalsContact C-N 3.31Å; L233-A235 PolarHBondContact O-N 3.24Å; A235-H237 VanDerWaalsContact C-N 3.34Å; A235-H237 PolarHBondContact O-N 3.25Å; A235-S238 PolarHBondContact O-N 2.87Å; A235-L239 WeakPolarHBondContact O-CB 3.48Å; A235-L239 VanDerWaalsContact O-CG 3.27Å; A235-L239 WeakPolarHBondContact O-CG 3.45Å; A235-L239 PolarHBondContact O-N 3.34Å
236I91.3Very high88.8Confident55 Ų5552.2 Ų52.228%0.28228%0.275SS..Hα-helixtrans-59-48.7174.7-63.7170.1000110.4F174 G232 L233 S238 L239 I240F174-I236 HydrophobicContact CD2-CD1 4.22Å; F174-I236 HydrophobicContact CD2-CG1 4.01Å; F174-I236 HydrophobicContact CE1-CD1 4.35Å; F174-I236 HydrophobicContact CE1-CG1 4.44Å; F174-I236 HydrophobicContact CE2-CD1 3.48Å; F174-I236 VanDerWaalsContact CE2-CD1 3.48Å; F174-I236 HydrophobicContact CE2-CG1 3.79Å; F174-I236 HydrophobicContact CG-CG1 4.46Å; F174-I236 HydrophobicContact CZ-CD1 3.54Å; F174-I236 HydrophobicContact CZ-CG1 4Å; G232-I236 WeakPolarHBondContact O-CG1 3.42Å; G232-I236 PolarHBondContact O-N 3.04Å; L233-I236 PolarHBondContact O-N 3.39Å; I236-S238 VanDerWaalsContact C-N 3.31Å; I236-S238 PolarHBondContact O-N 3.39Å; I236-L239 PolarHBondContact O-N 2.84Å; I236-I240 HydrophobicContact CG2-CD1 3.61Å; I236-I240 HydrophobicContact CG2-CG1 4.33Å; I236-I240 WeakPolarHBondContact O-CG1 3.5Å; I236-I240 PolarHBondContact O-N 3.38Å
237H91.5Very high88.7Confident64 Ų6449.1 Ų49.130%0.29627%0.266SS..Hα-helixtrans-58.5-45.2-178.7179.577.2000111.7L233 L234 A235 I240 S241 T245L233-H237 VanDerWaalsContact O-CB 3.28Å; L233-H237 WeakPolarHBondContact O-CB 3.22Å; L233-H237 PolarHBondContact O-N 3.45Å; L234-H237 PolarHBondContact O-N 3.05Å; A235-H237 VanDerWaalsContact C-N 3.34Å; A235-H237 PolarHBondContact O-N 3.25Å; H237-I240 PolarHBondContact O-N 3.31Å; H237-S241 WeakPolarHBondContact O-CB 3.33Å; H237-S241 PolarHBondContact O-N 3.32Å; H237-S241 PolarHBondContact O-OG 3.03Å; H237-T245 PolarHBondContact NE2-OG1 3.35Å
238S88.8Confident88.5Confident0 Ų051.2 Ų51.20%028%0.279CS..Hα-helixtrans-67.9-37.4177.4-73.90000112.9M162 L234 A235 I236 I240 G242M162-S238 VanDerWaalsContact CE-CB 3.41Å; L234-S238 WeakPolarHBondContact O-CB 3.32Å; L234-S238 PolarHBondContact O-N 3.28Å; L234-S238 PolarHBondContact O-OG 2.9Å; A235-S238 PolarHBondContact O-N 2.87Å; I236-S238 VanDerWaalsContact C-N 3.31Å; I236-S238 PolarHBondContact O-N 3.39Å; S238-I240 VanDerWaalsContact C-N 3.34Å; S238-I240 PolarHBondContact O-N 3.24Å; S238-G242 WeakPolarHBondContact O-CA 3.29Å; S238-G242 PolarHBondContact O-N 2.86Å
239L89.8Confident88.2Confident42 Ų4252.7 Ų52.722%0.2229%0.286CS..Hα-helixtrans-62.1-40.1174.2-77.9169.4000112.3K167 M170 F171 A235 I236K167-L239 HydrophobicContact CB-CD2 4.11Å; K167-L239 HydrophobicContact CG-CD2 4.05Å; M170-L239 HydrophobicContact CB-CD1 4.16Å; M170-L239 HydrophobicContact CB-CD2 4.03Å; M170-L239 HydrophobicContact CB-CG 4.12Å; F171-L239 HydrophobicContact CB-CD1 4.4Å; A235-L239 WeakPolarHBondContact O-CB 3.48Å; A235-L239 VanDerWaalsContact O-CG 3.27Å; A235-L239 WeakPolarHBondContact O-CG 3.45Å; A235-L239 PolarHBondContact O-N 3.34Å; I236-L239 PolarHBondContact O-N 2.84Å
240I90.9Very high88.2Confident142 Ų14250.9 Ų50.973%0.72828%0.28SS*.Hα-helixtrans-75.2-48.3180-66.1170.4000111.1I236 H237 S238I236-I240 HydrophobicContact CG2-CD1 3.61Å; I236-I240 HydrophobicContact CG2-CG1 4.33Å; I236-I240 WeakPolarHBondContact O-CG1 3.5Å; I236-I240 PolarHBondContact O-N 3.38Å; H237-I240 PolarHBondContact O-N 3.31Å; S238-I240 VanDerWaalsContact C-N 3.34Å; S238-I240 PolarHBondContact O-N 3.24Å
241S88.8Confident88.2Confident35 Ų3550.1 Ų50.125%0.24528%0.275CS..Hα-helixtrans-77.4-27-174.159.10000113.3H237 Q243H237-S241 WeakPolarHBondContact O-CB 3.33Å; H237-S241 PolarHBondContact O-N 3.32Å; H237-S241 PolarHBondContact O-OG 3.03Å; S241-Q243 PolarHBondContact O-N 3.07Å; S241-Q243 PolarHBondContact OG-O 2.76Å
242G82.4Confident88.2Confident32 Ų3249.7 Ų49.733%0.3327%0.274SS..  trans68.5-4.1-179.500000115.2S238S238-G242 WeakPolarHBondContact O-CA 3.29Å; S238-G242 PolarHBondContact O-N 2.86Å
243Q78.5Confident88.3Confident123 Ų12353.4 Ų53.458%0.57529%0.293SS*.SBendtrans-149.8164.6-173.870.2-174.2-10.800111.8S241 T245S241-Q243 PolarHBondContact O-N 3.07Å; S241-Q243 PolarHBondContact OG-O 2.76Å; Q243-T245 HydrophobicContact CG-CG2 3.7Å; Q243-T245 PolarHBondContact O-N 2.7Å
244L81.9Confident88.3Confident71 Ų7149.2 Ų49.237%0.37227%0.271SS..  trans-7399177.6-166.981000111.4P150 T160 Y251P150-L244 HydrophobicContact CB-CD1 4.07Å; P150-L244 HydrophobicContact CB-CD2 4.04Å; P150-L244 HydrophobicContact CG-CD1 3.44Å; P150-L244 VanDerWaalsContact CG-CD1 3.44Å; P150-L244 HydrophobicContact CG-CD2 4.25Å; T160-L244 HydrophobicContact CG2-CB 4.34Å; T160-L244 HydrophobicContact CG2-CD1 4.15Å; T160-L244 HydrophobicContact CG2-CD2 4.47Å; L244-Y251 HydrophobicContact CD1-CE1 4.34Å; L244-Y251 HydrophobicContact CD1-CE2 3.69Å; L244-Y251 VanDerWaalsContact CD1-CZ 3.48Å; L244-Y251 WeakPolarHBondContact CD1-OH 3.41Å
245T84.7Confident88.5Confident72 Ų7249 Ų4944%0.44227%0.27SS..  trans-108.1-16.9179.348.90000113.7H237 Q243H237-T245 PolarHBondContact NE2-OG1 3.35Å; Q243-T245 HydrophobicContact CG-CG2 3.7Å; Q243-T245 PolarHBondContact O-N 2.7Å
246L86.3Confident88.7Confident54 Ų5449.6 Ų49.628%0.28327%0.272SS..SBendtrans-90152.8-179.2-61.7176.9000111.8L234 Y251L234-L246 HydrophobicContact CD2-CD1 3.42Å; L234-L246 VanDerWaalsContact CD2-CD1 3.42Å; L246-Y251 HydrophobicContact CB-CE2 3.77Å
247N88.9Confident88.9Confident83 Ų8350.6 Ų50.644%0.44428%0.277SS..  trans-61.1136.7171.3-173.3-41000110.1F249 S250N247-F249 PolarHBondContact O-N 3.45Å; N247-F249 WeakPolarHBondContact OD1-CD2 3.27Å; N247-F249 PolarHBondContact OD1-N 3.25Å; N247-S250 WeakPolarHBondContact O-CB 3.48Å; N247-S250 PolarHBondContact O-N 3.06Å; N247-S250 PolarHBondContact O-OG 3.11Å
248P88Confident89.1Confident46 Ų4647.7 Ų47.730%0.29927%0.265SS..Hα-helixtrans-45.9-31.2173.1-32.436.4000115.7P150 H151 S250 Y251 C252P150-P248 HydrophobicContact CB-CB 4.25Å; P150-P248 HydrophobicContact CB-CG 4.31Å; H151-P248 HydrophobicContact CB-CB 4.06Å; P248-S250 VanDerWaalsContact C-N 3.29Å; P248-S250 PolarHBondContact O-N 2.89Å; P248-Y251 PolarHBondContact O-N 3.43Å; P248-C252 PolarHBondContact O-N 3.36Å
249F87.8Confident89.3Confident59 Ų5948.4 Ų48.426%0.25927%0.268SS..Hα-helixtrans-63.1-31.4176.2-68.6-63.4000113.7T5 F8 N247 Y251 C252 I253T5-F249 HydrophobicContact CG2-CE1 3.63Å; T5-F249 HydrophobicContact CG2-CZ 4.29Å; F8-F249 HydrophobicContact CD2-CD1 4.37Å; F8-F249 AromaticContact CE2-CD1 3.55Å; F8-F249 HydrophobicContact CE2-CD1 3.55Å; F8-F249 AromaticContact CE2-CE1 3.98Å; F8-F249 HydrophobicContact CE2-CE1 3.98Å; F8-F249 HydrophobicContact CZ-CD1 4.2Å; N247-F249 PolarHBondContact O-N 3.45Å; N247-F249 WeakPolarHBondContact OD1-CD2 3.27Å; N247-F249 PolarHBondContact OD1-N 3.25Å; F249-Y251 VanDerWaalsContact C-N 3.3Å; F249-Y251 PolarHBondContact O-N 3.1Å; F249-C252 PolarHBondContact O-N 2.74Å; F249-I253 WeakPolarHBondContact O-CG1 3.06Å; F249-I253 PolarHBondContact O-N 2.93Å
250S90.2Very high89.6Confident42 Ų4249.3 Ų49.329%0.29427%0.272SS..Hα-helixtrans-61.8-39.7178.4-58.40000111.6N247 P248 I253 T254N247-S250 WeakPolarHBondContact O-CB 3.48Å; N247-S250 PolarHBondContact O-N 3.06Å; N247-S250 PolarHBondContact O-OG 3.11Å; P248-S250 VanDerWaalsContact C-N 3.29Å; P248-S250 PolarHBondContact O-N 2.89Å; S250-I253 PolarHBondContact O-N 3.46Å; S250-T254 WeakPolarHBondContact O-CB 3.49Å; S250-T254 PolarHBondContact O-N 3.22Å; S250-T254 PolarHBondContact O-OG1 3.42Å
251Y91Very high89.9Confident0 Ų042.8 Ų42.80%024%0.239CC..Hα-helixtrans-65.6-42.9176.1-60.1-90.7000111.4P150 W159 L234 L244 L246 P248 F249 I253 T254 Q255P150-Y251 HydrophobicContact CB-CD2 4.15Å; P150-Y251 HydrophobicContact CB-CE2 4.4Å; P150-Y251 HydrophobicContact CG-CD1 4.14Å; P150-Y251 HydrophobicContact CG-CD2 3.82Å; P150-Y251 HydrophobicContact CG-CE1 4.25Å; P150-Y251 HydrophobicContact CG-CE2 3.92Å; P150-Y251 HydrophobicContact CG-CG 3.95Å; W159-Y251 HydrophobicContact CB-CD1 4.45Å; W159-Y251 HydrophobicContact CB-CE1 3.67Å; W159-Y251 AromaticContact CD1-CD1 3.57Å; W159-Y251 AromaticContact CD1-CE1 3.67Å; W159-Y251 HydrophobicContact CD2-CD1 4.34Å; W159-Y251 HydrophobicContact CD2-CE1 4.03Å; W159-Y251 AromaticContact CG-CD1 3.87Å; W159-Y251 HydrophobicContact CG-CD1 3.87Å; W159-Y251 AromaticContact CG-CE1 3.49Å; W159-Y251 HydrophobicContact CG-CE1 3.49Å; W159-Y251 VanDerWaalsContact CG-CE1 3.49Å; W159-Y251 AromaticContact NE1-CD1 3.83Å; L234-Y251 HydrophobicContact CD1-CD1 3.83Å; L234-Y251 HydrophobicContact CD1-CE1 4.22Å; L234-Y251 HydrophobicContact CD1-CG 4.48Å; L234-Y251 HydrophobicContact CD2-CE1 4.42Å; L244-Y251 HydrophobicContact CD1-CE1 4.34Å; L244-Y251 HydrophobicContact CD1-CE2 3.69Å; L244-Y251 VanDerWaalsContact CD1-CZ 3.48Å; L244-Y251 WeakPolarHBondContact CD1-OH 3.41Å; L246-Y251 HydrophobicContact CB-CE2 3.77Å; P248-Y251 PolarHBondContact O-N 3.43Å; F249-Y251 VanDerWaalsContact C-N 3.3Å; F249-Y251 PolarHBondContact O-N 3.1Å; Y251-I253 PolarHBondContact O-N 3.44Å; Y251-T254 PolarHBondContact O-N 3.24Å; Y251-Q255 PolarHBondContact O-N 3.38Å
252C91.1Very high90.3Very high4 Ų441.1 Ų41.13%0.02723%0.228CC..Hα-helixtrans-64.6-39.4177.6-1680000112.3F8 P248 F249 Q255 L256F8-C252 HydrophobicContact CD1-CB 4.45Å; F8-C252 WeakPolarHBondContact CD1-SG 3.46Å; F8-C252 HydrophobicContact CE1-CB 4.42Å; F8-C252 VanDerWaalsContact CG-SG 3.55Å; P248-C252 PolarHBondContact O-N 3.36Å; F249-C252 PolarHBondContact O-N 2.74Å; C252-Q255 PolarHBondContact O-N 3.2Å; C252-L256 WeakPolarHBondContact O-CB 3.23Å; C252-L256 PolarHBondContact O-N 3.45Å
253I91.9Very high91Very high79 Ų7939.6 Ų39.641%0.40521%0.212SC..Hα-helixtrans-64.1-48176.2-71166.9000110.3F8 F249 S250 Y251 Q255 L256 L257F8-I253 HydrophobicContact CE1-CG1 3.71Å; F8-I253 HydrophobicContact CZ-CD1 4.45Å; F8-I253 HydrophobicContact CZ-CG1 3.85Å; F249-I253 WeakPolarHBondContact O-CG1 3.06Å; F249-I253 PolarHBondContact O-N 2.93Å; S250-I253 PolarHBondContact O-N 3.46Å; Y251-I253 PolarHBondContact O-N 3.44Å; I253-Q255 VanDerWaalsContact C-N 3.3Å; I253-Q255 PolarHBondContact O-N 3.45Å; I253-L256 PolarHBondContact O-N 3.36Å; I253-L256 VanDerWaalsContact O-N 3.1Å; I253-L257 HydrophobicContact CG2-CD1 3.99Å; I253-L257 HydrophobicContact CG2-CG 4.26Å; I253-L257 WeakPolarHBondContact O-CG 3.36Å; I253-L257 PolarHBondContact O-N 3.25Å
254T92.4Very high91.8Very high12 Ų1236.6 Ų36.67%0.07420%0.197CC..Hα-helixtrans-56.6-44.6176.7-70.90000111.6S230 Y231 L234 S250 Y251 L256 L257 A258S230-T254 WeakPolarHBondContact OG-CG2 2.9Å; Y231-T254 HydrophobicContact CD1-CG2 3.46Å; Y231-T254 VanDerWaalsContact CD1-CG2 3.46Å; Y231-T254 HydrophobicContact CD2-CG2 3.54Å; Y231-T254 HydrophobicContact CE1-CG2 3.63Å; Y231-T254 HydrophobicContact CE2-CG2 3.75Å; Y231-T254 HydrophobicContact CG-CG2 3.4Å; Y231-T254 VanDerWaalsContact CG-CG2 3.4Å; L234-T254 HydrophobicContact CD1-CG2 3.47Å; L234-T254 VanDerWaalsContact CD1-CG2 3.47Å; L234-T254 WeakPolarHBondContact CD1-OG1 3.37Å; L234-T254 HydrophobicContact CG-CG2 4.16Å; S250-T254 WeakPolarHBondContact O-CB 3.49Å; S250-T254 PolarHBondContact O-N 3.22Å; S250-T254 PolarHBondContact O-OG1 3.42Å; Y251-T254 PolarHBondContact O-N 3.24Å; T254-L256 VanDerWaalsContact C-N 3.35Å; T254-L256 PolarHBondContact O-N 3.17Å; T254-L257 PolarHBondContact O-N 2.75Å; T254-A258 PolarHBondContact O-N 3.06Å; T254-A258 VanDerWaalsContact O-N 3.11Å
255Q92.8Very high92.5Very high5 Ų533.2 Ų33.22%0.02318%0.179CC..Hα-helixtrans-59.4-44.5174.3-175169.16600112.9F12 Y81 S154 Y231 Y251 C252 I253 K259F12-Q255 HydrophobicContact CE1-CG 4.03Å; F12-Q255 HydrophobicContact CZ-CB 4.36Å; F12-Q255 HydrophobicContact CZ-CG 4.1Å; Y81-Q255 PolarHBondContact OH-NE2 3.48Å; S154-Q255 VanDerWaalsContact CB-OE1 3.31Å; S154-Q255 VanDerWaalsContact OG-CD 3.25Å; S154-Q255 PolarHBondContact OG-NE2 2.76Å; S154-Q255 PolarHBondContact OG-OE1 3.02Å; Y231-Q255 WeakPolarHBondContact OH-CA 3.49Å; Y231-Q255 WeakPolarHBondContact OH-CB 3.35Å; Y231-Q255 WeakPolarHBondContact OH-CG 3.49Å; Y251-Q255 PolarHBondContact O-N 3.38Å; C252-Q255 PolarHBondContact O-N 3.2Å; I253-Q255 VanDerWaalsContact C-N 3.3Å; I253-Q255 PolarHBondContact O-N 3.45Å; Q255-K259 HydrophobicContact CG-CD 4.22Å; Q255-K259 WeakPolarHBondContact O-CG 3.37Å; Q255-K259 PolarHBondContact O-N 3.45Å
256L93.7Very high93.1Very high21 Ų2129.8 Ų29.811%0.1116%0.158CC..Hα-helixtrans-66.2-42179.8-176.963.5000111.6F8 A11 F12 C252 I253 T254 A258 K259 I260F8-L256 HydrophobicContact CD1-CD2 4.22Å; A11-L256 HydrophobicContact CB-CD1 4Å; A11-L256 HydrophobicContact CB-CD2 3.68Å; F12-L256 HydrophobicContact CD1-CD1 3.61Å; F12-L256 HydrophobicContact CE1-CB 3.88Å; F12-L256 HydrophobicContact CE1-CD1 3.78Å; F12-L256 HydrophobicContact CE1-CG 4.43Å; F12-L256 HydrophobicContact CG-CD1 4.28Å; F12-L256 HydrophobicContact CZ-CB 4.24Å; C252-L256 WeakPolarHBondContact O-CB 3.23Å; C252-L256 PolarHBondContact O-N 3.45Å; I253-L256 PolarHBondContact O-N 3.36Å; I253-L256 VanDerWaalsContact O-N 3.1Å; T254-L256 VanDerWaalsContact C-N 3.35Å; T254-L256 PolarHBondContact O-N 3.17Å; L256-A258 PolarHBondContact O-N 3.04Å; L256-K259 PolarHBondContact O-N 3.11Å; L256-K259 VanDerWaalsContact O-N 3.16Å; L256-I260 HydrophobicContact CD1-CD1 4.13Å; L256-I260 HydrophobicContact CD1-CG1 4.22Å; L256-I260 HydrophobicContact CD2-CD1 4.29Å; L256-I260 HydrophobicContact CG-CD1 3.74Å; L256-I260 HydrophobicContact CG-CG1 4.26Å; L256-I260 WeakPolarHBondContact O-CB 3.49Å; L256-I260 VanDerWaalsContact O-CG1 3.31Å; L256-I260 WeakPolarHBondContact O-CG1 3.48Å; L256-I260 PolarHBondContact O-N 3.28Å
257L95.2Very high93.6Very high76 Ų7629.5 Ų29.540%0.39816%0.157SC..Hα-helixtrans-60.4-44177.4-73.2174.4000112.1I253 T254 K259 I260 S261I253-L257 HydrophobicContact CG2-CD1 3.99Å; I253-L257 HydrophobicContact CG2-CG 4.26Å; I253-L257 WeakPolarHBondContact O-CG 3.36Å; I253-L257 PolarHBondContact O-N 3.25Å; T254-L257 PolarHBondContact O-N 2.75Å; L257-K259 VanDerWaalsContact C-N 3.31Å; L257-K259 PolarHBondContact O-N 3.27Å; L257-I260 PolarHBondContact O-N 3.04Å; L257-S261 PolarHBondContact O-N 3.08Å
258A95Very high93.9Very high4 Ų425.6 Ų25.63%0.03314%0.136CC..Hα-helixtrans-60.1-42175.300000111.5W228 Y231 T254 L256 S261 Q262W228-A258 HydrophobicContact CD2-CB 4.42Å; W228-A258 HydrophobicContact CE3-CB 3.94Å; W228-A258 HydrophobicContact CH2-CB 4.2Å; W228-A258 HydrophobicContact CZ3-CB 3.83Å; Y231-A258 HydrophobicContact CD2-CB 3.91Å; Y231-A258 HydrophobicContact CE2-CB 3.71Å; T254-A258 PolarHBondContact O-N 3.06Å; T254-A258 VanDerWaalsContact O-N 3.11Å; L256-A258 PolarHBondContact O-N 3.04Å; A258-S261 PolarHBondContact O-OG 2.89Å; A258-Q262 WeakPolarHBondContact O-CG 3.42Å; A258-Q262 PolarHBondContact O-N 3.32Å
259K95Very high94.3Very high15 Ų1523.4 Ų23.47%0.06512%0.122CC..Hα-helixtrans-71.2-40.7178.9-69.2167.1178-58.40112.7F12 T15 T59 Y81 Q255 L256 L257 S261 Q262 A263F12-K259 HydrophobicContact CD1-CD 3.67Å; F12-K259 HydrophobicContact CE1-CD 3.62Å; T15-K259 HydrophobicContact CG2-CB 4.12Å; T59-K259 HydrophobicContact CG2-CD 3.74Å; T59-K259 VanDerWaalsContact OG1-CD 3.29Å; T59-K259 WeakPolarHBondContact OG1-CD 3.45Å; T59-K259 WeakPolarHBondContact OG1-CG 3.24Å; T59-K259 PolarHBondContact OG1-NZ 3.43Å; Y81-K259 VanDerWaalsContact OH-CE 3.24Å; Y81-K259 WeakPolarHBondContact OH-CE 3.46Å; Y81-K259 PolarHBondContact OH-NZ 2.95Å; Q255-K259 HydrophobicContact CG-CD 4.22Å; Q255-K259 WeakPolarHBondContact O-CG 3.37Å; Q255-K259 PolarHBondContact O-N 3.45Å; L256-K259 PolarHBondContact O-N 3.11Å; L256-K259 VanDerWaalsContact O-N 3.16Å; L257-K259 VanDerWaalsContact C-N 3.31Å; L257-K259 PolarHBondContact O-N 3.27Å; K259-S261 VanDerWaalsContact C-N 3.3Å; K259-S261 PolarHBondContact O-N 3.35Å; K259-Q262 PolarHBondContact O-N 2.85Å; K259-A263 WeakPolarHBondContact O-CB 3.45Å; K259-A263 PolarHBondContact O-N 3.48Å
260I95.7Very high94.6Very high60 Ų6021.7 Ų21.731%0.30812%0.117SC..Hα-helixtrans-59.4-44.4176.3-73171.3000109.9T15 L256 L257 Q262 A263 F264T15-I260 HydrophobicContact CG2-CB 4.49Å; T15-I260 HydrophobicContact CG2-CG1 3.9Å; L256-I260 HydrophobicContact CD1-CD1 4.13Å; L256-I260 HydrophobicContact CD1-CG1 4.22Å; L256-I260 HydrophobicContact CD2-CD1 4.29Å; L256-I260 HydrophobicContact CG-CD1 3.74Å; L256-I260 HydrophobicContact CG-CG1 4.26Å; L256-I260 WeakPolarHBondContact O-CB 3.49Å; L256-I260 VanDerWaalsContact O-CG1 3.31Å; L256-I260 WeakPolarHBondContact O-CG1 3.48Å; L256-I260 PolarHBondContact O-N 3.28Å; L257-I260 PolarHBondContact O-N 3.04Å; I260-Q262 VanDerWaalsContact C-N 3.32Å; I260-Q262 PolarHBondContact O-N 2.86Å; I260-A263 PolarHBondContact O-N 2.9Å; I260-F264 HydrophobicContact CG2-CD2 4.04Å; I260-F264 HydrophobicContact CG2-CE2 4.44Å; I260-F264 WeakPolarHBondContact O-CB 3.41Å; I260-F264 VanDerWaalsContact O-CD2 3.3Å; I260-F264 WeakPolarHBondContact O-CD2 3.4Å; I260-F264 PolarHBondContact O-N 3.41Å
261S96.2Very high94.8Very high6 Ų626.5 Ų26.54%0.04213%0.13CC..Hα-helixtrans-60.8-42.4179.975.20000112.4F223 G227 L257 A258 K259 L265F223-S261 WeakPolarHBondContact O-CB 3.38Å; G227-S261 WeakPolarHBondContact CA-OG 3.39Å; L257-S261 PolarHBondContact O-N 3.08Å; A258-S261 PolarHBondContact O-OG 2.89Å; K259-S261 VanDerWaalsContact C-N 3.3Å; K259-S261 PolarHBondContact O-N 3.35Å; S261-L265 WeakPolarHBondContact O-CB 3.49Å; S261-L265 PolarHBondContact O-N 3.47Å
262Q96.8Very high95Very high0 Ų026.5 Ų26.50%013%0.13CC..Hα-helixtrans-69.8-37.1178.3-58.7-52.4-50.800112.4H23 C52 C55 S92 N224 W228 A258 K259 I260H23-Q262 PolarHBondContact NE2-O 3.17Å; C52-Q262 HydrophobicContact CB-CB 4.37Å; C52-Q262 PolarHBondContact SG-OE1 3.28Å; C55-Q262 HydrophobicContact CB-CB 4.02Å; C55-Q262 HydrophobicContact CB-CG 3.99Å; S92-Q262 PolarHBondContact OG-OE1 2.87Å; N224-Q262 PolarHBondContact OD1-NE2 3.45Å; W228-Q262 HydrophobicContact CZ2-CG 3.99Å; A258-Q262 WeakPolarHBondContact O-CG 3.42Å; A258-Q262 PolarHBondContact O-N 3.32Å; K259-Q262 PolarHBondContact O-N 2.85Å; I260-Q262 VanDerWaalsContact C-N 3.32Å; I260-Q262 PolarHBondContact O-N 2.86Å
263A96.9Very high95.1Very high0 Ų028.3 Ų28.30%014%0.138CC..Hα-helixtrans-66.1-39.1176.400000112.8T15 L22 I56 K259 I260 P266T15-A263 HydrophobicContact CG2-CB 3.62Å; T15-A263 WeakPolarHBondContact O-CB 3.46Å; L22-A263 WeakPolarHBondContact CD1-O 3.41Å; I56-A263 HydrophobicContact CD1-CB 4.27Å; I56-A263 HydrophobicContact CG1-CB 4.22Å; K259-A263 WeakPolarHBondContact O-CB 3.45Å; K259-A263 PolarHBondContact O-N 3.48Å; I260-A263 PolarHBondContact O-N 2.9Å; A263-P266 WeakPolarHBondContact O-CD 3.38Å
264F96.5Very high95.2Very high59 Ų5931 Ų3126%0.25915%0.147SC..Hα-helixtrans-97.2-6.9-172.9-74.8-112.6000113.6L18 L22 F223 I260 P266 I267L18-F264 HydrophobicContact CB-CZ 4.42Å; L18-F264 HydrophobicContact CD1-CZ 3.94Å; L22-F264 HydrophobicContact CD1-CD1 4.24Å; L22-F264 HydrophobicContact CD1-CG 4.26Å; F223-F264 HydrophobicContact CE1-CB 4.12Å; I260-F264 HydrophobicContact CG2-CD2 4.04Å; I260-F264 HydrophobicContact CG2-CE2 4.44Å; I260-F264 WeakPolarHBondContact O-CB 3.41Å; I260-F264 VanDerWaalsContact O-CD2 3.3Å; I260-F264 WeakPolarHBondContact O-CD2 3.4Å; I260-F264 PolarHBondContact O-N 3.41Å; F264-P266 VanDerWaalsContact O-N 3.11Å; F264-I267 HydrophobicContact CB-CD1 4.14Å; F264-I267 HydrophobicContact CD1-CD1 3.59Å; F264-I267 HydrophobicContact CE1-CD1 4.49Å; F264-I267 HydrophobicContact CG-CD1 4.32Å; F264-I267 WeakPolarHBondContact O-CB 3.26Å; F264-I267 VanDerWaalsContact O-CG1 3.31Å; F264-I267 WeakPolarHBondContact O-CG1 3.5Å; F264-I267 PolarHBondContact O-N 2.98Å
265L97.2Very high95.2Very high0 Ų032.2 Ų32.20%015%0.152CC..THydrogen-bonded Turntrans-47.7-36.7173.7-168.1145.5000114.3L48 I220 F223 N224 S261 I267 A268 Y269L48-L265 HydrophobicContact CD2-CD2 4.39Å; I220-L265 HydrophobicContact CG1-CD2 4.44Å; I220-L265 HydrophobicContact CG2-CD1 4.26Å; F223-L265 HydrophobicContact CB-CD1 4.46Å; N224-L265 WeakPolarHBondContact ND2-CD1 3.37Å; S261-L265 WeakPolarHBondContact O-CB 3.49Å; S261-L265 PolarHBondContact O-N 3.47Å; L265-I267 PolarHBondContact O-N 3.47Å; L265-A268 WeakPolarHBondContact O-CB 3.49Å; L265-A268 PolarHBondContact O-N 2.92Å; L265-Y269 HydrophobicContact CD2-CD2 4.32Å; L265-Y269 HydrophobicContact CD2-CE2 3.58Å
266P96.9Very high95.2Very high0 Ų032.3 Ų32.30%015%0.152CC..Hα-helixtrans-52.5-20.9171.8-32.940.3000117L22 H23 N26 A263 F264 A268 Y269 S270L22-P266 HydrophobicContact CB-CB 3.95Å; L22-P266 HydrophobicContact CB-CG 4Å; H23-P266 HydrophobicContact CB-CG 4.45Å; H23-P266 VanDerWaalsContact CE1-CG 3.42Å; H23-P266 WeakPolarHBondContact CE1-CG 3.34Å; H23-P266 WeakPolarHBondContact NE2-CD 3.31Å; H23-P266 WeakPolarHBondContact NE2-CG 3.13Å; N26-P266 HydrophobicContact CB-CB 4Å; N26-P266 HydrophobicContact CB-CG 4.21Å; A263-P266 WeakPolarHBondContact O-CD 3.38Å; F264-P266 VanDerWaalsContact O-N 3.11Å; P266-A268 VanDerWaalsContact C-N 3.27Å; P266-A268 PolarHBondContact O-N 2.94Å; P266-Y269 PolarHBondContact O-N 3.49Å; P266-S270 PolarHBondContact O-N 3.4Å
267I96.1Very high95.1Very high49 Ų4932.8 Ų32.825%0.25116%0.162SC..Hα-helixtrans-63-36.7176-68178.8000110.8F223 F264 L265 Y269 S270 Y271F223-I267 HydrophobicContact CZ-CB 4.29Å; F264-I267 HydrophobicContact CB-CD1 4.14Å; F264-I267 HydrophobicContact CD1-CD1 3.59Å; F264-I267 HydrophobicContact CE1-CD1 4.49Å; F264-I267 HydrophobicContact CG-CD1 4.32Å; F264-I267 WeakPolarHBondContact O-CB 3.26Å; F264-I267 VanDerWaalsContact O-CG1 3.31Å; F264-I267 WeakPolarHBondContact O-CG1 3.5Å; F264-I267 PolarHBondContact O-N 2.98Å; L265-I267 PolarHBondContact O-N 3.47Å; I267-Y269 VanDerWaalsContact C-N 3.31Å; I267-Y269 PolarHBondContact O-N 2.85Å; I267-S270 WeakPolarHBondContact O-CB 3.08Å; I267-S270 PolarHBondContact O-N 2.98Å; I267-S270 VanDerWaalsContact O-N 3.09Å; I267-Y271 HydrophobicContact CG2-CD2 3.68Å; I267-Y271 HydrophobicContact CG2-CE2 3.28Å; I267-Y271 VanDerWaalsContact O-CD2 3.24Å; I267-Y271 WeakPolarHBondContact O-CD2 3.18Å; I267-Y271 PolarHBondContact O-N 3.34Å
268A96Very high94.9Very high1 Ų135.4 Ų35.41%0.00817%0.173CC..Hα-helixtrans-56.7-46.2174.500000111.3L216 I220 F223 L265 P266 S270 Y271 T272L216-A268 HydrophobicContact CD1-CB 4.42Å; I220-A268 HydrophobicContact CG1-CB 4.05Å; F223-A268 HydrophobicContact CD2-CB 4.43Å; F223-A268 HydrophobicContact CE2-CB 4.3Å; L265-A268 WeakPolarHBondContact O-CB 3.49Å; L265-A268 PolarHBondContact O-N 2.92Å; P266-A268 VanDerWaalsContact C-N 3.27Å; P266-A268 PolarHBondContact O-N 2.94Å; A268-S270 VanDerWaalsContact C-N 3.33Å; A268-S270 PolarHBondContact O-N 2.99Å; A268-Y271 PolarHBondContact O-N 3.35Å; A268-T272 PolarHBondContact O-N 2.91Å; A268-T272 VanDerWaalsContact O-N 3.11Å; A268-T272 PolarHBondContact O-OG1 2.64Å; A268-T272 VanDerWaalsContact O-OG1 3.08Å
269Y96.2Very high94.8Very high0 Ų036.3 Ų36.30%018%0.175CC..Hα-helixtrans-66.9-33176.6-62.9-70.3000112.8N26 L30 I33 H45 L216 I220 L265 P266 I267 T272 E273N26-Y269 VanDerWaalsContact ND2-CD2 3.34Å; N26-Y269 WeakPolarHBondContact ND2-CD2 3.45Å; N26-Y269 WeakPolarHBondContact OD1-CB 3.42Å; N26-Y269 WeakPolarHBondContact OD1-CD2 3.41Å; L30-Y269 HydrophobicContact CD2-CD1 3.9Å; L30-Y269 HydrophobicContact CD2-CE1 3.6Å; L30-Y269 HydrophobicContact CD2-CE2 4.27Å; L30-Y269 HydrophobicContact CD2-CG 4.35Å; I33-Y269 HydrophobicContact CD1-CD1 3.55Å; I33-Y269 HydrophobicContact CD1-CE1 3.6Å; H45-Y269 HydrophobicContact CB-CE1 4.44Å; H45-Y269 AromaticContact ND1-CE1 3.38Å; H45-Y269 WeakPolarHBondContact ND1-CE1 3.34Å; H45-Y269 AromaticContact ND1-CZ 3.54Å; H45-Y269 PolarHBondContact ND1-OH 2.89Å; L216-Y269 HydrophobicContact CD1-CD1 3.6Å; L216-Y269 HydrophobicContact CD1-CE1 3.84Å; L216-Y269 HydrophobicContact CD1-CG 4.33Å; L216-Y269 HydrophobicContact CD2-CD1 4.47Å; L216-Y269 HydrophobicContact CD2-CE1 4.32Å; I220-Y269 HydrophobicContact CD1-CE1 3.96Å; I220-Y269 HydrophobicContact CD1-CE2 4.39Å; L265-Y269 HydrophobicContact CD2-CD2 4.32Å; L265-Y269 HydrophobicContact CD2-CE2 3.58Å; P266-Y269 PolarHBondContact O-N 3.49Å; I267-Y269 VanDerWaalsContact C-N 3.31Å; I267-Y269 PolarHBondContact O-N 2.85Å; Y269-T272 PolarHBondContact O-N 3.41Å; Y269-E273 WeakPolarHBondContact O-CB 3.49Å; Y269-E273 PolarHBondContact O-N 3.39Å
270S94.7Very high94.6Very high23 Ų2339.1 Ų39.116%0.16119%0.191CC..Hα-helixtrans-65.6-40.8176.2-168.90000112.7R29 P266 I267 A268 T272 K274R29-S270 PolarHBondContact NH2-OG 2.7Å; P266-S270 PolarHBondContact O-N 3.4Å; I267-S270 WeakPolarHBondContact O-CB 3.08Å; I267-S270 PolarHBondContact O-N 2.98Å; I267-S270 VanDerWaalsContact O-N 3.09Å; A268-S270 VanDerWaalsContact C-N 3.33Å; A268-S270 PolarHBondContact O-N 2.99Å; S270-T272 VanDerWaalsContact C-N 3.34Å; S270-K274 PolarHBondContact O-N 3.26Å
271Y93.9Very high94.3Very high142 Ų14245.2 Ų45.256%0.55722%0.215SC*.Hα-helixtrans-66.7-39174.4-74.4-63.6000111.5I267 A268 K274 Q275I267-Y271 HydrophobicContact CG2-CD2 3.68Å; I267-Y271 HydrophobicContact CG2-CE2 3.28Å; I267-Y271 VanDerWaalsContact O-CD2 3.24Å; I267-Y271 WeakPolarHBondContact O-CD2 3.18Å; I267-Y271 PolarHBondContact O-N 3.34Å; A268-Y271 PolarHBondContact O-N 3.35Å; Y271-K274 PolarHBondContact O-N 3.2Å; Y271-Q275 WeakPolarHBondContact O-CG 3.36Å; Y271-Q275 PolarHBondContact O-N 3.39Å; Y271-Q275 VanDerWaalsContact O-N 3.16Å; Y271-Q275 PolarHBondContact O-NE2 3.43Å
272T94.8Very high94.1Very high1 Ų149.7 Ų49.71%0.00624%0.242CC..Hα-helixtrans-65.8-41.2176.9-61.40000112.2I33 I36 I212 L216 A268 Y269 S270 K274 Q275 I276I33-T272 HydrophobicContact CG2-CG2 3.95Å; I36-T272 HydrophobicContact CD1-CG2 4.19Å; I212-T272 HydrophobicContact CG2-CG2 3.74Å; L216-T272 HydrophobicContact CB-CG2 4.24Å; L216-T272 HydrophobicContact CD1-CG2 4.38Å; L216-T272 WeakPolarHBondContact CD1-OG1 3.28Å; L216-T272 HydrophobicContact CD2-CG2 4.27Å; A268-T272 PolarHBondContact O-N 2.91Å; A268-T272 VanDerWaalsContact O-N 3.11Å; A268-T272 PolarHBondContact O-OG1 2.64Å; A268-T272 VanDerWaalsContact O-OG1 3.08Å; Y269-T272 PolarHBondContact O-N 3.41Å; S270-T272 VanDerWaalsContact C-N 3.34Å; T272-K274 VanDerWaalsContact C-N 3.31Å; T272-K274 PolarHBondContact O-N 2.9Å; T272-Q275 WeakPolarHBondContact O-CB 3.47Å; T272-Q275 PolarHBondContact O-N 3.42Å; T272-Q275 VanDerWaalsContact O-N 3.12Å; T272-I276 HydrophobicContact CG2-CD1 4.07Å; T272-I276 HydrophobicContact CG2-CG1 4.4Å; T272-I276 WeakPolarHBondContact O-CG1 3.34Å; T272-I276 PolarHBondContact O-N 3.47Å
273E93.8Very high93.6Very high42 Ų4251.6 Ų51.620%0.19625%0.249CC..Hα-helixtrans-54.6-46.3173.9178.1-173.2-159.200111.8R29 K32 Y269 Q275 I276 G277R29-E273 WeakPolarHBondContact CG-OE2 3.34Å; R29-E273 IonicContact NE-OE2 2.84Å; R29-E273 PolarHBondContact NE-OE2 2.86Å; K32-E273 HydrophobicContact CD-CG 4.01Å; K32-E273 VanDerWaalsContact CD-OE1 3.27Å; K32-E273 WeakPolarHBondContact CD-OE1 3.49Å; K32-E273 WeakPolarHBondContact CE-OE1 3.38Å; K32-E273 IonicContact NZ-OE1 2.7Å; K32-E273 PolarHBondContact NZ-OE1 3.24Å; Y269-E273 WeakPolarHBondContact O-CB 3.49Å; Y269-E273 PolarHBondContact O-N 3.39Å; E273-Q275 VanDerWaalsContact C-N 3.34Å; E273-Q275 PolarHBondContact O-N 2.66Å; E273-I276 PolarHBondContact O-N 3.35Å; E273-G277 PolarHBondContact O-N 3.35Å
274K93.3Very high92.6Very high136 Ų13653.4 Ų53.459%0.59127%0.268SS*.Hα-helixtrans-61.4-42.4177-69.5179.9180-179.10111.9S270 Y271 T272 G277 Q278S270-K274 PolarHBondContact O-N 3.26Å; Y271-K274 PolarHBondContact O-N 3.2Å; T272-K274 VanDerWaalsContact C-N 3.31Å; T272-K274 PolarHBondContact O-N 2.9Å; K274-G277 PolarHBondContact O-N 3.39Å; K274-Q278 PolarHBondContact O-N 2.96Å; K274-Q278 VanDerWaalsContact O-N 3.13Å
275Q93.2Very high91.2Very high37 Ų3758.5 Ų58.517%0.17330%0.298CS..Hα-helixtrans-65.1-39.3177.6-71.4177.786.500112.2I212 Y271 T272 E273 G277 Q278 W279I212-Q275 HydrophobicContact CD1-CB 4.14Å; I212-Q275 HydrophobicContact CG1-CB 4.07Å; I212-Q275 HydrophobicContact CG2-CB 4.29Å; Y271-Q275 WeakPolarHBondContact O-CG 3.36Å; Y271-Q275 PolarHBondContact O-N 3.39Å; Y271-Q275 VanDerWaalsContact O-N 3.16Å; Y271-Q275 PolarHBondContact O-NE2 3.43Å; T272-Q275 WeakPolarHBondContact O-CB 3.47Å; T272-Q275 PolarHBondContact O-N 3.42Å; T272-Q275 VanDerWaalsContact O-N 3.12Å; E273-Q275 VanDerWaalsContact C-N 3.34Å; E273-Q275 PolarHBondContact O-N 2.66Å; Q275-G277 VanDerWaalsContact C-N 3.33Å; Q275-Q278 PolarHBondContact O-N 2.68Å; Q275-W279 WeakPolarHBondContact O-CB 3.01Å; Q275-W279 PolarHBondContact O-N 3.23Å
276I91.8Very high89.3Confident6 Ų662.7 Ų62.73%0.03132%0.324CS..Hα-helixtrans-63.9-41174.2-66.4171.1000110.7I33 I36 I212 T272 E273 Q278 W279 N280I33-I276 HydrophobicContact CB-CD1 3.96Å; I33-I276 HydrophobicContact CG2-CD1 3.74Å; I36-I276 HydrophobicContact CD1-CD1 3.55Å; I36-I276 HydrophobicContact CD1-CG1 3.73Å; I36-I276 HydrophobicContact CG1-CD1 3.65Å; I36-I276 HydrophobicContact CG1-CG1 4.15Å; I36-I276 HydrophobicContact CG2-CD1 4.21Å; I36-I276 HydrophobicContact CG2-CG1 4.03Å; I36-I276 HydrophobicContact CG2-CG2 4.48Å; I212-I276 HydrophobicContact CG2-CG1 4.43Å; T272-I276 HydrophobicContact CG2-CD1 4.07Å; T272-I276 HydrophobicContact CG2-CG1 4.4Å; T272-I276 WeakPolarHBondContact O-CG1 3.34Å; T272-I276 PolarHBondContact O-N 3.47Å; E273-I276 PolarHBondContact O-N 3.35Å; I276-Q278 VanDerWaalsContact C-N 3.28Å; I276-Q278 PolarHBondContact O-N 2.84Å; I276-W279 PolarHBondContact O-N 2.86Å; I276-N280 WeakPolarHBondContact O-CB 3.35Å; I276-N280 PolarHBondContact O-N 3.47Å
277G92Very high86.8Confident32 Ų3273.5 Ų73.533%0.3337%0.374SS..Hα-helixtrans-58.2-4017500000112.7E273 K274 Q275 K281E273-G277 PolarHBondContact O-N 3.35Å; K274-G277 PolarHBondContact O-N 3.39Å; Q275-G277 VanDerWaalsContact C-N 3.33Å; G277-K281 WeakPolarHBondContact O-CG 3.27Å; G277-K281 PolarHBondContact O-N 3.42Å
278Q91.7Very high86.4Confident131 Ų13174.8 Ų74.861%0.61238%0.38SS*.Hα-helixtrans-69.4-44174-67.7173.7-9.500111.9K274 Q275 I276 N280 K281 V282K274-Q278 PolarHBondContact O-N 2.96Å; K274-Q278 VanDerWaalsContact O-N 3.13Å; Q275-Q278 PolarHBondContact O-N 2.68Å; I276-Q278 VanDerWaalsContact C-N 3.28Å; I276-Q278 PolarHBondContact O-N 2.84Å; Q278-N280 PolarHBondContact O-N 3.15Å; Q278-K281 WeakPolarHBondContact O-CB 3.41Å; Q278-K281 PolarHBondContact O-N 2.75Å; Q278-K281 VanDerWaalsContact O-N 3.16Å; Q278-V282 WeakPolarHBondContact O-CG2 3.4Å; Q278-V282 PolarHBondContact O-N 3.39Å
279W91.9Very high85.9Confident23 Ų2378.6 Ų78.69%0.08740%0.4CS..Hα-helixtrans-60.5-43.2177.8179.989000111.9I36 K205 K209 I212 Q275 I276 K281 V282 Y283I36-W279 HydrophobicContact CG2-CE3 4.4Å; I36-W279 HydrophobicContact CG2-CZ3 4.34Å; K205-W279 HydrophobicContact CD-CH2 4.4Å; K205-W279 HydrophobicContact CD-CZ2 3.98Å; K205-W279 VanDerWaalsContact CE-CZ2 3.43Å; K205-W279 HydrophobicContact CG-CH2 4.25Å; K205-W279 HydrophobicContact CG-CZ2 3.36Å; K205-W279 PolarHBondContact O-NE1 3.2Å; K209-W279 HydrophobicContact CB-CZ2 4.39Å; I212-W279 HydrophobicContact CD1-CB 3.87Å; I212-W279 HydrophobicContact CD1-CG 4.11Å; Q275-W279 WeakPolarHBondContact O-CB 3.01Å; Q275-W279 PolarHBondContact O-N 3.23Å; I276-W279 PolarHBondContact O-N 2.86Å; W279-K281 VanDerWaalsContact C-N 3.33Å; W279-K281 PolarHBondContact O-N 3.05Å; W279-V282 PolarHBondContact O-N 3.21Å; W279-Y283 AromaticContact CD1-CD2 3.41Å; W279-Y283 VanDerWaalsContact CD1-CD2 3.41Å; W279-Y283 AromaticContact CD1-CE2 3.78Å; W279-Y283 HydrophobicContact CD2-CD2 4.38Å; W279-Y283 AromaticContact CG-CD2 3.93Å; W279-Y283 HydrophobicContact CG-CD2 3.93Å; W279-Y283 AromaticContact NE1-CD2 3.58Å; W279-Y283 WeakPolarHBondContact O-CB 3.4Å; W279-Y283 WeakPolarHBondContact O-CD2 3.44Å; W279-Y283 PolarHBondContact O-N 3.03Å
280N90.5Very high85.3Confident74 Ų7483 Ų8340%0.39642%0.422SS..Hα-helixtrans-62.7-36.7174.7-76.8-13.7000112.3I276 Q278 V282 G284I276-N280 WeakPolarHBondContact O-CB 3.35Å; I276-N280 PolarHBondContact O-N 3.47Å; Q278-N280 PolarHBondContact O-N 3.15Å; N280-V282 VanDerWaalsContact C-N 3.29Å; N280-V282 PolarHBondContact O-N 2.89Å; N280-G284 WeakPolarHBondContact O-CA 3.33Å; N280-G284 PolarHBondContact O-N 2.71Å
281K91.1Very high84.7Confident188 Ų18886.5 Ų86.582%0.81744%0.438SS*.Hα-helixtrans-65.1-34.1176.7-75.1176.4-179.6-171.30112.6G277 Q278 W279G277-K281 WeakPolarHBondContact O-CG 3.27Å; G277-K281 PolarHBondContact O-N 3.42Å; Q278-K281 WeakPolarHBondContact O-CB 3.41Å; Q278-K281 PolarHBondContact O-N 2.75Å; Q278-K281 VanDerWaalsContact O-N 3.16Å; W279-K281 VanDerWaalsContact C-N 3.33Å; W279-K281 PolarHBondContact O-N 3.05Å
282V90.2Very high84.2Confident100 Ų10083.1 Ų83.161%0.60643%0.43SS*.Hα-helixtrans-86.4-38.8-178.1179.40000111.9Q278 W279 N280Q278-V282 WeakPolarHBondContact O-CG2 3.4Å; Q278-V282 PolarHBondContact O-N 3.39Å; W279-V282 PolarHBondContact O-N 3.21Å; N280-V282 VanDerWaalsContact C-N 3.29Å; N280-V282 PolarHBondContact O-N 2.89Å
283Y87.2Confident83.4Confident40 Ų4088.5 Ų88.516%0.15746%0.458CS..Hα-helixtrans-119.81.4-169.1-56.8-71.6000114.4K205 K208 W279 N285 T286K205-Y283 HydrophobicContact CB-CD1 3.77Å; K205-Y283 HydrophobicContact CB-CE1 4.27Å; K205-Y283 HydrophobicContact CB-CG 3.98Å; K205-Y283 HydrophobicContact CG-CD1 4.31Å; K205-Y283 HydrophobicContact CG-CG 4.02Å; K208-Y283 HydrophobicContact CB-CE2 4.1Å; K208-Y283 HydrophobicContact CG-CE2 4.05Å; W279-Y283 AromaticContact CD1-CD2 3.41Å; W279-Y283 VanDerWaalsContact CD1-CD2 3.41Å; W279-Y283 AromaticContact CD1-CE2 3.78Å; W279-Y283 HydrophobicContact CD2-CD2 4.38Å; W279-Y283 AromaticContact CG-CD2 3.93Å; W279-Y283 HydrophobicContact CG-CD2 3.93Å; W279-Y283 AromaticContact NE1-CD2 3.58Å; W279-Y283 WeakPolarHBondContact O-CB 3.4Å; W279-Y283 WeakPolarHBondContact O-CD2 3.44Å; W279-Y283 PolarHBondContact O-N 3.03Å; Y283-N285 VanDerWaalsContact C-N 3.28Å; Y283-N285 PolarHBondContact O-N 3.48Å; Y283-T286 PolarHBondContact O-N 2.88Å; Y283-T286 PolarHBondContact O-OG1 2.9Å
284G75.5Confident82.7Confident38 Ų3891.9 Ų91.939%0.39248%0.477SS..THydrogen-bonded Turntrans-65.8-27.5-176.100000114.1N280N280-G284 WeakPolarHBondContact O-CA 3.33Å; N280-G284 PolarHBondContact O-N 2.71Å
285N66.7Low81.9Confident166 Ų16688.5 Ų88.589%0.88847%0.468SS*.THydrogen-bonded Turntrans-93.512.4178.9-63-7.3000113.1Y283Y283-N285 VanDerWaalsContact C-N 3.28Å; Y283-N285 PolarHBondContact O-N 3.48Å
286T57.1Low80.9Confident88 Ų8892.8 Ų92.854%0.5449%0.493SS..  trans-107.139.3-177.550.80000113.3Y283Y283-T286 PolarHBondContact O-N 2.88Å; Y283-T286 PolarHBondContact O-OG1 2.9Å
287E45.8Very low80Confident227 Ų227100.6 Ų100.6100%1.06154%0.535SS*.  trans-116.20167.6-86.1167.7-151.400109.7K205K205-E287 IonicContact NZ-OE1 3.19Å; K205-E287 PolarHBondContact NZ-OE1 3.4Å

Retrieved 287 of 287 residues in 381.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).