A0A077Z0Y7_TRITR Loading...

Potassium channels protein 7, TWiK family

AlphaFold DB , UniProt , Accession A0A077Z0Y7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 410 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
1M59.6Low68.9Low185 Ų185130 Ų13091%0.91161%0.612SS**  0-51.30-157.4167.779.900112.7I3 Y4 L5M1-I3 PolarHBondContact O-N 2.83Å; M1-Y4 PolarHBondContact O-N 2.88Å; M1-L5 HydrophobicContact CG-CD1 4.21Å; M1-L5 PolarHBondContact O-N 3.37Å; M1-L5 VanDerWaalsContact O-N 3.1Å
2Q65.9Low69.6Low161 Ų161128.5 Ų128.575%0.75261%0.61SS**Hα-helixtrans-58.4-40.2-177.9-72.7177.9-2300115.1Y4 L5 Q6Q2-Y4 PolarHBondContact O-N 3.32Å; Q2-L5 PolarHBondContact O-N 3.08Å; Q2-Q6 PolarHBondContact O-N 3.23Å
3I69.5Low70.3Confident118 Ų118124.2 Ų124.261%0.60560%0.602SS**Hα-helixtrans-63.6-40.1177.6-63.3168.2000111.8M1 Q6 K7M1-I3 PolarHBondContact O-N 2.83Å; I3-Q6 PolarHBondContact O-N 2.98Å; I3-K7 PolarHBondContact O-N 3.39Å; I3-K7 VanDerWaalsContact O-N 3.12Å
4Y67.5Low71.1Confident175 Ų175117 Ų11769%0.68657%0.567SS**Hα-helixtrans-68.3-40.8177.4-77.4-82.5000111.4M1 Q2 Q6 K7 I8M1-Y4 PolarHBondContact O-N 2.88Å; Q2-Y4 PolarHBondContact O-N 3.32Å; Y4-Q6 PolarHBondContact O-N 2.8Å; Y4-K7 PolarHBondContact O-N 2.84Å; Y4-I8 WeakPolarHBondContact O-CB 3.19Å; Y4-I8 VanDerWaalsContact O-CG1 3.25Å; Y4-I8 WeakPolarHBondContact O-CG1 3.49Å; Y4-I8 PolarHBondContact O-N 2.8Å
5L70.7Confident72Confident97 Ų97113.8 Ų113.851%0.50856%0.557SS.*Hα-helixtrans-63.9-38.1176.1-71171.5000112.5M1 Q2 I8 K9M1-L5 HydrophobicContact CG-CD1 4.21Å; M1-L5 PolarHBondContact O-N 3.37Å; M1-L5 VanDerWaalsContact O-N 3.1Å; Q2-L5 PolarHBondContact O-N 3.08Å; L5-I8 PolarHBondContact O-N 2.7Å; L5-K9 WeakPolarHBondContact O-CB 3.36Å; L5-K9 PolarHBondContact O-N 2.98Å
6Q68Low73Confident130 Ų130108.3 Ų108.361%0.60754%0.538SS*.Hα-helixtrans-64.1-45.5174.1-78.3177.9-22.600112Q2 I3 Y4 I8 K9 I10Q2-Q6 PolarHBondContact O-N 3.23Å; I3-Q6 PolarHBondContact O-N 2.98Å; Y4-Q6 PolarHBondContact O-N 2.8Å; Q6-I8 VanDerWaalsContact C-N 3.35Å; Q6-I8 PolarHBondContact O-N 3.38Å; Q6-K9 PolarHBondContact O-N 3.48Å; Q6-I10 WeakPolarHBondContact O-CG1 3.49Å; Q6-I10 PolarHBondContact O-N 3.43Å; Q6-I10 VanDerWaalsContact O-N 3.08Å
7K66.7Low74Confident134 Ų134104 Ų10458%0.58352%0.517SS*.Hα-helixtrans-61.8-41.6175.1-73-172.4174.7-167.30112.3I3 Y4 I10 I11I3-K7 PolarHBondContact O-N 3.39Å; I3-K7 VanDerWaalsContact O-N 3.12Å; Y4-K7 PolarHBondContact O-N 2.84Å; K7-I10 PolarHBondContact O-N 3.39Å; K7-I11 VanDerWaalsContact O-CG1 3.3Å; K7-I11 WeakPolarHBondContact O-CG1 3.39Å; K7-I11 PolarHBondContact O-N 3.01Å
8I72.5Confident74.9Confident100 Ų100100.8 Ų100.851%0.51351%0.505SS..Hα-helixtrans-61.8-43.7175.5-70.6165.5000110.6Y4 L5 Q6 I10 I11 L12Y4-I8 WeakPolarHBondContact O-CB 3.19Å; Y4-I8 VanDerWaalsContact O-CG1 3.25Å; Y4-I8 WeakPolarHBondContact O-CG1 3.49Å; Y4-I8 PolarHBondContact O-N 2.8Å; L5-I8 PolarHBondContact O-N 2.7Å; Q6-I8 VanDerWaalsContact C-N 3.35Å; Q6-I8 PolarHBondContact O-N 3.38Å; I8-I10 VanDerWaalsContact C-N 3.32Å; I8-I10 PolarHBondContact O-N 3.4Å; I8-I11 PolarHBondContact O-N 3.04Å; I8-L12 WeakPolarHBondContact O-CB 3.48Å; I8-L12 PolarHBondContact O-N 3.04Å
9K73.1Confident75.8Confident162 Ų162100.9 Ų100.970%0.70451%0.506SS*.Hα-helixtrans-63.1-37.4179.2-170.3178.3179.3-178.20112.6L5 Q6 S13L5-K9 WeakPolarHBondContact O-CB 3.36Å; L5-K9 PolarHBondContact O-N 2.98Å; Q6-K9 PolarHBondContact O-N 3.48Å; K9-S13 PolarHBondContact O-N 3.3Å
10I70.5Confident76.7Confident95 Ų95100.7 Ų100.749%0.48751%0.506SS..Hα-helixtrans-67.2-50.8175.6-65.2164.7000109.7Q6 K7 I8 L12 S13 H14Q6-I10 WeakPolarHBondContact O-CG1 3.49Å; Q6-I10 PolarHBondContact O-N 3.43Å; Q6-I10 VanDerWaalsContact O-N 3.08Å; K7-I10 PolarHBondContact O-N 3.39Å; I8-I10 VanDerWaalsContact C-N 3.32Å; I8-I10 PolarHBondContact O-N 3.4Å; I10-L12 PolarHBondContact O-N 3.45Å; I10-S13 PolarHBondContact O-N 3.39Å; I10-S13 PolarHBondContact O-OG 2.81Å; I10-H14 PolarHBondContact O-CD2 3.39Å
11I74.5Confident77.6Confident73 Ų7396.1 Ų96.137%0.37448%0.483SS..Hα-helixtrans-58.8-37.9176.8-65.6166.2000111.1K7 I8 S13 H14 V15 F164K7-I11 VanDerWaalsContact O-CG1 3.3Å; K7-I11 WeakPolarHBondContact O-CG1 3.39Å; K7-I11 PolarHBondContact O-N 3.01Å; I8-I11 PolarHBondContact O-N 3.04Å; I11-S13 VanDerWaalsContact C-N 3.34Å; I11-S13 PolarHBondContact O-N 3.41Å; I11-H14 PolarHBondContact O-N 3.4Å; I11-V15 HydrophobicContact CG2-CG2 3.95Å; I11-V15 WeakPolarHBondContact O-CG2 3.31Å; I11-V15 PolarHBondContact O-N 3.17Å; I11-F164 HydrophobicContact CG1-CE2 3.97Å; I11-F164 HydrophobicContact CG1-CZ 4.38Å
12L76.5Confident79.2Confident112 Ų11290.4 Ų90.459%0.58646%0.46SS*.Hα-helixtrans-63.9-34.9-178.5-172.966.7000112.7I8 I10 G16I8-L12 WeakPolarHBondContact O-CB 3.48Å; I8-L12 PolarHBondContact O-N 3.04Å; I10-L12 PolarHBondContact O-N 3.45Å; L12-G16 PolarHBondContact O-N 2.63Å
13S79.1Confident80.6Confident72 Ų7288.6 Ų88.650%0.50346%0.455SS..Hα-helixtrans-69.1-37.7176.266.70000111.6K9 I10 I11 L17K9-S13 PolarHBondContact O-N 3.3Å; I10-S13 PolarHBondContact O-N 3.39Å; I10-S13 PolarHBondContact O-OG 2.81Å; I11-S13 VanDerWaalsContact C-N 3.34Å; I11-S13 PolarHBondContact O-N 3.41Å; S13-L17 PolarHBondContact O-N 2.72Å; S13-L17 VanDerWaalsContact O-N 3.16Å
14H80.9Confident81.9Confident24 Ų2485.1 Ų85.111%0.11144%0.435CS..Hα-helixtrans-65.9-49.1174.6-57.9-68.6000111.4I10 I11 G16 L17 V18 N160I10-H14 PolarHBondContact O-CD2 3.39Å; I11-H14 PolarHBondContact O-N 3.4Å; H14-G16 VanDerWaalsContact C-N 3.34Å; H14-G16 PolarHBondContact O-N 2.97Å; H14-L17 PolarHBondContact O-N 3.5Å; H14-V18 WeakPolarHBondContact O-CG2 3.47Å; H14-V18 PolarHBondContact O-N 3.24Å; H14-V18 VanDerWaalsContact O-N 3.12Å; H14-N160 PolarHBondContact CE1-OD1 3.43Å; H14-N160 PolarHBondContact ND1-ND2 3.07Å; H14-N160 PolarHBondContact ND1-OD1 3.2Å
15V84.9Confident83.3Confident69 Ų6977.3 Ų77.342%0.41841%0.405SS..Hα-helixtrans-63.8-40.6179.1174.40000111I11 L17 V18 L19I11-V15 HydrophobicContact CG2-CG2 3.95Å; I11-V15 WeakPolarHBondContact O-CG2 3.31Å; I11-V15 PolarHBondContact O-N 3.17Å; V15-L17 VanDerWaalsContact C-N 3.34Å; V15-L17 PolarHBondContact O-N 3.27Å; V15-V18 PolarHBondContact O-N 2.81Å; V15-L19 HydrophobicContact CG1-CD1 3.96Å; V15-L19 HydrophobicContact CG1-CG 4.26Å; V15-L19 WeakPolarHBondContact O-CB 3.21Å; V15-L19 VanDerWaalsContact O-CG 3.31Å; V15-L19 WeakPolarHBondContact O-CG 3.42Å; V15-L19 PolarHBondContact O-N 3.23Å
16G87.6Confident84.5Confident25 Ų2574.9 Ų74.926%0.25839%0.394SS..Hα-helixtrans-59.3-43.8176.800000112.4L12 H14 L19 I20L12-G16 PolarHBondContact O-N 2.63Å; H14-G16 VanDerWaalsContact C-N 3.34Å; H14-G16 PolarHBondContact O-N 2.97Å; G16-L19 PolarHBondContact O-N 2.67Å; G16-I20 VanDerWaalsContact O-CG1 3.26Å; G16-I20 WeakPolarHBondContact O-CG1 3Å; G16-I20 PolarHBondContact O-N 2.72Å
17L90.5Very high85.9Confident36 Ų3674.3 Ų74.319%0.18839%0.39CS..Hα-helixtrans-66.3-39.9178.1-171.569.4000112.4S13 H14 V15 I20 S21 L153 I156 T157 N160S13-L17 PolarHBondContact O-N 2.72Å; S13-L17 VanDerWaalsContact O-N 3.16Å; H14-L17 PolarHBondContact O-N 3.5Å; V15-L17 VanDerWaalsContact C-N 3.34Å; V15-L17 PolarHBondContact O-N 3.27Å; L17-I20 PolarHBondContact O-N 2.76Å; L17-S21 WeakPolarHBondContact O-CB 3.4Å; L17-S21 PolarHBondContact O-N 3.45Å; L17-S21 PolarHBondContact O-OG 2.98Å; L17-L153 HydrophobicContact CD1-CD1 4.25Å; L17-I156 HydrophobicContact CD2-CG2 4.13Å; L17-T157 HydrophobicContact CD2-CG2 4.49Å; L17-T157 HydrophobicContact CG-CG2 4.31Å; L17-T157 WeakPolarHBondContact CG-OG1 3.39Å; L17-N160 HydrophobicContact CD2-CB 4.19Å
18V91Very high87.3Confident47 Ų4768 Ų6829%0.28536%0.362SS..Hα-helixtrans-63-44.2173.6174.10000110.8H14 V15 S21 C22 T157 S161H14-V18 WeakPolarHBondContact O-CG2 3.47Å; H14-V18 PolarHBondContact O-N 3.24Å; H14-V18 VanDerWaalsContact O-N 3.12Å; V15-V18 PolarHBondContact O-N 2.81Å; V18-S21 WeakPolarHBondContact O-CB 3Å; V18-S21 PolarHBondContact O-N 2.85Å; V18-C22 PolarHBondContact O-N 2.94Å; V18-C22 PolarHBondContact O-SG 3.35Å; V18-T157 HydrophobicContact CB-CG2 4.46Å; V18-T157 HydrophobicContact CG2-CG2 3.82Å; V18-S161 WeakPolarHBondContact CG2-OG 3.3Å
19L92.1Very high88.4Confident102 Ų10263.2 Ų63.253%0.53434%0.338SS..Hα-helixtrans-62.7-44.3177.4-72.8173.1000112.2V15 G16 S21 C22 L23V15-L19 HydrophobicContact CG1-CD1 3.96Å; V15-L19 HydrophobicContact CG1-CG 4.26Å; V15-L19 WeakPolarHBondContact O-CB 3.21Å; V15-L19 VanDerWaalsContact O-CG 3.31Å; V15-L19 WeakPolarHBondContact O-CG 3.42Å; V15-L19 PolarHBondContact O-N 3.23Å; G16-L19 PolarHBondContact O-N 2.67Å; L19-S21 VanDerWaalsContact C-N 3.27Å; L19-S21 PolarHBondContact O-N 3.45Å; L19-C22 PolarHBondContact O-N 2.77Å; L19-L23 WeakPolarHBondContact O-CG 3.29Å; L19-L23 PolarHBondContact O-N 3.44Å
20I93.6Very high89.5Confident97 Ų9759.4 Ų59.450%0.49732%0.323SS..Hα-helixtrans-58.8-43.3174.9-70164.8000110.2G16 L17 L23 Y24G16-I20 VanDerWaalsContact O-CG1 3.26Å; G16-I20 WeakPolarHBondContact O-CG1 3Å; G16-I20 PolarHBondContact O-N 2.72Å; L17-I20 PolarHBondContact O-N 2.76Å; I20-L23 PolarHBondContact O-N 3.43Å; I20-Y24 WeakPolarHBondContact O-CB 3.48Å; I20-Y24 PolarHBondContact O-N 2.9Å
21S94.1Very high90.7Very high4 Ų457.3 Ų57.33%0.02831%0.313CS..Hα-helixtrans-64.1-43.1178.1-60.20000112.2L17 V18 L19 Y24 I25 T157L17-S21 WeakPolarHBondContact O-CB 3.4Å; L17-S21 PolarHBondContact O-N 3.45Å; L17-S21 PolarHBondContact O-OG 2.98Å; V18-S21 WeakPolarHBondContact O-CB 3Å; V18-S21 PolarHBondContact O-N 2.85Å; L19-S21 VanDerWaalsContact C-N 3.27Å; L19-S21 PolarHBondContact O-N 3.45Å; S21-Y24 WeakPolarHBondContact O-CB 3.24Å; S21-Y24 PolarHBondContact O-N 3.27Å; S21-I25 WeakPolarHBondContact O-CG1 3.45Å; S21-I25 PolarHBondContact O-N 3.18Å; S21-T157 PolarHBondContact OG-OG1 3.19Å
22C94.2Very high91.8Very high65 Ų6553.9 Ų53.944%0.43930%0.295SS..Hα-helixtrans-62.4-44.7175.2-70.80000111.9V18 L19 Y24 I25 V26V18-C22 PolarHBondContact O-N 2.94Å; V18-C22 PolarHBondContact O-SG 3.35Å; L19-C22 PolarHBondContact O-N 2.77Å; C22-Y24 VanDerWaalsContact C-N 3.3Å; C22-Y24 PolarHBondContact O-N 3.02Å; C22-I25 PolarHBondContact O-N 3.41Å; C22-V26 WeakPolarHBondContact O-CG2 3.44Å; C22-V26 PolarHBondContact O-N 2.95Å
23L95.7Very high92.7Very high123 Ų12351.1 Ų51.164%0.64428%0.277SS*.Hα-helixtrans-62.6-39.8175.9-70.8173.7000111.5L19 I20 V26 F27L19-L23 WeakPolarHBondContact O-CG 3.29Å; L19-L23 PolarHBondContact O-N 3.44Å; I20-L23 PolarHBondContact O-N 3.43Å; L23-V26 PolarHBondContact O-N 3.46Å; L23-F27 WeakPolarHBondContact O-CB 3.27Å; L23-F27 PolarHBondContact O-N 3.25Å
24Y96.2Very high93.5Very high45 Ų4553.9 Ų53.918%0.17628%0.282CS..Hα-helixtrans-61.6-46.6176.4-169.8-97.7000111.6I20 S21 C22 F27 G28 L124 Y146 G150 L153I20-Y24 WeakPolarHBondContact O-CB 3.48Å; I20-Y24 PolarHBondContact O-N 2.9Å; S21-Y24 WeakPolarHBondContact O-CB 3.24Å; S21-Y24 PolarHBondContact O-N 3.27Å; C22-Y24 VanDerWaalsContact C-N 3.3Å; C22-Y24 PolarHBondContact O-N 3.02Å; Y24-F27 PolarHBondContact O-N 3.5Å; Y24-G28 PolarHBondContact O-N 3.01Å; Y24-L124 HydrophobicContact CD1-CD1 3.74Å; Y24-L124 HydrophobicContact CE1-CD1 3.88Å; Y24-L124 HydrophobicContact CE1-CD2 4.46Å; Y24-Y146 VanDerWaalsContact C-OH 3.32Å; Y24-Y146 AromaticContact CD1-CE2 3.9Å; Y24-Y146 HydrophobicContact CD1-CE2 3.9Å; Y24-Y146 AromaticContact CD1-CZ 3.65Å; Y24-Y146 VanDerWaalsContact CD1-OH 3.23Å; Y24-Y146 WeakPolarHBondContact CD1-OH 3.08Å; Y24-Y146 HydrophobicContact CD2-CE2 4.41Å; Y24-Y146 AromaticContact CE1-CD2 3.95Å; Y24-Y146 HydrophobicContact CE1-CD2 3.95Å; Y24-Y146 AromaticContact CE1-CE1 3.89Å; Y24-Y146 HydrophobicContact CE1-CE1 3.89Å; Y24-Y146 AromaticContact CE1-CE2 3.26Å; Y24-Y146 HydrophobicContact CE1-CE2 3.26Å; Y24-Y146 AromaticContact CE1-CZ 3.21Å; Y24-Y146 WeakPolarHBondContact CE1-OH 3.26Å; Y24-Y146 HydrophobicContact CE2-CD2 4.38Å; Y24-Y146 AromaticContact CE2-CE2 3.86Å; Y24-Y146 HydrophobicContact CE2-CE2 3.86Å; Y24-Y146 HydrophobicContact CG-CE2 4.43Å; Y24-Y146 AromaticContact CZ-CD2 3.63Å; Y24-Y146 AromaticContact CZ-CE2 3.24Å; Y24-Y146 AromaticContact CZ-CZ 3.76Å; Y24-Y146 PolarHBondContact O-OH 2.9Å; Y24-Y146 VanDerWaalsContact OH-CD2 3.26Å; Y24-Y146 WeakPolarHBondContact OH-CD2 3.32Å; Y24-Y146 WeakPolarHBondContact OH-CE2 3.23Å; Y24-Y146 PolarHBondContact OH-O 3.12Å; Y24-G150 PolarHBondContact OH-N 2.85Å; Y24-L153 HydrophobicContact CD1-CD2 4.29Å; Y24-L153 HydrophobicContact CD2-CD2 4.33Å; Y24-L153 HydrophobicContact CG-CD2 4.04Å
25I96.5Very high94.2Very high12 Ų1254.5 Ų54.56%0.06229%0.287CS..Hα-helixtrans-58.3-49.9174.9-70.1163.5000110.4S21 C22 F27 G28 S29 I117 T120 A121 L124 I154S21-I25 WeakPolarHBondContact O-CG1 3.45Å; S21-I25 PolarHBondContact O-N 3.18Å; C22-I25 PolarHBondContact O-N 3.41Å; I25-F27 VanDerWaalsContact C-N 3.3Å; I25-F27 PolarHBondContact O-N 3.15Å; I25-G28 PolarHBondContact O-N 2.88Å; I25-S29 WeakPolarHBondContact O-CB 3.42Å; I25-S29 PolarHBondContact O-N 2.74Å; I25-S29 PolarHBondContact O-OG 2.92Å; I25-I117 HydrophobicContact CG2-CG2 4.31Å; I25-T120 HydrophobicContact CG2-CG2 4.26Å; I25-A121 HydrophobicContact CD1-CB 4.29Å; I25-A121 HydrophobicContact CG2-CB 4.2Å; I25-L124 HydrophobicContact CG1-CD1 3.91Å; I25-I154 HydrophobicContact CD1-CD1 4.27Å
26V96.8Very high94.7Very high46 Ų4651.2 Ų51.228%0.27927%0.267SS..Hα-helixtrans-59.2-42.8-179.7170.10000111.2C22 L23 S29 M30C22-V26 WeakPolarHBondContact O-CG2 3.44Å; C22-V26 PolarHBondContact O-N 2.95Å; L23-V26 PolarHBondContact O-N 3.46Å; V26-S29 WeakPolarHBondContact O-CB 3.31Å; V26-S29 PolarHBondContact O-N 3.48Å; V26-M30 HydrophobicContact CG1-CE 3.72Å; V26-M30 HydrophobicContact CG1-SD 4.38Å; V26-M30 WeakPolarHBondContact O-CG 3.41Å; V26-M30 PolarHBondContact O-N 2.79Å
27F96.6Very high94.9Very high118 Ų11852.1 Ų52.152%0.51827%0.265SS..Hα-helixtrans-60.6-49.2176.9176.3-100.5000112.6L23 Y24 I25 S29 M30 I31 Y146L23-F27 WeakPolarHBondContact O-CB 3.27Å; L23-F27 PolarHBondContact O-N 3.25Å; Y24-F27 PolarHBondContact O-N 3.5Å; I25-F27 VanDerWaalsContact C-N 3.3Å; I25-F27 PolarHBondContact O-N 3.15Å; F27-S29 VanDerWaalsContact C-N 3.3Å; F27-S29 PolarHBondContact O-N 3.32Å; F27-M30 PolarHBondContact O-N 3.28Å; F27-I31 HydrophobicContact CD1-CD1 4.12Å; F27-I31 HydrophobicContact CE1-CD1 3.51Å; F27-I31 HydrophobicContact CE2-CD1 4.17Å; F27-I31 HydrophobicContact CZ-CD1 3.55Å; F27-I31 PolarHBondContact O-N 3.47Å; F27-Y146 HydrophobicContact CD1-CE2 4.47Å
28G95.9Very high95.1Very high0 Ų054.1 Ų54.10%028%0.28CS..Hα-helixtrans-61.2-40.4176.100000112.2Y24 I25 M30 I31 F32Y24-G28 PolarHBondContact O-N 3.01Å; I25-G28 PolarHBondContact O-N 2.88Å; G28-M30 PolarHBondContact O-N 3.35Å; G28-I31 PolarHBondContact O-N 2.84Å; G28-F32 WeakPolarHBondContact O-CD2 3.33Å; G28-F32 PolarHBondContact O-N 3.3Å
29S96.4Very high95.2Very high0 Ų054.6 Ų54.60%028%0.279CS..Hα-helixtrans-63-40.4179.5-52.70000112.6I25 V26 F27 F32 Y33 A116 I117 T120I25-S29 WeakPolarHBondContact O-CB 3.42Å; I25-S29 PolarHBondContact O-N 2.74Å; I25-S29 PolarHBondContact O-OG 2.92Å; V26-S29 WeakPolarHBondContact O-CB 3.31Å; V26-S29 PolarHBondContact O-N 3.48Å; F27-S29 VanDerWaalsContact C-N 3.3Å; F27-S29 PolarHBondContact O-N 3.32Å; S29-F32 PolarHBondContact O-N 2.92Å; S29-Y33 VanDerWaalsContact O-CB 3.23Å; S29-Y33 WeakPolarHBondContact O-CB 3.25Å; S29-Y33 PolarHBondContact O-N 3.03Å; S29-A116 PolarHBondContact OG-O 3.22Å; S29-I117 VanDerWaalsContact OG-CA 3.23Å; S29-I117 WeakPolarHBondContact OG-CA 3.23Å; S29-T120 WeakPolarHBondContact CA-OG1 3.23Å; S29-T120 PolarHBondContact N-OG1 3.06Å; S29-T120 VanDerWaalsContact OG-CB 3.28Å; S29-T120 WeakPolarHBondContact OG-CB 3.35Å; S29-T120 PolarHBondContact OG-OG1 3.23Å; S29-T120 VanDerWaalsContact OG-OG1 3.07Å
30M96.6Very high95.2Very high82 Ų8249.8 Ų49.840%0.40425%0.254SS..Hα-helixtrans-60.8-45174.6-74.8177.8177.800111.1V26 F27 G28 Y33 H34 Y113V26-M30 HydrophobicContact CG1-CE 3.72Å; V26-M30 HydrophobicContact CG1-SD 4.38Å; V26-M30 WeakPolarHBondContact O-CG 3.41Å; V26-M30 PolarHBondContact O-N 2.79Å; F27-M30 PolarHBondContact O-N 3.28Å; G28-M30 PolarHBondContact O-N 3.35Å; M30-Y33 PolarHBondContact O-N 3.45Å; M30-H34 WeakPolarHBondContact O-CB 3.27Å; M30-H34 PolarHBondContact O-CD2 2.85Å; M30-H34 PolarHBondContact O-N 3.07Å; M30-Y113 HydrophobicContact CE-CE2 4.32Å; M30-Y113 HydrophobicContact CG-CE2 3.92Å
31I96Very high95.1Very high51 Ų5147.7 Ų47.726%0.26224%0.243SC..Hα-helixtrans-64.3-48.9178.7-65.6171.6000110.8F27 G28 Y33 H34 V35 F142F27-I31 HydrophobicContact CD1-CD1 4.12Å; F27-I31 HydrophobicContact CE1-CD1 3.51Å; F27-I31 HydrophobicContact CE2-CD1 4.17Å; F27-I31 HydrophobicContact CZ-CD1 3.55Å; F27-I31 PolarHBondContact O-N 3.47Å; G28-I31 PolarHBondContact O-N 2.84Å; I31-Y33 PolarHBondContact O-N 2.68Å; I31-H34 PolarHBondContact O-N 2.81Å; I31-V35 WeakPolarHBondContact O-CG2 3.24Å; I31-V35 PolarHBondContact O-N 3.28Å; I31-F142 HydrophobicContact CB-CE1 4.14Å; I31-F142 HydrophobicContact CB-CZ 4.09Å; I31-F142 HydrophobicContact CD1-CE1 4.46Å; I31-F142 HydrophobicContact CD1-CE2 3.7Å; I31-F142 HydrophobicContact CD1-CZ 3.57Å; I31-F142 HydrophobicContact CG1-CZ 4.42Å; I31-F142 HydrophobicContact CG2-CD1 4.04Å; I31-F142 HydrophobicContact CG2-CD2 4.32Å; I31-F142 HydrophobicContact CG2-CE1 3.88Å; I31-F142 HydrophobicContact CG2-CE2 4.17Å; I31-F142 HydrophobicContact CG2-CG 4.27Å; I31-F142 HydrophobicContact CG2-CZ 3.95Å
32F96.4Very high95.1Very high1 Ų154.9 Ų54.90%0.00427%0.274CS..Hα-helixtrans-59.2-47.1178-74.8-59.8000111.7G28 S29 H34 V35 E36 W111 F119 T120 P134 F142 Y146G28-F32 WeakPolarHBondContact O-CD2 3.33Å; G28-F32 PolarHBondContact O-N 3.3Å; S29-F32 PolarHBondContact O-N 2.92Å; F32-H34 PolarHBondContact O-N 2.66Å; F32-V35 PolarHBondContact O-N 2.98Å; F32-E36 VanDerWaalsContact O-CB 3.26Å; F32-E36 WeakPolarHBondContact O-CB 3.29Å; F32-E36 PolarHBondContact O-N 3.07Å; F32-W111 HydrophobicContact CB-CH2 4.47Å; F32-W111 HydrophobicContact CB-CZ3 4.04Å; F32-F119 HydrophobicContact CD1-CE1 4.15Å; F32-F119 HydrophobicContact CD2-CD1 4.17Å; F32-F119 AromaticContact CD2-CE1 3.89Å; F32-F119 HydrophobicContact CD2-CE1 3.89Å; F32-F119 HydrophobicContact CE1-CE1 4.13Å; F32-F119 HydrophobicContact CE2-CD1 4.49Å; F32-F119 AromaticContact CE2-CE1 3.87Å; F32-F119 HydrophobicContact CE2-CE1 3.87Å; F32-F119 HydrophobicContact CG-CD1 4.38Å; F32-F119 HydrophobicContact CG-CE1 4.05Å; F32-F119 AromaticContact CZ-CE1 4Å; F32-F119 HydrophobicContact CZ-CE1 4Å; F32-T120 WeakPolarHBondContact CD2-OG1 3.41Å; F32-T120 HydrophobicContact CE2-CG2 4.43Å; F32-P134 HydrophobicContact CE1-CB 4.49Å; F32-F142 HydrophobicContact CD1-CD1 4.31Å; F32-F142 HydrophobicContact CD2-CE1 4.29Å; F32-F142 AromaticContact CE1-CD1 3.68Å; F32-F142 HydrophobicContact CE1-CD1 3.68Å; F32-F142 HydrophobicContact CE1-CE1 4.17Å; F32-F142 HydrophobicContact CE2-CD1 4.14Å; F32-F142 AromaticContact CE2-CE1 3.79Å; F32-F142 HydrophobicContact CE2-CE1 3.79Å; F32-F142 AromaticContact CZ-CD1 3.58Å; F32-F142 HydrophobicContact CZ-CD1 3.58Å; F32-F142 AromaticContact CZ-CE1 3.72Å; F32-F142 HydrophobicContact CZ-CE1 3.72Å; F32-Y146 HydrophobicContact CE2-CD1 4.33Å; F32-Y146 HydrophobicContact CE2-CE1 4.46Å
33Y96Very high95Very high54 Ų5453.6 Ų53.621%0.21226%0.262CS..Hα-helixtrans-58.7-49.1177.5175.1-103.7000112.1S29 M30 I31 V35 Q37 W111S29-Y33 VanDerWaalsContact O-CB 3.23Å; S29-Y33 WeakPolarHBondContact O-CB 3.25Å; S29-Y33 PolarHBondContact O-N 3.03Å; M30-Y33 PolarHBondContact O-N 3.45Å; I31-Y33 PolarHBondContact O-N 2.68Å; Y33-V35 VanDerWaalsContact C-N 3.3Å; Y33-V35 PolarHBondContact O-N 2.78Å; Y33-Q37 HydrophobicContact CD2-CB 4.39Å; Y33-Q37 HydrophobicContact CE2-CB 4.29Å; Y33-Q37 HydrophobicContact CE2-CG 4.3Å; Y33-Q37 VanDerWaalsContact CZ-CD 3.46Å; Y33-Q37 WeakPolarHBondContact O-CB 3.35Å; Y33-Q37 PolarHBondContact O-N 3.27Å; Y33-Q37 VanDerWaalsContact OH-CD 3.32Å; Y33-Q37 PolarHBondContact OH-NE2 3.2Å; Y33-Q37 PolarHBondContact OH-OE1 3.23Å; Y33-W111 VanDerWaalsContact CE2-O 3.31Å; Y33-W111 WeakPolarHBondContact CE2-O 3.49Å
34H96Very high94.8Very high130 Ų13048.4 Ų48.460%0.60223%0.234SC*.Hα-helixtrans-64.5-32.2-178.1-82.2-59.5000113.6M30 I31 F32 P38M30-H34 WeakPolarHBondContact O-CB 3.27Å; M30-H34 PolarHBondContact O-CD2 2.85Å; M30-H34 PolarHBondContact O-N 3.07Å; I31-H34 PolarHBondContact O-N 2.81Å; F32-H34 PolarHBondContact O-N 2.66Å; H34-P38 VanDerWaalsContact O-CD 3.31Å; H34-P38 WeakPolarHBondContact O-CD 3.36Å; H34-P38 WeakPolarHBondContact O-CG 3.32Å
35V95.4Very high94.5Very high37 Ų3752.1 Ų52.122%0.22425%0.253CS..Hα-helixtrans-86.5-43.9-179.9176.40000111.8I31 F32 Y33 L138I31-V35 WeakPolarHBondContact O-CG2 3.24Å; I31-V35 PolarHBondContact O-N 3.28Å; F32-V35 PolarHBondContact O-N 2.98Å; Y33-V35 VanDerWaalsContact C-N 3.3Å; Y33-V35 PolarHBondContact O-N 2.78Å; V35-L138 HydrophobicContact CG1-CB 4.41Å; V35-L138 HydrophobicContact CG1-CD2 4.07Å; V35-L138 HydrophobicContact CG1-CG 4.47Å; V35-L138 HydrophobicContact CG2-CD2 4.11Å
36E94.4Very high94.4Very high0 Ų059 Ų590%028%0.279CS..Hα-helixtrans-83.3-33.6-172.3-72.8-66146.900113.6F32 H39 E40 Y95 W111 P134 M135 S136 S139F32-E36 VanDerWaalsContact O-CB 3.26Å; F32-E36 WeakPolarHBondContact O-CB 3.29Å; F32-E36 PolarHBondContact O-N 3.07Å; E36-H39 CarbonylContact O-C 3.57Å; E36-H39 WeakPolarHBondContact O-CB 2.95Å; E36-H39 PolarHBondContact O-N 3.24Å; E36-H39 VanDerWaalsContact O-N 3.14Å; E36-H39 IonicContact OE2-CD2 2.69Å; E36-E40 WeakPolarHBondContact O-CB 3.47Å; E36-E40 PolarHBondContact O-N 3.02Å; E36-Y95 PolarHBondContact OE2-OH 2.84Å; E36-W111 HydrophobicContact CB-CD2 3.68Å; E36-W111 HydrophobicContact CB-CE3 4.28Å; E36-W111 HydrophobicContact CB-CG 3.87Å; E36-W111 HydrophobicContact CB-CZ2 4.08Å; E36-W111 HydrophobicContact CG-CD2 4.34Å; E36-W111 HydrophobicContact CG-CH2 4.32Å; E36-W111 HydrophobicContact CG-CZ2 3.82Å; E36-P134 HydrophobicContact CG-CB 4.46Å; E36-M135 PolarHBondContact OE1-N 3.47Å; E36-M135 VanDerWaalsContact OE1-N 3.15Å; E36-M135 PolarHBondContact OE2-N 2.64Å; E36-S136 WeakPolarHBondContact OE1-CB 3.34Å; E36-S136 PolarHBondContact OE1-N 3.14Å; E36-S139 VanDerWaalsContact OE1-CB 3.22Å; E36-S139 WeakPolarHBondContact OE1-CB 3.4Å; E36-S139 PolarHBondContact OE1-OG 3.21Å
37Q93.3Very high94.1Very high45 Ų4557.2 Ų57.221%0.2127%0.267CS..Hα-helixtrans-58.3-50.2-179.7-173.4-174.740.300113.6Y33 H39 E40 I41 W111Y33-Q37 HydrophobicContact CD2-CB 4.39Å; Y33-Q37 HydrophobicContact CE2-CB 4.29Å; Y33-Q37 HydrophobicContact CE2-CG 4.3Å; Y33-Q37 VanDerWaalsContact CZ-CD 3.46Å; Y33-Q37 WeakPolarHBondContact O-CB 3.35Å; Y33-Q37 PolarHBondContact O-N 3.27Å; Y33-Q37 VanDerWaalsContact OH-CD 3.32Å; Y33-Q37 PolarHBondContact OH-NE2 3.2Å; Y33-Q37 PolarHBondContact OH-OE1 3.23Å; Q37-H39 VanDerWaalsContact C-N 3.26Å; Q37-H39 PolarHBondContact O-N 3.3Å; Q37-E40 PolarHBondContact O-N 3.05Å; Q37-I41 HydrophobicContact CG-CD1 4.43Å; Q37-I41 WeakPolarHBondContact O-CG1 3.36Å; Q37-I41 PolarHBondContact O-N 2.77Å; Q37-W111 HydrophobicContact CB-CB 4.45Å
38P93.7Very high93.9Very high77 Ų7753 Ų5350%0.525%0.25SC..Hα-helixtrans-66.4-30.5176.425.6-34.3000112.4H34 K42H34-P38 VanDerWaalsContact O-CD 3.31Å; H34-P38 WeakPolarHBondContact O-CD 3.36Å; H34-P38 WeakPolarHBondContact O-CG 3.32Å; P38-K42 PolarHBondContact O-N 3.46Å
39H92.9Very high93.7Very high58 Ų5855.8 Ų55.827%0.26927%0.273SS..Hα-helixtrans-69.4-41.8177-17266.3000112E36 Q37 K42 I43E36-H39 CarbonylContact O-C 3.57Å; E36-H39 WeakPolarHBondContact O-CB 2.95Å; E36-H39 PolarHBondContact O-N 3.24Å; E36-H39 VanDerWaalsContact O-N 3.14Å; E36-H39 IonicContact OE2-CD2 2.69Å; Q37-H39 VanDerWaalsContact C-N 3.26Å; Q37-H39 PolarHBondContact O-N 3.3Å; H39-K42 PolarHBondContact O-N 3.26Å; H39-I43 WeakPolarHBondContact NE2-CD1 3.44Å; H39-I43 PolarHBondContact O-N 2.96Å
40E92.9Very high93.5Very high0 Ų058.7 Ų58.70%028%0.284CS..Hα-helixtrans-54.7-54.8173.3173.6-171.916300110.2E36 Q37 K42 I43 R44 Y95 N109 V110 W111E36-E40 WeakPolarHBondContact O-CB 3.47Å; E36-E40 PolarHBondContact O-N 3.02Å; Q37-E40 PolarHBondContact O-N 3.05Å; E40-K42 VanDerWaalsContact C-N 3.28Å; E40-K42 PolarHBondContact O-N 3.06Å; E40-I43 PolarHBondContact O-N 2.67Å; E40-R44 WeakPolarHBondContact O-CB 3.4Å; E40-R44 PolarHBondContact O-N 3.22Å; E40-R44 IonicContact OE1-NH1 3.07Å; E40-R44 PolarHBondContact OE1-NH1 3.06Å; E40-R44 VanDerWaalsContact OE1-NH1 3.07Å; E40-Y95 HydrophobicContact CB-CD1 4.32Å; E40-Y95 HydrophobicContact CB-CD2 4.18Å; E40-Y95 HydrophobicContact CB-CE1 4.3Å; E40-Y95 HydrophobicContact CB-CE2 4.13Å; E40-Y95 HydrophobicContact CB-CG 4.27Å; E40-Y95 HydrophobicContact CG-CD1 3.75Å; E40-Y95 HydrophobicContact CG-CD2 4.08Å; E40-Y95 HydrophobicContact CG-CE1 4.19Å; E40-Y95 HydrophobicContact CG-CE2 4.46Å; E40-Y95 HydrophobicContact CG-CG 3.69Å; E40-N109 WeakPolarHBondContact OE1-CA 3.36Å; E40-V110 PolarHBondContact OE1-N 3.23Å; E40-V110 PolarHBondContact OE2-N 2.75Å; E40-W111 VanDerWaalsContact OE2-CB 3.26Å; E40-W111 WeakPolarHBondContact OE2-CB 3.31Å; E40-W111 PolarHBondContact OE2-N 3.37Å
41I91.7Very high93.3Very high53 Ų5355.3 Ų55.327%0.27227%0.268SS..Hα-helixtrans-58.5-44.5-176.4-65167.7000110.1Q37 R44 Q45Q37-I41 HydrophobicContact CG-CD1 4.43Å; Q37-I41 WeakPolarHBondContact O-CG1 3.36Å; Q37-I41 PolarHBondContact O-N 2.77Å; I41-R44 PolarHBondContact O-N 2.84Å; I41-Q45 HydrophobicContact CG2-CG 4.35Å; I41-Q45 WeakPolarHBondContact O-CB 3.44Å; I41-Q45 VanDerWaalsContact O-CG 3.23Å; I41-Q45 WeakPolarHBondContact O-CG 3.43Å; I41-Q45 PolarHBondContact O-N 3.21Å
42K92.9Very high93.1Very high156 Ų15655.9 Ų55.968%0.67827%0.27SS*.Hα-helixtrans-63.6-47179.9-171.8177.1-178.1177.60112.7P38 H39 E40 W46P38-K42 PolarHBondContact O-N 3.46Å; H39-K42 PolarHBondContact O-N 3.26Å; E40-K42 VanDerWaalsContact C-N 3.28Å; E40-K42 PolarHBondContact O-N 3.06Å; K42-W46 WeakPolarHBondContact O-CB 3.49Å; K42-W46 PolarHBondContact O-N 3.21Å; K42-W46 VanDerWaalsContact O-N 3.13Å
43I92.4Very high92.9Very high37 Ų3761.6 Ų61.619%0.1930%0.297CS..Hα-helixtrans-66-44.7178.5-72.5177000110.7H39 E40 Q45 W46 N47 T93 Y95H39-I43 WeakPolarHBondContact NE2-CD1 3.44Å; H39-I43 PolarHBondContact O-N 2.96Å; E40-I43 PolarHBondContact O-N 2.67Å; I43-Q45 PolarHBondContact O-N 3.43Å; I43-W46 PolarHBondContact O-N 3.17Å; I43-N47 WeakPolarHBondContact CG2-ND2 3.27Å; I43-N47 WeakPolarHBondContact O-CB 3.16Å; I43-N47 PolarHBondContact O-N 3.01Å; I43-T93 HydrophobicContact CG2-CG2 3.99Å; I43-Y95 HydrophobicContact CB-CD2 4.11Å; I43-Y95 HydrophobicContact CD1-CE2 4.25Å; I43-Y95 HydrophobicContact CG2-CD2 3.98Å
44R91.2Very high92.8Very high14 Ų1462.3 Ų62.35%0.05330%0.301CS..Hα-helixtrans-58.7-49.5179-179.7175.769.7-160.29111.1E40 I41 W46 N47 I48 Y95 V96 H100 N109E40-R44 WeakPolarHBondContact O-CB 3.4Å; E40-R44 PolarHBondContact O-N 3.22Å; E40-R44 IonicContact OE1-NH1 3.07Å; E40-R44 PolarHBondContact OE1-NH1 3.06Å; E40-R44 VanDerWaalsContact OE1-NH1 3.07Å; I41-R44 PolarHBondContact O-N 2.84Å; R44-W46 PolarHBondContact O-N 3.28Å; R44-N47 PolarHBondContact O-N 3.44Å; R44-I48 HydrophobicContact CG-CD1 3.58Å; R44-I48 HydrophobicContact CG-CG1 4.41Å; R44-I48 WeakPolarHBondContact O-CB 3.29Å; R44-I48 WeakPolarHBondContact O-CD1 3.18Å; R44-I48 WeakPolarHBondContact O-CG1 3.26Å; R44-I48 PolarHBondContact O-N 3.48Å; R44-Y95 WeakPolarHBondContact CD-O 3.5Å; R44-V96 HydrophobicContact CG-CG2 4.4Å; R44-H100 VanDerWaalsContact CD-CE1 3.46Å; R44-H100 WeakPolarHBondContact CD-CE1 3.41Å; R44-N109 PolarHBondContact NH1-OD1 2.96Å; R44-N109 PolarHBondContact NH2-OD1 3.21Å
45Q91Very high92.6Very high123 Ų12361 Ų6158%0.57529%0.291SS*.Hα-helixtrans-60.2-44.7178-75.9174-13.200111.9I41 I43 A49I41-Q45 HydrophobicContact CG2-CG 4.35Å; I41-Q45 WeakPolarHBondContact O-CB 3.44Å; I41-Q45 VanDerWaalsContact O-CG 3.23Å; I41-Q45 WeakPolarHBondContact O-CG 3.43Å; I41-Q45 PolarHBondContact O-N 3.21Å; I43-Q45 PolarHBondContact O-N 3.43Å; Q45-A49 VanDerWaalsContact O-CB 3.28Å; Q45-A49 WeakPolarHBondContact O-CB 3.49Å; Q45-A49 PolarHBondContact O-N 3.46Å
46W92.8Very high92.4Very high158 Ų15862.6 Ų62.660%0.59830%0.298SS*.Hα-helixtrans-63.1-45.7178.3-177.682.3000112.4K42 I43 R44 A49 R50K42-W46 WeakPolarHBondContact O-CB 3.49Å; K42-W46 PolarHBondContact O-N 3.21Å; K42-W46 VanDerWaalsContact O-N 3.13Å; I43-W46 PolarHBondContact O-N 3.17Å; R44-W46 PolarHBondContact O-N 3.28Å; W46-A49 PolarHBondContact O-N 3.28Å; W46-R50 WeakPolarHBondContact O-CB 3.31Å; W46-R50 PolarHBondContact O-N 3.08Å
47N92.4Very high92.3Very high7 Ų766 Ų664%0.03732%0.319CS..Hα-helixtrans-64.8-43.8178-82.1-27.2000112.4I43 R44 R50 V51 A90 T93 V96I43-N47 WeakPolarHBondContact CG2-ND2 3.27Å; I43-N47 WeakPolarHBondContact O-CB 3.16Å; I43-N47 PolarHBondContact O-N 3.01Å; R44-N47 PolarHBondContact O-N 3.44Å; N47-R50 PolarHBondContact O-N 2.9Å; N47-V51 VanDerWaalsContact O-CG2 3.32Å; N47-V51 WeakPolarHBondContact O-CG2 3.16Å; N47-V51 PolarHBondContact O-N 2.77Å; N47-A90 HydrophobicContact CB-CB 3.87Å; N47-T93 VanDerWaalsContact ND2-CG2 3.26Å; N47-T93 WeakPolarHBondContact ND2-CG2 3.43Å; N47-T93 PolarHBondContact ND2-OG1 3.38Å; N47-V96 HydrophobicContact CB-CG2 4.03Å
48I90.4Very high92.2Very high30 Ų3064.8 Ų64.815%0.15431%0.314CS..Hα-helixtrans-63.4-46.5177.4-69.6167.2000110.3R44 R50 V51 I52 V96 H100R44-I48 HydrophobicContact CG-CD1 3.58Å; R44-I48 HydrophobicContact CG-CG1 4.41Å; R44-I48 WeakPolarHBondContact O-CB 3.29Å; R44-I48 WeakPolarHBondContact O-CD1 3.18Å; R44-I48 WeakPolarHBondContact O-CG1 3.26Å; R44-I48 PolarHBondContact O-N 3.48Å; I48-R50 VanDerWaalsContact C-N 3.32Å; I48-R50 PolarHBondContact O-N 3.22Å; I48-V51 PolarHBondContact O-N 2.65Å; I48-I52 HydrophobicContact CG2-CD1 3.61Å; I48-I52 HydrophobicContact CG2-CG1 4.29Å; I48-I52 WeakPolarHBondContact O-CB 3.34Å; I48-I52 WeakPolarHBondContact O-CG1 3.44Å; I48-I52 PolarHBondContact O-N 3.36Å; I48-V96 HydrophobicContact CG1-CG1 4.37Å; I48-V96 HydrophobicContact CG1-CG2 4.33Å; I48-H100 HydrophobicContact CD1-CB 3.66Å; I48-H100 HydrophobicContact CG1-CB 4.5Å
49A92.3Very high92.1Very high58 Ų5866.6 Ų66.648%0.47932%0.317SS..Hα-helixtrans-58.4-44.4177.700000111.5Q45 W46 V51 I52 E53Q45-A49 VanDerWaalsContact O-CB 3.28Å; Q45-A49 WeakPolarHBondContact O-CB 3.49Å; Q45-A49 PolarHBondContact O-N 3.46Å; W46-A49 PolarHBondContact O-N 3.28Å; A49-V51 PolarHBondContact O-N 2.83Å; A49-I52 PolarHBondContact O-N 3.45Å; A49-E53 WeakPolarHBondContact O-CB 3.15Å; A49-E53 PolarHBondContact O-N 2.91Å
50R92.6Very high91.9Very high62 Ų6270.9 Ų70.923%0.23434%0.337CS..Hα-helixtrans-61.9-42.5176.5-169.117681.6157.52.8112.7W46 N47 I48 K54 N89W46-R50 WeakPolarHBondContact O-CB 3.31Å; W46-R50 PolarHBondContact O-N 3.08Å; N47-R50 PolarHBondContact O-N 2.9Å; I48-R50 VanDerWaalsContact C-N 3.32Å; I48-R50 PolarHBondContact O-N 3.22Å; R50-K54 VanDerWaalsContact O-CG 3.32Å; R50-K54 WeakPolarHBondContact O-CG 3.32Å; R50-K54 PolarHBondContact O-N 3.39Å; R50-K54 VanDerWaalsContact O-N 3.12Å; R50-N89 VanDerWaalsContact NH2-CB 3.34Å
51V92.2Very high91.6Very high11 Ų1171.8 Ų71.87%0.06735%0.345CS..Hα-helixtrans-66-42.7177.7170.10000111N47 I48 A49 R55 L83 L87 A90 L101N47-V51 VanDerWaalsContact O-CG2 3.32Å; N47-V51 WeakPolarHBondContact O-CG2 3.16Å; N47-V51 PolarHBondContact O-N 2.77Å; I48-V51 PolarHBondContact O-N 2.65Å; A49-V51 PolarHBondContact O-N 2.83Å; V51-R55 VanDerWaalsContact O-CB 3.3Å; V51-R55 WeakPolarHBondContact O-CB 3.44Å; V51-R55 PolarHBondContact O-N 2.85Å; V51-L83 HydrophobicContact CG1-CD1 4.46Å; V51-L87 HydrophobicContact CG1-CD1 4Å; V51-A90 HydrophobicContact CG2-CB 3.96Å; V51-L101 HydrophobicContact CB-CD2 4.48Å; V51-L101 HydrophobicContact CG1-CD2 3.99Å
52I91.1Very high91.3Very high62 Ų6274.3 Ų74.332%0.31836%0.358SS..Hα-helixtrans-63.5-46.3177-69.6172.2000110.6I48 A49 K54 R55 D56I48-I52 HydrophobicContact CG2-CD1 3.61Å; I48-I52 HydrophobicContact CG2-CG1 4.29Å; I48-I52 WeakPolarHBondContact O-CB 3.34Å; I48-I52 WeakPolarHBondContact O-CG1 3.44Å; I48-I52 PolarHBondContact O-N 3.36Å; A49-I52 PolarHBondContact O-N 3.45Å; I52-K54 PolarHBondContact O-N 2.93Å; I52-R55 WeakPolarHBondContact O-CB 3.47Å; I52-R55 PolarHBondContact O-N 3.34Å; I52-D56 WeakPolarHBondContact CG2-OD2 3.34Å; I52-D56 WeakPolarHBondContact O-CB 3.25Å; I52-D56 PolarHBondContact O-N 3.05Å
53E93.5Very high91Very high122 Ų12277.6 Ų77.657%0.5737%0.366SS*.Hα-helixtrans-57.1-48.7178.1-179.4-173.3-175.500112.4A49 R55 D56 T57A49-E53 WeakPolarHBondContact O-CB 3.15Å; A49-E53 PolarHBondContact O-N 2.91Å; E53-R55 PolarHBondContact O-N 3.22Å; E53-D56 PolarHBondContact O-N 3.16Å; E53-T57 PolarHBondContact O-N 3.19Å; E53-T57 PolarHBondContact O-OG1 3.46Å
54K92.6Very high90.4Very high69 Ų6977.7 Ų77.730%0.337%0.37SS..Hα-helixtrans-65.1-39.3178.2-68-67.8-177.7174.70112.2R50 I52 L58 D82 L83R50-K54 VanDerWaalsContact O-CG 3.32Å; R50-K54 WeakPolarHBondContact O-CG 3.32Å; R50-K54 PolarHBondContact O-N 3.39Å; R50-K54 VanDerWaalsContact O-N 3.12Å; I52-K54 PolarHBondContact O-N 2.93Å; K54-L58 WeakPolarHBondContact O-CB 3.16Å; K54-L58 PolarHBondContact O-N 3.34Å; K54-D82 WeakPolarHBondContact CD-OD2 3.33Å; K54-D82 VanDerWaalsContact CE-OD2 3.24Å; K54-D82 WeakPolarHBondContact CE-OD2 3.38Å; K54-D82 IonicContact NZ-OD1 3.71Å; K54-D82 IonicContact NZ-OD2 2.67Å; K54-D82 PolarHBondContact NZ-OD2 3.43Å; K54-L83 HydrophobicContact CB-CD1 3.92Å
55R91.9Very high89.5Confident101 Ų10180.4 Ų80.438%0.38139%0.389SS..Hα-helixtrans-62.3-46.8175.2-178.9-159.869.4-174.7-0.2110.7V51 I52 E53 T57 L58 M59 L83V51-R55 VanDerWaalsContact O-CB 3.3Å; V51-R55 WeakPolarHBondContact O-CB 3.44Å; V51-R55 PolarHBondContact O-N 2.85Å; I52-R55 WeakPolarHBondContact O-CB 3.47Å; I52-R55 PolarHBondContact O-N 3.34Å; E53-R55 PolarHBondContact O-N 3.22Å; R55-T57 VanDerWaalsContact C-N 3.34Å; R55-L58 PolarHBondContact O-N 3.25Å; R55-M59 HydrophobicContact CG-CG 4.49Å; R55-M59 HydrophobicContact CG-SD 4.17Å; R55-M59 WeakPolarHBondContact O-CB 3.31Å; R55-M59 WeakPolarHBondContact O-CG 3.44Å; R55-M59 PolarHBondContact O-N 2.81Å; R55-L83 HydrophobicContact CB-CD1 4.18Å
56D92.6Very high88.4Confident71 Ų7180.5 Ų80.538%0.3840%0.401SS..Hα-helixtrans-67.2-38.7-176.8-65.9-8000110.6I52 E53 L58 M59 E60I52-D56 WeakPolarHBondContact CG2-OD2 3.34Å; I52-D56 WeakPolarHBondContact O-CB 3.25Å; I52-D56 PolarHBondContact O-N 3.05Å; E53-D56 PolarHBondContact O-N 3.16Å; D56-L58 PolarHBondContact O-N 2.97Å; D56-M59 PolarHBondContact O-N 2.83Å; D56-E60 WeakPolarHBondContact O-CB 3.41Å; D56-E60 PolarHBondContact O-N 2.69Å
57T91.5Very high86.9Confident71 Ų7178 Ų7844%0.43641%0.408SS..Hα-helixtrans-62.3-42.6173-51.70000111.7E53 R55 E60 A61 M79E53-T57 PolarHBondContact O-N 3.19Å; E53-T57 PolarHBondContact O-OG1 3.46Å; R55-T57 VanDerWaalsContact C-N 3.34Å; T57-E60 PolarHBondContact O-N 2.84Å; T57-A61 WeakPolarHBondContact O-CB 3.44Å; T57-A61 PolarHBondContact O-N 2.72Å; T57-M79 HydrophobicContact CG2-CE 3.78Å; T57-M79 WeakPolarHBondContact O-CE 2.97Å
58L91Very high85.4Confident20 Ų2085.6 Ų85.611%0.10544%0.443CS..Hα-helixtrans-64.5-43.2174.8176.964.8000111.7K54 R55 D56 E60 A61 I62 M79 V80 L83K54-L58 WeakPolarHBondContact O-CB 3.16Å; K54-L58 PolarHBondContact O-N 3.34Å; R55-L58 PolarHBondContact O-N 3.25Å; D56-L58 PolarHBondContact O-N 2.97Å; L58-E60 VanDerWaalsContact C-N 3.33Å; L58-E60 PolarHBondContact O-N 2.92Å; L58-A61 PolarHBondContact O-N 3.33Å; L58-I62 HydrophobicContact CD1-CD1 3.92Å; L58-I62 HydrophobicContact CD1-CG1 4.26Å; L58-I62 HydrophobicContact CG-CD1 3.86Å; L58-I62 VanDerWaalsContact O-CG1 3.27Å; L58-I62 WeakPolarHBondContact O-CG1 3.14Å; L58-I62 PolarHBondContact O-N 3.47Å; L58-M79 HydrophobicContact CB-CE 4.25Å; L58-M79 HydrophobicContact CD1-CB 3.8Å; L58-M79 HydrophobicContact CD1-CE 4.36Å; L58-M79 HydrophobicContact CD1-SD 4.32Å; L58-V80 HydrophobicContact CD1-CG2 4.26Å; L58-V80 HydrophobicContact CD2-CG2 4.14Å; L58-L83 HydrophobicContact CD2-CD2 3.67Å
59M91.2Very high83.9Confident116 Ų11686.9 Ų86.957%0.57145%0.449SS*.Hα-helixtrans-61.7-41.7177.2-76.4-178.7138.800111.6R55 D56 I62 W63R55-M59 HydrophobicContact CG-CG 4.49Å; R55-M59 HydrophobicContact CG-SD 4.17Å; R55-M59 WeakPolarHBondContact O-CB 3.31Å; R55-M59 WeakPolarHBondContact O-CG 3.44Å; R55-M59 PolarHBondContact O-N 2.81Å; D56-M59 PolarHBondContact O-N 2.83Å; M59-I62 PolarHBondContact O-N 3.13Å; M59-W63 WeakPolarHBondContact O-CB 3.31Å; M59-W63 PolarHBondContact O-N 3.34Å
60E89.1Confident82.5Confident147 Ų14792.6 Ų92.669%0.68747%0.471SS*.Hα-helixtrans-64-44.1176.6-170.6171.2-16600111.9D56 T57 L58 I62 W63 S64D56-E60 WeakPolarHBondContact O-CB 3.41Å; D56-E60 PolarHBondContact O-N 2.69Å; T57-E60 PolarHBondContact O-N 2.84Å; L58-E60 VanDerWaalsContact C-N 3.33Å; L58-E60 PolarHBondContact O-N 2.92Å; E60-I62 VanDerWaalsContact C-N 3.31Å; E60-I62 PolarHBondContact O-N 2.87Å; E60-W63 PolarHBondContact O-N 3.33Å; E60-S64 PolarHBondContact O-N 2.98Å
61A86.1Confident81.3Confident19 Ų1992.2 Ų92.216%0.15748%0.476CS..Hα-helixtrans-66.1-29.517600000113.6T57 L58 S64 Y76 M79T57-A61 WeakPolarHBondContact O-CB 3.44Å; T57-A61 PolarHBondContact O-N 2.72Å; L58-A61 PolarHBondContact O-N 3.33Å; A61-S64 PolarHBondContact O-OG 2.97Å; A61-Y76 HydrophobicContact CB-CE1 4.16Å; A61-Y76 WeakPolarHBondContact O-CE1 3.4Å; A61-Y76 PolarHBondContact O-OH 3.03Å; A61-M79 HydrophobicContact CB-CE 3.76Å; A61-M79 HydrophobicContact CB-SD 3.79Å
62I85.9Confident80.6Confident107 Ų10794.8 Ų94.855%0.54950%0.495SS..Hα-helixtrans-76.5-35.9174.3-69.2168.5000110.8L58 M59 E60 Y76L58-I62 HydrophobicContact CD1-CD1 3.92Å; L58-I62 HydrophobicContact CD1-CG1 4.26Å; L58-I62 HydrophobicContact CG-CD1 3.86Å; L58-I62 VanDerWaalsContact O-CG1 3.27Å; L58-I62 WeakPolarHBondContact O-CG1 3.14Å; L58-I62 PolarHBondContact O-N 3.47Å; M59-I62 PolarHBondContact O-N 3.13Å; E60-I62 VanDerWaalsContact C-N 3.31Å; E60-I62 PolarHBondContact O-N 2.87Å; I62-Y76 HydrophobicContact CG1-CD1 4.36Å; I62-Y76 HydrophobicContact CG1-CE1 3.97Å
63W86.5Confident80.2Confident225 Ų22599 Ų9985%0.85252%0.517SS*.Hα-helixtrans-79.9-20.7-177.5-169.5-98.6000113.6M59 E60M59-W63 WeakPolarHBondContact O-CB 3.31Å; M59-W63 PolarHBondContact O-N 3.34Å; E60-W63 PolarHBondContact O-N 3.33Å
64S80.8Confident79.9Confident39 Ų3996.1 Ų96.127%0.27351%0.51SS..SBendtrans-59.9134.1178.361.60000111.8E60 A61E60-S64 PolarHBondContact O-N 2.98Å; A61-S64 PolarHBondContact O-OG 2.97Å
65P72.2Confident79.5Confident70 Ų7097.1 Ų97.146%0.45552%0.516SS..  trans-61.1137.8-172.921.8-31.4000112S67 E68P65-S67 PolarHBondContact O-N 2.76Å; P65-E68 PolarHBondContact O-N 2.93Å
66P67.1Low79.3Confident125 Ų12595 Ų9581%0.81251%0.508SS*.G310 helixtrans-61.5-13.1-173.512.4-20.7000114.8E68P66-E68 VanDerWaalsContact C-N 3.29Å; P66-E68 PolarHBondContact O-N 2.9Å
67S62.4Low79.2Confident107 Ų10793.9 Ų93.975%0.74851%0.508SS*.G310 helixtrans-72.7-13.5-17953.20000115P65P65-S67 PolarHBondContact O-N 2.76Å
68E59.8Low79.1Confident166 Ų16696.6 Ų96.678%0.77652%0.516SS*.G310 helixtrans-103.6-3.3-178.5-70.3-173.7170.900114.2P65 P66P65-E68 PolarHBondContact O-N 2.93Å; P66-E68 VanDerWaalsContact C-N 3.29Å; P66-E68 PolarHBondContact O-N 2.9Å
69M59.1Low79.1Confident56 Ų5697 Ų9728%0.27652%0.517SS..  trans-117.7104.5-169.2-74.8-149.9-35.800114.7V71 Y76M69-V71 HydrophobicContact CB-CB 3.82Å; M69-V71 HydrophobicContact CB-CG2 3.68Å; M69-V71 HydrophobicContact CE-CB 3.72Å; M69-V71 HydrophobicContact CE-CG1 4.15Å; M69-V71 HydrophobicContact CE-CG2 4.11Å; M69-V71 HydrophobicContact CG-CB 4.11Å; M69-V71 HydrophobicContact CG-CG2 3.59Å; M69-V71 PolarHBondContact O-N 3.49Å; M69-V71 HydrophobicContact SD-CB 3.66Å; M69-V71 HydrophobicContact SD-CG1 4.2Å; M69-V71 HydrophobicContact SD-CG2 3.33Å; M69-V71 WeakPolarHBondContact SD-CG2 3.07Å; M69-Y76 HydrophobicContact CE-CE1 4.41Å; M69-Y76 HydrophobicContact CE-CE2 3.6Å; M69-Y76 WeakPolarHBondContact CE-OH 3.49Å
70N62.9Low79.2Confident178 Ų17894.6 Ų94.695%0.95251%0.509SS*.  trans-73.938.4148.6-78.2-19.7000110.9
71V68.4Low79.5Confident54 Ų5492.4 Ų92.433%0.32750%0.502SS..  trans-90.9115.6-175.4176.90000108.4M69 H75M69-V71 HydrophobicContact CB-CB 3.82Å; M69-V71 HydrophobicContact CB-CG2 3.68Å; M69-V71 HydrophobicContact CE-CB 3.72Å; M69-V71 HydrophobicContact CE-CG1 4.15Å; M69-V71 HydrophobicContact CE-CG2 4.11Å; M69-V71 HydrophobicContact CG-CB 4.11Å; M69-V71 HydrophobicContact CG-CG2 3.59Å; M69-V71 PolarHBondContact O-N 3.49Å; M69-V71 HydrophobicContact SD-CB 3.66Å; M69-V71 HydrophobicContact SD-CG1 4.2Å; M69-V71 HydrophobicContact SD-CG2 3.33Å; M69-V71 WeakPolarHBondContact SD-CG2 3.07Å; V71-H75 HydrophobicContact CG1-CB 3.29Å; V71-H75 VanDerWaalsContact CG1-CD2 3.45Å; V71-H75 WeakPolarHBondContact CG1-CD2 3.47Å
72S77Confident79.8Confident66 Ų6694.4 Ų94.446%0.46251%0.51SS..  trans-63.7149.3178.350.90000110.7S74 H75S72-S74 WeakPolarHBondContact CB-OG 3.4Å; S72-S74 PolarHBondContact O-N 3.18Å; S72-S74 PolarHBondContact OG-OG 3.49Å; S72-H75 WeakPolarHBondContact O-CB 3.43Å; S72-H75 PolarHBondContact O-N 3.08Å
73L83.3Confident80.3Confident151 Ų15190.9 Ų90.979%0.79149%0.493SS*.Hα-helixtrans-48.5-29.2170.4-176.866.5000112.5H75 Y76 A77L73-H75 VanDerWaalsContact C-N 3.32Å; L73-H75 PolarHBondContact O-N 2.97Å; L73-Y76 PolarHBondContact O-N 3.48Å; L73-A77 WeakPolarHBondContact O-CB 3.37Å; L73-A77 PolarHBondContact O-N 2.81Å
74S85.6Confident80.6Confident61 Ų6183.2 Ų83.243%0.42747%0.47SS..Hα-helixtrans-61.2-34.6175.360.10000113.7S72 A77 H78S72-S74 WeakPolarHBondContact CB-OG 3.4Å; S72-S74 PolarHBondContact O-N 3.18Å; S72-S74 PolarHBondContact OG-OG 3.49Å; S74-A77 PolarHBondContact O-N 2.83Å; S74-H78 PolarHBondContact O-CD2 3.2Å; S74-H78 PolarHBondContact O-N 3.31Å
75H85.9Confident81.3Confident89 Ų8986.9 Ų86.941%0.41248%0.483SS..Hα-helixtrans-65.9-48.2179-177.680.2000111.4V71 S72 L73 A77 H78 M79V71-H75 HydrophobicContact CG1-CB 3.29Å; V71-H75 VanDerWaalsContact CG1-CD2 3.45Å; V71-H75 WeakPolarHBondContact CG1-CD2 3.47Å; S72-H75 WeakPolarHBondContact O-CB 3.43Å; S72-H75 PolarHBondContact O-N 3.08Å; L73-H75 VanDerWaalsContact C-N 3.32Å; L73-H75 PolarHBondContact O-N 2.97Å; H75-A77 VanDerWaalsContact C-N 3.3Å; H75-A77 PolarHBondContact O-N 3.35Å; H75-H78 WeakPolarHBondContact O-CB 3.34Å; H75-H78 PolarHBondContact O-N 3.45Å; H75-H78 VanDerWaalsContact O-N 3.13Å; H75-M79 WeakPolarHBondContact O-CG 3.16Å; H75-M79 PolarHBondContact O-N 2.86Å
76Y86.8Confident82.2Confident58 Ų5883.8 Ų83.823%0.22746%0.463CS..Hα-helixtrans-60.5-40.9173.6-73.7-66.3000112.1A61 I62 M69 L73 H78 M79 V80A61-Y76 HydrophobicContact CB-CE1 4.16Å; A61-Y76 WeakPolarHBondContact O-CE1 3.4Å; A61-Y76 PolarHBondContact O-OH 3.03Å; I62-Y76 HydrophobicContact CG1-CD1 4.36Å; I62-Y76 HydrophobicContact CG1-CE1 3.97Å; M69-Y76 HydrophobicContact CE-CE1 4.41Å; M69-Y76 HydrophobicContact CE-CE2 3.6Å; M69-Y76 WeakPolarHBondContact CE-OH 3.49Å; L73-Y76 PolarHBondContact O-N 3.48Å; Y76-H78 VanDerWaalsContact C-N 3.31Å; Y76-H78 PolarHBondContact O-N 3.15Å; Y76-M79 PolarHBondContact O-N 3.41Å; Y76-V80 WeakPolarHBondContact O-CG2 3.14Å; Y76-V80 PolarHBondContact O-N 3.41Å
77A89.9Confident83.4Confident46 Ų4680.7 Ų80.738%0.3844%0.439SS..Hα-helixtrans-60.3-40.4174.600000112L73 S74 H75 V80 N81L73-A77 WeakPolarHBondContact O-CB 3.37Å; L73-A77 PolarHBondContact O-N 2.81Å; S74-A77 PolarHBondContact O-N 2.83Å; H75-A77 VanDerWaalsContact C-N 3.3Å; H75-A77 PolarHBondContact O-N 3.35Å; A77-V80 PolarHBondContact O-N 3.27Å; A77-N81 WeakPolarHBondContact O-CB 3.32Å; A77-N81 PolarHBondContact O-N 2.81Å; A77-N81 PolarHBondContact O-ND2 3.28Å
78H90.8Very high84.9Confident128 Ų12881 Ų8159%0.59343%0.432SS*.Hα-helixtrans-63.7-42.8174.3-77.2-62.8000112.4S74 H75 Y76 N81 D82S74-H78 PolarHBondContact O-CD2 3.2Å; S74-H78 PolarHBondContact O-N 3.31Å; H75-H78 WeakPolarHBondContact O-CB 3.34Å; H75-H78 PolarHBondContact O-N 3.45Å; H75-H78 VanDerWaalsContact O-N 3.13Å; Y76-H78 VanDerWaalsContact C-N 3.31Å; Y76-H78 PolarHBondContact O-N 3.15Å; H78-N81 PolarHBondContact O-N 2.96Å; H78-D82 WeakPolarHBondContact O-CB 3.14Å; H78-D82 PolarHBondContact O-N 3.09Å
79M91Very high86.4Confident28 Ų2876.2 Ų76.214%0.13841%0.412CS..Hα-helixtrans-65.6-40.4177.6-64.2-179.579.200112.4T57 L58 A61 H75 Y76 D82 L83T57-M79 HydrophobicContact CG2-CE 3.78Å; T57-M79 WeakPolarHBondContact O-CE 2.97Å; L58-M79 HydrophobicContact CB-CE 4.25Å; L58-M79 HydrophobicContact CD1-CB 3.8Å; L58-M79 HydrophobicContact CD1-CE 4.36Å; L58-M79 HydrophobicContact CD1-SD 4.32Å; A61-M79 HydrophobicContact CB-CE 3.76Å; A61-M79 HydrophobicContact CB-SD 3.79Å; H75-M79 WeakPolarHBondContact O-CG 3.16Å; H75-M79 PolarHBondContact O-N 2.86Å; Y76-M79 PolarHBondContact O-N 3.41Å; M79-D82 PolarHBondContact O-N 2.88Å; M79-L83 WeakPolarHBondContact O-CB 3.09Å; M79-L83 PolarHBondContact O-N 3.43Å
80V93.4Very high87.9Confident67 Ų6773.6 Ų73.641%0.40640%0.399SS..Hα-helixtrans-63.9-43.2174.9171.20000110.6L58 Y76 A77 L83 T84L58-V80 HydrophobicContact CD1-CG2 4.26Å; L58-V80 HydrophobicContact CD2-CG2 4.14Å; Y76-V80 WeakPolarHBondContact O-CG2 3.14Å; Y76-V80 PolarHBondContact O-N 3.41Å; A77-V80 PolarHBondContact O-N 3.27Å; V80-L83 PolarHBondContact O-N 3.21Å; V80-T84 WeakPolarHBondContact O-CB 3.32Å; V80-T84 PolarHBondContact O-N 2.94Å; V80-T84 PolarHBondContact O-OG1 3.28Å
81N94.5Very high89.2Confident101 Ų10169 Ų6954%0.5437%0.369SS..Hα-helixtrans-62.5-42.6175.7-73.6-18.7000112A77 H78 T84 E85A77-N81 WeakPolarHBondContact O-CB 3.32Å; A77-N81 PolarHBondContact O-N 2.81Å; A77-N81 PolarHBondContact O-ND2 3.28Å; H78-N81 PolarHBondContact O-N 2.96Å; N81-T84 PolarHBondContact O-N 3.46Å; N81-E85 WeakPolarHBondContact O-CB 3.42Å; N81-E85 PolarHBondContact O-N 3.04Å
82D93.6Very high90.1Very high60 Ų6072.2 Ų72.232%0.32139%0.385SS..Hα-helixtrans-67.4-38.6179.3-171.134.2000112.3K54 H78 M79 S86K54-D82 WeakPolarHBondContact CD-OD2 3.33Å; K54-D82 VanDerWaalsContact CE-OD2 3.24Å; K54-D82 WeakPolarHBondContact CE-OD2 3.38Å; K54-D82 IonicContact NZ-OD1 3.71Å; K54-D82 IonicContact NZ-OD2 2.67Å; K54-D82 PolarHBondContact NZ-OD2 3.43Å; H78-D82 WeakPolarHBondContact O-CB 3.14Å; H78-D82 PolarHBondContact O-N 3.09Å; M79-D82 PolarHBondContact O-N 2.88Å; D82-S86 VanDerWaalsContact O-CB 3.32Å; D82-S86 WeakPolarHBondContact O-CB 3.38Å; D82-S86 PolarHBondContact O-N 3.29Å; D82-S86 PolarHBondContact O-OG 3.33Å
83L94.6Very high90.6Very high34 Ų3470.2 Ų70.218%0.17837%0.369CS..Hα-helixtrans-64.2-44.6170.317661.4000111.3V51 K54 R55 L58 M79 V80 S86 L87V51-L83 HydrophobicContact CG1-CD1 4.46Å; K54-L83 HydrophobicContact CB-CD1 3.92Å; R55-L83 HydrophobicContact CB-CD1 4.18Å; L58-L83 HydrophobicContact CD2-CD2 3.67Å; M79-L83 WeakPolarHBondContact O-CB 3.09Å; M79-L83 PolarHBondContact O-N 3.43Å; V80-L83 PolarHBondContact O-N 3.21Å; L83-S86 PolarHBondContact O-N 3.17Å; L83-L87 WeakPolarHBondContact O-CB 3.38Å; L83-L87 PolarHBondContact O-N 2.69Å
84T94.1Very high90.6Very high63 Ų6369 Ų6939%0.38735%0.354SS..Hα-helixtrans-63.2-43.7179-56.90000110.8V80 N81 L87 L88V80-T84 WeakPolarHBondContact O-CB 3.32Å; V80-T84 PolarHBondContact O-N 2.94Å; V80-T84 PolarHBondContact O-OG1 3.28Å; N81-T84 PolarHBondContact O-N 3.46Å; T84-L87 PolarHBondContact O-N 3.19Å; T84-L88 HydrophobicContact CG2-CD1 4.07Å; T84-L88 HydrophobicContact CG2-CG 4.41Å; T84-L88 WeakPolarHBondContact O-CB 3.48Å; T84-L88 VanDerWaalsContact O-CG 3.28Å; T84-L88 WeakPolarHBondContact O-CG 3.11Å; T84-L88 PolarHBondContact O-N 3.27Å
85E94.1Very high90.6Very high117 Ų11766.2 Ų66.255%0.54734%0.335SS..Hα-helixtrans-62.6-42.8174.9-178177.8170.200111.3N81 L87 L88 N89N81-E85 WeakPolarHBondContact O-CB 3.42Å; N81-E85 PolarHBondContact O-N 3.04Å; E85-L87 VanDerWaalsContact C-N 3.32Å; E85-L87 PolarHBondContact O-N 2.9Å; E85-L88 PolarHBondContact O-N 3.12Å; E85-N89 VanDerWaalsContact O-CB 3.3Å; E85-N89 WeakPolarHBondContact O-CB 3.47Å; E85-N89 VanDerWaalsContact O-CG 3.25Å; E85-N89 PolarHBondContact O-N 3.04Å; E85-N89 PolarHBondContact O-ND2 3.42Å
86S92.3Very high90.6Very high4 Ų462.2 Ų62.23%0.02832%0.316CS..Hα-helixtrans-63.1-39.8176.8-68.90000112.2D82 L83 A90D82-S86 VanDerWaalsContact O-CB 3.32Å; D82-S86 WeakPolarHBondContact O-CB 3.38Å; D82-S86 PolarHBondContact O-N 3.29Å; D82-S86 PolarHBondContact O-OG 3.33Å; L83-S86 PolarHBondContact O-N 3.17Å; S86-A90 WeakPolarHBondContact O-CB 3.07Å; S86-A90 PolarHBondContact O-N 3.46Å
87L92.6Very high90.4Very high60 Ų6063.7 Ų63.731%0.31432%0.324SS..Hα-helixtrans-66.3-49.4176.6-169.970.9000111.1V51 L83 T84 E85 N89 A90 Y91 L101V51-L87 HydrophobicContact CG1-CD1 4Å; L83-L87 WeakPolarHBondContact O-CB 3.38Å; L83-L87 PolarHBondContact O-N 2.69Å; T84-L87 PolarHBondContact O-N 3.19Å; E85-L87 VanDerWaalsContact C-N 3.32Å; E85-L87 PolarHBondContact O-N 2.9Å; L87-N89 PolarHBondContact O-N 3.21Å; L87-A90 WeakPolarHBondContact O-CB 3.3Å; L87-A90 PolarHBondContact O-N 3.23Å; L87-A90 VanDerWaalsContact O-N 3.15Å; L87-Y91 HydrophobicContact CD1-CD2 4.16Å; L87-Y91 HydrophobicContact CD1-CE2 3.66Å; L87-Y91 HydrophobicContact CD2-CE2 4.43Å; L87-Y91 HydrophobicContact CG-CD2 3.95Å; L87-Y91 HydrophobicContact CG-CE2 3.8Å; L87-Y91 VanDerWaalsContact O-CD2 3.25Å; L87-Y91 WeakPolarHBondContact O-CD2 3.39Å; L87-Y91 PolarHBondContact O-N 2.91Å; L87-L101 HydrophobicContact CD1-CD1 3.71Å
88L92.9Very high90Very high113 Ų11366 Ų6659%0.59233%0.333SS*.Hα-helixtrans-60-46.1178.9-72.5173.3000111.5T84 E85 A90 Y91 D92T84-L88 HydrophobicContact CG2-CD1 4.07Å; T84-L88 HydrophobicContact CG2-CG 4.41Å; T84-L88 WeakPolarHBondContact O-CB 3.48Å; T84-L88 VanDerWaalsContact O-CG 3.28Å; T84-L88 WeakPolarHBondContact O-CG 3.11Å; T84-L88 PolarHBondContact O-N 3.27Å; E85-L88 PolarHBondContact O-N 3.12Å; L88-A90 VanDerWaalsContact C-N 3.3Å; L88-A90 PolarHBondContact O-N 2.94Å; L88-Y91 PolarHBondContact O-N 3.32Å; L88-D92 WeakPolarHBondContact O-CB 3.39Å; L88-D92 PolarHBondContact O-N 3.17Å
89N92.1Very high89.6Confident66 Ų6661.1 Ų61.135%0.35332%0.315SS..Hα-helixtrans-61.6-36.5175.5-76.7-38.2000112.6R50 E85 L87 D92R50-N89 VanDerWaalsContact NH2-CB 3.34Å; E85-N89 VanDerWaalsContact O-CB 3.3Å; E85-N89 WeakPolarHBondContact O-CB 3.47Å; E85-N89 VanDerWaalsContact O-CG 3.25Å; E85-N89 PolarHBondContact O-N 3.04Å; E85-N89 PolarHBondContact O-ND2 3.42Å; L87-N89 PolarHBondContact O-N 3.21Å; N89-D92 PolarHBondContact O-N 3.44Å
90A90.4Very high89.2Confident1 Ų161.1 Ų61.11%0.00832%0.315CS..Hα-helixtrans-65.9-44.3176.500000111.5N47 V51 S86 L87 L88 T93 V96N47-A90 HydrophobicContact CB-CB 3.87Å; V51-A90 HydrophobicContact CG2-CB 3.96Å; S86-A90 WeakPolarHBondContact O-CB 3.07Å; S86-A90 PolarHBondContact O-N 3.46Å; L87-A90 WeakPolarHBondContact O-CB 3.3Å; L87-A90 PolarHBondContact O-N 3.23Å; L87-A90 VanDerWaalsContact O-N 3.15Å; L88-A90 VanDerWaalsContact C-N 3.3Å; L88-A90 PolarHBondContact O-N 2.94Å; A90-T93 PolarHBondContact O-N 2.94Å; A90-T93 PolarHBondContact O-OG1 3.41Å; A90-V96 HydrophobicContact CB-CG2 4.21Å
91Y89.8Confident88.6Confident81 Ų8160.3 Ų60.332%0.31831%0.308SS..Hα-helixtrans-67.8-32.9175.7-82.2-73.4000113.2L87 L88 T93 R94 V96 V98 L101L87-Y91 HydrophobicContact CD1-CD2 4.16Å; L87-Y91 HydrophobicContact CD1-CE2 3.66Å; L87-Y91 HydrophobicContact CD2-CE2 4.43Å; L87-Y91 HydrophobicContact CG-CD2 3.95Å; L87-Y91 HydrophobicContact CG-CE2 3.8Å; L87-Y91 VanDerWaalsContact O-CD2 3.25Å; L87-Y91 WeakPolarHBondContact O-CD2 3.39Å; L87-Y91 PolarHBondContact O-N 2.91Å; L88-Y91 PolarHBondContact O-N 3.32Å; Y91-T93 PolarHBondContact O-N 2.92Å; Y91-R94 WeakPolarHBondContact O-CA 3.29Å; Y91-R94 PolarHBondContact O-N 2.87Å; Y91-V96 WeakPolarHBondContact CD1-O 3.48Å; Y91-V98 HydrophobicContact CE1-CG2 4.4Å; Y91-V98 WeakPolarHBondContact OH-CG2 3.26Å; Y91-L101 HydrophobicContact CE2-CD1 4.13Å
92D88.6Confident87.9Confident123 Ų12359.6 Ų59.666%0.65831%0.309SS*.Hα-helixtrans-61.2-28.6178-166.848.9000112.4L88 N89 R94L88-D92 WeakPolarHBondContact O-CB 3.39Å; L88-D92 PolarHBondContact O-N 3.17Å; N89-D92 PolarHBondContact O-N 3.44Å; D92-R94 PolarHBondContact O-N 3.42Å
93T85.5Confident86.7Confident23 Ų2363.8 Ų63.814%0.14133%0.332CS..THydrogen-bonded Turntrans-68.6-14.2172.868.60000114.5I43 N47 A90 Y91 Y95I43-T93 HydrophobicContact CG2-CG2 3.99Å; N47-T93 VanDerWaalsContact ND2-CG2 3.26Å; N47-T93 WeakPolarHBondContact ND2-CG2 3.43Å; N47-T93 PolarHBondContact ND2-OG1 3.38Å; A90-T93 PolarHBondContact O-N 2.94Å; A90-T93 PolarHBondContact O-OG1 3.41Å; Y91-T93 PolarHBondContact O-N 2.92Å; T93-Y95 PolarHBondContact O-N 2.88Å
94R84.7Confident85.2Confident125 Ų12565.8 Ų65.847%0.47235%0.346SS..SBendtrans60.3-1.6-177.5-55.2175-177.4160.4-12.1116.1Y91 D92 G130 N131Y91-R94 WeakPolarHBondContact O-CA 3.29Å; Y91-R94 PolarHBondContact O-N 2.87Å; D92-R94 PolarHBondContact O-N 3.42Å; R94-G130 VanDerWaalsContact CZ-O 3.28Å; R94-G130 PolarHBondContact NH1-O 2.81Å; R94-N131 WeakPolarHBondContact CD-O 3.21Å
95Y85.2Confident83.3Confident4 Ų468.5 Ų68.52%0.01637%0.367CS..  trans-84.5-18.2174.2-60.9-27.8000112.9E36 E40 I43 R44 T93 H100 W111 M135E36-Y95 PolarHBondContact OE2-OH 2.84Å; E40-Y95 HydrophobicContact CB-CD1 4.32Å; E40-Y95 HydrophobicContact CB-CD2 4.18Å; E40-Y95 HydrophobicContact CB-CE1 4.3Å; E40-Y95 HydrophobicContact CB-CE2 4.13Å; E40-Y95 HydrophobicContact CB-CG 4.27Å; E40-Y95 HydrophobicContact CG-CD1 3.75Å; E40-Y95 HydrophobicContact CG-CD2 4.08Å; E40-Y95 HydrophobicContact CG-CE1 4.19Å; E40-Y95 HydrophobicContact CG-CE2 4.46Å; E40-Y95 HydrophobicContact CG-CG 3.69Å; I43-Y95 HydrophobicContact CB-CD2 4.11Å; I43-Y95 HydrophobicContact CD1-CE2 4.25Å; I43-Y95 HydrophobicContact CG2-CD2 3.98Å; R44-Y95 WeakPolarHBondContact CD-O 3.5Å; T93-Y95 PolarHBondContact O-N 2.88Å; Y95-H100 PolarHBondContact O-CE1 3.28Å; Y95-H100 PolarHBondContact O-ND1 3.31Å; Y95-W111 AromaticContact CE1-CD1 3.71Å; Y95-W111 AromaticContact CE1-NE1 3.51Å; Y95-W111 AromaticContact CZ-NE1 3.72Å; Y95-W111 PolarHBondContact OH-NE1 3.37Å; Y95-W111 VanDerWaalsContact OH-NE1 3.1Å; Y95-M135 HydrophobicContact CE2-CB 4.28Å; Y95-M135 HydrophobicContact CE2-CG 4.08Å
96V84.9Confident81.8Confident5 Ų569.2 Ų69.23%0.0337%0.371CS..  trans-96.4117.1177-175.60000109.6R44 N47 I48 A90 Y91 L101R44-V96 HydrophobicContact CG-CG2 4.4Å; N47-V96 HydrophobicContact CB-CG2 4.03Å; I48-V96 HydrophobicContact CG1-CG1 4.37Å; I48-V96 HydrophobicContact CG1-CG2 4.33Å; A90-V96 HydrophobicContact CB-CG2 4.21Å; Y91-V96 WeakPolarHBondContact CD1-O 3.48Å; V96-L101 HydrophobicContact CG1-CG 4.33Å
97K83.6Confident80.5Confident89 Ų8976.5 Ų76.539%0.38740%0.404SS..  trans-104.3160.8169.9-66.9-173.3175.2-171.50109.6A99 H100 I108K97-A99 PolarHBondContact O-N 3.25Å; K97-H100 PolarHBondContact N-ND1 3.26Å; K97-H100 WeakPolarHBondContact O-CB 3.27Å; K97-H100 PolarHBondContact O-N 3.03Å; K97-I108 HydrophobicContact CD-CG2 4.43Å
98V82.3Confident79.7Confident93 Ų9376.5 Ų76.556%0.56440%0.404SS*.Hα-helixtrans-53-40.2176.6-179.70000111.7Y91 H100 L101 C102Y91-V98 HydrophobicContact CE1-CG2 4.4Å; Y91-V98 WeakPolarHBondContact OH-CG2 3.26Å; V98-H100 PolarHBondContact O-N 3.34Å; V98-H100 VanDerWaalsContact O-N 3.16Å; V98-L101 PolarHBondContact O-N 2.87Å; V98-C102 PolarHBondContact O-N 2.96Å
99A81.3Confident79.3Confident26 Ų2672.8 Ų72.822%0.21539%0.385CS..Hα-helixtrans-54.9-34.8178.700000113.6K97 L101 C102 T104K97-A99 PolarHBondContact O-N 3.25Å; A99-L101 VanDerWaalsContact C-N 3.33Å; A99-L101 PolarHBondContact O-N 3.28Å; A99-C102 PolarHBondContact O-N 2.77Å; A99-T104 PolarHBondContact O-N 3.41Å
100H82.4Confident79.1Confident29 Ų2970.7 Ų70.713%0.13437%0.374CS..Hα-helixtrans-70.3-28.4-180-57.4149.2000112.9R44 I48 Y95 K97 V98 I108R44-H100 VanDerWaalsContact CD-CE1 3.46Å; R44-H100 WeakPolarHBondContact CD-CE1 3.41Å; I48-H100 HydrophobicContact CD1-CB 3.66Å; I48-H100 HydrophobicContact CG1-CB 4.5Å; Y95-H100 PolarHBondContact O-CE1 3.28Å; Y95-H100 PolarHBondContact O-ND1 3.31Å; K97-H100 PolarHBondContact N-ND1 3.26Å; K97-H100 WeakPolarHBondContact O-CB 3.27Å; K97-H100 PolarHBondContact O-N 3.03Å; V98-H100 PolarHBondContact O-N 3.34Å; V98-H100 VanDerWaalsContact O-N 3.16Å; H100-I108 PolarHBondContact NE2-O 3.4Å
101L81.2Confident79.1Confident49 Ų4970.7 Ų70.726%0.25737%0.374SS..Hα-helixtrans-84.4-27.4178.9-64.4175000112.2V51 L87 Y91 V96 V98 A99 N103V51-L101 HydrophobicContact CB-CD2 4.48Å; V51-L101 HydrophobicContact CG1-CD2 3.99Å; L87-L101 HydrophobicContact CD1-CD1 3.71Å; Y91-L101 HydrophobicContact CE2-CD1 4.13Å; V96-L101 HydrophobicContact CG1-CG 4.33Å; V98-L101 PolarHBondContact O-N 2.87Å; A99-L101 VanDerWaalsContact C-N 3.33Å; A99-L101 PolarHBondContact O-N 3.28Å; L101-N103 VanDerWaalsContact C-N 3.31Å; L101-N103 PolarHBondContact O-N 3.37Å
102C79.1Confident79.3Confident86 Ų8668.1 Ų68.158%0.58137%0.367SS*.THydrogen-bonded Turntrans-89.415.8-177.5-63.30000114.2V98 A99 T104V98-C102 PolarHBondContact O-N 2.96Å; A99-C102 PolarHBondContact O-N 2.77Å; C102-T104 PolarHBondContact O-N 2.82Å; C102-T104 VanDerWaalsContact O-N 3.07Å
103N69Low79.5Confident149 Ų14966.5 Ų66.580%0.79735%0.352SS*.THydrogen-bonded Turntrans46.837.8-177.4-163.125.3000113.3L101L101-N103 VanDerWaalsContact C-N 3.31Å; L101-N103 PolarHBondContact O-N 3.37Å
104T63.5Low79.9Confident76 Ų7670.9 Ų70.947%0.46637%0.366SS..  trans-81.6122.4172.6-52.80000106.9A99 C102 E106A99-T104 PolarHBondContact O-N 3.41Å; C102-T104 PolarHBondContact O-N 2.82Å; C102-T104 VanDerWaalsContact O-N 3.07Å; T104-E106 PolarHBondContact O-N 3.31Å
105S53.8Low80.3Confident120 Ų12065 Ų6584%0.83935%0.345SS*.SBendtrans-625.5-169.1-38.70000116.2E107S105-E107 PolarHBondContact O-N 3.16Å
106E62.1Low80.8Confident132 Ų13264.9 Ų64.962%0.61734%0.344SS*.  trans-91.3100.2177-66.4-171.1170.700109.3T104 I108T104-E106 PolarHBondContact O-N 3.31Å; E106-I108 HydrophobicContact CB-CD1 4.29Å; E106-I108 HydrophobicContact CB-CG1 3.96Å; E106-I108 PolarHBondContact O-N 3.25Å
107E65.4Low81.3Confident156 Ų15665.2 Ų65.273%0.72935%0.345SS*.  trans-68.181.3167.5-66.8-171.3167.300109.8S105 N109S105-E107 PolarHBondContact O-N 3.16Å; E107-N109 PolarHBondContact O-N 3.49Å
108I76.6Confident81.9Confident61 Ų6161.4 Ų61.431%0.31333%0.329SS..  trans-79.789.3-179.6-57.7169.7000108.7K97 H100 E106K97-I108 HydrophobicContact CD-CG2 4.43Å; H100-I108 PolarHBondContact NE2-O 3.4Å; E106-I108 HydrophobicContact CB-CD1 4.29Å; E106-I108 HydrophobicContact CB-CG1 3.96Å; E106-I108 PolarHBondContact O-N 3.25Å
109N84.3Confident82.5Confident35 Ų3558 Ų5819%0.18731%0.306CS..  trans-66.3133.3171.2-64.2-35.7000110.7E40 R44 E107 T112E40-N109 WeakPolarHBondContact OE1-CA 3.36Å; R44-N109 PolarHBondContact NH1-OD1 2.96Å; R44-N109 PolarHBondContact NH2-OD1 3.21Å; E107-N109 PolarHBondContact O-N 3.49Å; N109-T112 WeakPolarHBondContact O-CG2 3.25Å
110V87.3Confident83.2Confident22 Ų2256.7 Ų56.713%0.13330%0.296CS..SBendtrans-77.9-45.1177.7-172.30000109.7E40 T112 A115 L132E40-V110 PolarHBondContact OE1-N 3.23Å; E40-V110 PolarHBondContact OE2-N 2.75Å; V110-T112 PolarHBondContact O-N 3.2Å; V110-T112 VanDerWaalsContact O-N 3.11Å; V110-A115 WeakPolarHBondContact O-CB 3.25Å; V110-L132 HydrophobicContact CG1-CD1 3.64Å
111W91.5Very high83.8Confident0 Ų055.3 Ų55.30%029%0.29CS..  trans-82.580.6174.2-73.3100.9000111.6F32 Y33 E36 Q37 E40 Y95 A116 F119 L132F32-W111 HydrophobicContact CB-CH2 4.47Å; F32-W111 HydrophobicContact CB-CZ3 4.04Å; Y33-W111 VanDerWaalsContact CE2-O 3.31Å; Y33-W111 WeakPolarHBondContact CE2-O 3.49Å; E36-W111 HydrophobicContact CB-CD2 3.68Å; E36-W111 HydrophobicContact CB-CE3 4.28Å; E36-W111 HydrophobicContact CB-CG 3.87Å; E36-W111 HydrophobicContact CB-CZ2 4.08Å; E36-W111 HydrophobicContact CG-CD2 4.34Å; E36-W111 HydrophobicContact CG-CH2 4.32Å; E36-W111 HydrophobicContact CG-CZ2 3.82Å; Q37-W111 HydrophobicContact CB-CB 4.45Å; E40-W111 VanDerWaalsContact OE2-CB 3.26Å; E40-W111 WeakPolarHBondContact OE2-CB 3.31Å; E40-W111 PolarHBondContact OE2-N 3.37Å; Y95-W111 AromaticContact CE1-CD1 3.71Å; Y95-W111 AromaticContact CE1-NE1 3.51Å; Y95-W111 AromaticContact CZ-NE1 3.72Å; Y95-W111 PolarHBondContact OH-NE1 3.37Å; Y95-W111 VanDerWaalsContact OH-NE1 3.1Å; W111-A116 HydrophobicContact CE3-CB 4.14Å; W111-A116 HydrophobicContact CZ3-CB 4.22Å; W111-F119 HydrophobicContact CH2-CB 4.49Å; W111-F119 AromaticContact CH2-CD1 3.66Å; W111-F119 HydrophobicContact CH2-CD1 3.66Å; W111-F119 HydrophobicContact CH2-CD2 4.28Å; W111-F119 AromaticContact CH2-CE1 3.95Å; W111-F119 HydrophobicContact CH2-CE1 3.95Å; W111-F119 AromaticContact CH2-CG 3.86Å; W111-F119 HydrophobicContact CH2-CG 3.86Å; W111-F119 HydrophobicContact CH2-CZ 4.4Å; W111-F119 HydrophobicContact CZ3-CB 4.34Å; W111-F119 AromaticContact CZ3-CD1 3.89Å; W111-F119 HydrophobicContact CZ3-CD1 3.89Å; W111-F119 HydrophobicContact CZ3-CG 4.12Å; W111-L132 HydrophobicContact CD2-CD1 3.89Å; W111-L132 HydrophobicContact CD2-CD2 4.12Å; W111-L132 HydrophobicContact CD2-CG 4.27Å; W111-L132 HydrophobicContact CE3-CD2 3.97Å; W111-L132 HydrophobicContact CE3-CG 4.44Å; W111-L132 HydrophobicContact CG-CD1 4.28Å; W111-L132 HydrophobicContact CH2-CD1 4.32Å; W111-L132 HydrophobicContact CH2-CD2 4.13Å; W111-L132 HydrophobicContact CH2-CG 3.9Å; W111-L132 HydrophobicContact CZ2-CD1 3.65Å; W111-L132 HydrophobicContact CZ2-CD2 4.28Å; W111-L132 HydrophobicContact CZ2-CG 3.7Å; W111-L132 HydrophobicContact CZ3-CD2 3.98Å; W111-L132 HydrophobicContact CZ3-CG 4.26Å
112T92.8Very high84.5Confident27 Ų2753.3 Ų53.317%0.16628%0.279CS..  trans-92.5161.2163.469.70000110.8N109 V110 R114 A115 A116 Q286N109-T112 WeakPolarHBondContact O-CG2 3.25Å; V110-T112 PolarHBondContact O-N 3.2Å; V110-T112 VanDerWaalsContact O-N 3.11Å; T112-R114 PolarHBondContact O-N 2.9Å; T112-A115 PolarHBondContact O-N 3.29Å; T112-A115 WeakPolarHBondContact OG1-CB 3.39Å; T112-A115 PolarHBondContact OG1-N 2.78Å; T112-A116 PolarHBondContact O-N 3.49Å; T112-Q286 PolarHBondContact OG1-OE1 2.78Å
113Y92.7Very high85.3Confident90 Ų9051.7 Ų51.735%0.35326%0.263SS..Hα-helixtrans-55-39.1176.9-177.9-104.2000112.6M30 A116 I117M30-Y113 HydrophobicContact CE-CE2 4.32Å; M30-Y113 HydrophobicContact CG-CE2 3.92Å; Y113-A116 PolarHBondContact O-N 3.07Å; Y113-I117 HydrophobicContact CD1-CD1 3.88Å; Y113-I117 HydrophobicContact CE1-CD1 3.38Å; Y113-I117 HydrophobicContact CE1-CG1 4.4Å; Y113-I117 WeakPolarHBondContact O-CG1 3.32Å; Y113-I117 PolarHBondContact O-N 3.22Å; Y113-I117 VanDerWaalsContact O-N 3.1Å
114R94Very high86.6Confident114 Ų11444.6 Ų44.643%0.4323%0.225SC..Hα-helixtrans-66.3-43.3175.9-70.1-178-72.2-88.8-1.2111.8T112 A116 I117 F118 Q286 Y289 F290T112-R114 PolarHBondContact O-N 2.9Å; R114-A116 VanDerWaalsContact C-N 3.34Å; R114-I117 PolarHBondContact O-N 2.86Å; R114-F118 PolarHBondContact O-N 2.97Å; R114-Q286 WeakPolarHBondContact CD-O 3.48Å; R114-Y289 HydrophobicContact CB-CD2 4.42Å; R114-F290 HydrophobicContact CG-CE2 3.76Å; R114-F290 HydrophobicContact CG-CZ 4.16Å
115A93.4Very high88.1Confident3 Ų341.2 Ų41.23%0.02520%0.204CC..Hα-helixtrans-64.9-37.4176.200000112.2V110 T112 F118 F119 L132 Y289V110-A115 WeakPolarHBondContact O-CB 3.25Å; T112-A115 PolarHBondContact O-N 3.29Å; T112-A115 WeakPolarHBondContact OG1-CB 3.39Å; T112-A115 PolarHBondContact OG1-N 2.78Å; A115-F118 PolarHBondContact O-N 3.49Å; A115-F119 VanDerWaalsContact O-CB 3.29Å; A115-F119 WeakPolarHBondContact O-CB 3.33Å; A115-F119 PolarHBondContact O-N 3.16Å; A115-L132 HydrophobicContact CB-CD2 4.08Å; A115-Y289 HydrophobicContact CB-CE2 3.99Å
116A95.3Very high90.1Very high0 Ų038.7 Ų38.70%018%0.183CC..Hα-helixtrans-64.8-39175.500000112.4S29 W111 T112 Y113 R114 T120S29-A116 PolarHBondContact OG-O 3.22Å; W111-A116 HydrophobicContact CE3-CB 4.14Å; W111-A116 HydrophobicContact CZ3-CB 4.22Å; T112-A116 PolarHBondContact O-N 3.49Å; Y113-A116 PolarHBondContact O-N 3.07Å; R114-A116 VanDerWaalsContact C-N 3.34Å; A116-T120 WeakPolarHBondContact O-CB 3.38Å; A116-T120 PolarHBondContact O-N 3.47Å; A116-T120 PolarHBondContact O-OG1 3.09Å
117I95.8Very high91.7Very high12 Ų1232.7 Ų32.76%0.06216%0.156CC..Hα-helixtrans-62.5-48.3172.3-68.9170.2000111.2I25 S29 Y113 R114 F119 T120 A121 F290 L293I25-I117 HydrophobicContact CG2-CG2 4.31Å; S29-I117 VanDerWaalsContact OG-CA 3.23Å; S29-I117 WeakPolarHBondContact OG-CA 3.23Å; Y113-I117 HydrophobicContact CD1-CD1 3.88Å; Y113-I117 HydrophobicContact CE1-CD1 3.38Å; Y113-I117 HydrophobicContact CE1-CG1 4.4Å; Y113-I117 WeakPolarHBondContact O-CG1 3.32Å; Y113-I117 PolarHBondContact O-N 3.22Å; Y113-I117 VanDerWaalsContact O-N 3.1Å; R114-I117 PolarHBondContact O-N 2.86Å; I117-F119 PolarHBondContact O-N 2.92Å; I117-T120 PolarHBondContact O-N 3.31Å; I117-A121 WeakPolarHBondContact O-CB 3.46Å; I117-A121 PolarHBondContact O-N 3.42Å; I117-F290 HydrophobicContact CD1-CE1 4.08Å; I117-F290 HydrophobicContact CD1-CZ 4.17Å; I117-F290 HydrophobicContact CG2-CE1 4.46Å; I117-L293 HydrophobicContact CG2-CD2 4.09Å
118F95.3Very high92.9Very high9 Ų927.4 Ų27.44%0.03914%0.143CC..Hα-helixtrans-62-44.3179.3-171.5-100.3000111.9R114 A115 T122 Y129 V282 Y289 V292 I296R114-F118 PolarHBondContact O-N 2.97Å; A115-F118 PolarHBondContact O-N 3.49Å; F118-T122 HydrophobicContact CD1-CG2 4.31Å; F118-T122 HydrophobicContact CE1-CG2 4.02Å; F118-T122 HydrophobicContact CE2-CG2 4.38Å; F118-T122 HydrophobicContact CZ-CG2 4.06Å; F118-T122 WeakPolarHBondContact O-CB 3.47Å; F118-T122 VanDerWaalsContact O-CG2 3.29Å; F118-T122 WeakPolarHBondContact O-CG2 3.42Å; F118-T122 PolarHBondContact O-N 2.74Å; F118-T122 PolarHBondContact O-OG1 3.29Å; F118-Y129 HydrophobicContact CE1-CD2 4.08Å; F118-Y129 AromaticContact CE1-CE2 3.89Å; F118-Y129 HydrophobicContact CE1-CE2 3.89Å; F118-Y129 HydrophobicContact CZ-CD2 4.47Å; F118-Y129 AromaticContact CZ-CE2 3.82Å; F118-Y129 HydrophobicContact CZ-CE2 3.82Å; F118-V282 HydrophobicContact CE1-CG1 3.99Å; F118-Y289 HydrophobicContact CB-CD2 3.66Å; F118-Y289 HydrophobicContact CB-CE2 4.18Å; F118-Y289 HydrophobicContact CB-CG 4.22Å; F118-Y289 HydrophobicContact CD1-CE2 4.47Å; F118-Y289 HydrophobicContact CD2-CD2 4.48Å; F118-Y289 HydrophobicContact CD2-CG 4.25Å; F118-Y289 HydrophobicContact CG-CD2 4Å; F118-Y289 HydrophobicContact CG-CE2 4.37Å; F118-Y289 HydrophobicContact CG-CG 4.22Å; F118-V292 HydrophobicContact CE2-CB 4.27Å; F118-V292 HydrophobicContact CE2-CG1 3.73Å; F118-V292 HydrophobicContact CZ-CG1 4.2Å; F118-I296 HydrophobicContact CE2-CD1 4.1Å; F118-I296 HydrophobicContact CZ-CD1 4.32Å
119F95.1Very high93.7Very high21 Ų2125 Ų259%0.09213%0.13CC..Hα-helixtrans-58.5-51.8173.5167.4-98.2000111.8F32 W111 A115 I117 A121 T122 F123 L132 P134F32-F119 HydrophobicContact CD1-CE1 4.15Å; F32-F119 HydrophobicContact CD2-CD1 4.17Å; F32-F119 AromaticContact CD2-CE1 3.89Å; F32-F119 HydrophobicContact CD2-CE1 3.89Å; F32-F119 HydrophobicContact CE1-CE1 4.13Å; F32-F119 HydrophobicContact CE2-CD1 4.49Å; F32-F119 AromaticContact CE2-CE1 3.87Å; F32-F119 HydrophobicContact CE2-CE1 3.87Å; F32-F119 HydrophobicContact CG-CD1 4.38Å; F32-F119 HydrophobicContact CG-CE1 4.05Å; F32-F119 AromaticContact CZ-CE1 4Å; F32-F119 HydrophobicContact CZ-CE1 4Å; W111-F119 HydrophobicContact CH2-CB 4.49Å; W111-F119 AromaticContact CH2-CD1 3.66Å; W111-F119 HydrophobicContact CH2-CD1 3.66Å; W111-F119 HydrophobicContact CH2-CD2 4.28Å; W111-F119 AromaticContact CH2-CE1 3.95Å; W111-F119 HydrophobicContact CH2-CE1 3.95Å; W111-F119 AromaticContact CH2-CG 3.86Å; W111-F119 HydrophobicContact CH2-CG 3.86Å; W111-F119 HydrophobicContact CH2-CZ 4.4Å; W111-F119 HydrophobicContact CZ3-CB 4.34Å; W111-F119 AromaticContact CZ3-CD1 3.89Å; W111-F119 HydrophobicContact CZ3-CD1 3.89Å; W111-F119 HydrophobicContact CZ3-CG 4.12Å; A115-F119 VanDerWaalsContact O-CB 3.29Å; A115-F119 WeakPolarHBondContact O-CB 3.33Å; A115-F119 PolarHBondContact O-N 3.16Å; I117-F119 PolarHBondContact O-N 2.92Å; F119-A121 VanDerWaalsContact C-N 3.31Å; F119-A121 PolarHBondContact O-N 3.37Å; F119-T122 PolarHBondContact O-N 2.93Å; F119-T122 PolarHBondContact O-OG1 3.19Å; F119-F123 HydrophobicContact CZ-CB 4.49Å; F119-F123 VanDerWaalsContact O-CB 3.22Å; F119-F123 WeakPolarHBondContact O-CB 3.49Å; F119-F123 PolarHBondContact O-N 3.42Å; F119-L132 HydrophobicContact CB-CD2 4.04Å; F119-L132 HydrophobicContact CD2-CB 4.41Å; F119-L132 HydrophobicContact CD2-CG 4.39Å; F119-L132 VanDerWaalsContact CD2-O 3.22Å; F119-L132 WeakPolarHBondContact CD2-O 3.47Å; F119-L132 VanDerWaalsContact CE2-O 3.26Å; F119-L132 WeakPolarHBondContact CE2-O 3.43Å; F119-P134 HydrophobicContact CZ-CG 4.13Å
120T96.1Very high93.9Very high0 Ų024.7 Ų24.70%014%0.135CC..Hα-helixtrans-63.6-40.5-176.7-54.20000111.1I25 S29 F32 A116 I117 L124 Y146I25-T120 HydrophobicContact CG2-CG2 4.26Å; S29-T120 WeakPolarHBondContact CA-OG1 3.23Å; S29-T120 PolarHBondContact N-OG1 3.06Å; S29-T120 VanDerWaalsContact OG-CB 3.28Å; S29-T120 WeakPolarHBondContact OG-CB 3.35Å; S29-T120 PolarHBondContact OG-OG1 3.23Å; S29-T120 VanDerWaalsContact OG-OG1 3.07Å; F32-T120 WeakPolarHBondContact CD2-OG1 3.41Å; F32-T120 HydrophobicContact CE2-CG2 4.43Å; A116-T120 WeakPolarHBondContact O-CB 3.38Å; A116-T120 PolarHBondContact O-N 3.47Å; A116-T120 PolarHBondContact O-OG1 3.09Å; I117-T120 PolarHBondContact O-N 3.31Å; T120-L124 HydrophobicContact CG2-CD1 4.3Å; T120-L124 WeakPolarHBondContact O-CB 3.04Å; T120-L124 VanDerWaalsContact O-CG 3.3Å; T120-L124 WeakPolarHBondContact O-CG 3.3Å; T120-L124 PolarHBondContact O-N 2.85Å; T120-Y146 HydrophobicContact CG2-CE1 3.75Å
121A95.7Very high93.9Very high0 Ų026.6 Ų26.60%015%0.145CC..Hα-helixtrans-64.3-49.617600000111.9I25 I117 F119 F123 L124 T125 L293I25-A121 HydrophobicContact CD1-CB 4.29Å; I25-A121 HydrophobicContact CG2-CB 4.2Å; I117-A121 WeakPolarHBondContact O-CB 3.46Å; I117-A121 PolarHBondContact O-N 3.42Å; F119-A121 VanDerWaalsContact C-N 3.31Å; F119-A121 PolarHBondContact O-N 3.37Å; A121-F123 VanDerWaalsContact C-N 3.3Å; A121-F123 PolarHBondContact O-N 2.93Å; A121-L124 PolarHBondContact O-N 2.82Å; A121-T125 VanDerWaalsContact O-CG2 3.28Å; A121-T125 WeakPolarHBondContact O-CG2 3.48Å; A121-T125 PolarHBondContact O-N 3.31Å; A121-T125 PolarHBondContact O-OG1 3.29Å; A121-T125 VanDerWaalsContact O-OG1 3.06Å; A121-L293 HydrophobicContact CB-CD1 3.4Å; A121-L293 HydrophobicContact CB-CD2 4.04Å; A121-L293 HydrophobicContact CB-CG 4.38Å
122T95.2Very high93.9Very high6 Ų627.4 Ų27.44%0.03715%0.149CC..Hα-helixtrans-66.7-30.1-179.552.90000113.2F118 F119 T125 I127 G128 Y129F118-T122 HydrophobicContact CD1-CG2 4.31Å; F118-T122 HydrophobicContact CE1-CG2 4.02Å; F118-T122 HydrophobicContact CE2-CG2 4.38Å; F118-T122 HydrophobicContact CZ-CG2 4.06Å; F118-T122 WeakPolarHBondContact O-CB 3.47Å; F118-T122 VanDerWaalsContact O-CG2 3.29Å; F118-T122 WeakPolarHBondContact O-CG2 3.42Å; F118-T122 PolarHBondContact O-N 2.74Å; F118-T122 PolarHBondContact O-OG1 3.29Å; F119-T122 PolarHBondContact O-N 2.93Å; F119-T122 PolarHBondContact O-OG1 3.19Å; T122-T125 WeakPolarHBondContact CA-OG1 3.23Å; T122-T125 PolarHBondContact O-OG1 2.93Å; T122-I127 PolarHBondContact O-N 2.86Å; T122-G128 PolarHBondContact O-N 3.39Å; T122-Y129 HydrophobicContact CG2-CD2 4.05Å; T122-Y129 HydrophobicContact CG2-CE2 3.71Å
123F95.5Very high93.8Very high52 Ų5228.3 Ų28.323%0.22815%0.154CC..Hα-helixtrans-63.9-51.8169.7168.1-110.4000111.3F119 A121 T125 T126 S143 Y146F119-F123 HydrophobicContact CZ-CB 4.49Å; F119-F123 VanDerWaalsContact O-CB 3.22Å; F119-F123 WeakPolarHBondContact O-CB 3.49Å; F119-F123 PolarHBondContact O-N 3.42Å; A121-F123 VanDerWaalsContact C-N 3.3Å; A121-F123 PolarHBondContact O-N 2.93Å; F123-T125 PolarHBondContact O-N 2.9Å; F123-T126 PolarHBondContact O-N 3.38Å; F123-T126 VanDerWaalsContact O-N 3.16Å; F123-S143 WeakPolarHBondContact CZ-O 3.13Å; F123-Y146 HydrophobicContact CD1-CD1 4.44Å; F123-Y146 AromaticContact CE1-CD1 3.98Å; F123-Y146 HydrophobicContact CE1-CD1 3.98Å
124L96.4Very high93.8Very high0 Ų024.8 Ų24.80%014%0.142CC..Hα-helixtrans-72.1-27.6-177.1-67.6-177.5000113.8Y24 I25 T120 A121 T126 Y146 I151 I154Y24-L124 HydrophobicContact CD1-CD1 3.74Å; Y24-L124 HydrophobicContact CE1-CD1 3.88Å; Y24-L124 HydrophobicContact CE1-CD2 4.46Å; I25-L124 HydrophobicContact CG1-CD1 3.91Å; T120-L124 HydrophobicContact CG2-CD1 4.3Å; T120-L124 WeakPolarHBondContact O-CB 3.04Å; T120-L124 VanDerWaalsContact O-CG 3.3Å; T120-L124 WeakPolarHBondContact O-CG 3.3Å; T120-L124 PolarHBondContact O-N 2.85Å; A121-L124 PolarHBondContact O-N 2.82Å; L124-T126 PolarHBondContact O-N 3.32Å; L124-Y146 HydrophobicContact CD1-CE1 3.86Å; L124-Y146 HydrophobicContact CD2-CD1 4.15Å; L124-Y146 HydrophobicContact CD2-CE1 3.81Å; L124-Y146 HydrophobicContact CG-CE1 4.04Å; L124-I151 HydrophobicContact CD2-CG1 4.42Å; L124-I154 HydrophobicContact CB-CB 4.46Å; L124-I154 HydrophobicContact CB-CG1 3.71Å; L124-I154 HydrophobicContact CD1-CG1 4.06Å; L124-I154 HydrophobicContact CG-CG1 4.49Å
125T94.7Very high93.6Very high5 Ų522.3 Ų22.33%0.03114%0.137CC..THydrogen-bonded Turntrans-81.37.3172.660.20000113.4A121 T122 F123 I127 I154 I158 M297 L300A121-T125 VanDerWaalsContact O-CG2 3.28Å; A121-T125 WeakPolarHBondContact O-CG2 3.48Å; A121-T125 PolarHBondContact O-N 3.31Å; A121-T125 PolarHBondContact O-OG1 3.29Å; A121-T125 VanDerWaalsContact O-OG1 3.06Å; T122-T125 WeakPolarHBondContact CA-OG1 3.23Å; T122-T125 PolarHBondContact O-OG1 2.93Å; F123-T125 PolarHBondContact O-N 2.9Å; T125-I127 PolarHBondContact O-N 3.4Å; T125-I127 VanDerWaalsContact O-N 3.07Å; T125-I127 WeakPolarHBondContact OG1-CD1 3.23Å; T125-I127 WeakPolarHBondContact OG1-CG1 3.32Å; T125-I154 HydrophobicContact CG2-CG2 3.96Å; T125-I158 HydrophobicContact CG2-CD1 4.33Å; T125-M297 HydrophobicContact CG2-CE 3.34Å; T125-L300 HydrophobicContact CG2-CD1 3.65Å
126T95.9Very high93.6Very high67 Ų6723.2 Ų23.241%0.41114%0.143SC..THydrogen-bonded Turntrans54.926.8-17969.70000114.3F123 L124 I151F123-T126 PolarHBondContact O-N 3.38Å; F123-T126 VanDerWaalsContact O-N 3.16Å; L124-T126 PolarHBondContact O-N 3.32Å; T126-I151 HydrophobicContact CG2-CD1 4.37Å; T126-I151 HydrophobicContact CG2-CG1 4.29Å; T126-I151 HydrophobicContact CG2-CG2 3.67Å
127I95.6Very high93.6Very high7 Ų727.1 Ų27.14%0.03618%0.175CC..  trans-80.8-54.7172.8-63.8168.5000108.5T122 T125 Y129 T272 T275 I296 L300T122-I127 PolarHBondContact O-N 2.86Å; T125-I127 PolarHBondContact O-N 3.4Å; T125-I127 VanDerWaalsContact O-N 3.07Å; T125-I127 WeakPolarHBondContact OG1-CD1 3.23Å; T125-I127 WeakPolarHBondContact OG1-CG1 3.32Å; I127-Y129 HydrophobicContact CG2-CD1 3.94Å; I127-Y129 HydrophobicContact CG2-CD2 4.41Å; I127-Y129 HydrophobicContact CG2-CE1 3.57Å; I127-Y129 HydrophobicContact CG2-CE2 4.09Å; I127-Y129 HydrophobicContact CG2-CG 4.33Å; I127-T272 HydrophobicContact CD1-CG2 4.18Å; I127-T275 HydrophobicContact CG1-CG2 4.06Å; I127-I296 HydrophobicContact CD1-CG2 3.5Å; I127-I296 VanDerWaalsContact CD1-CG2 3.5Å; I127-L300 HydrophobicContact CD1-CD1 4.26Å
128G92.2Very high93.6Very high45 Ų4532 Ų3246%0.46420%0.201SC..  trans54.756.4170.500000115.9T122 G130T122-G128 PolarHBondContact O-N 3.39Å; G128-G130 PolarHBondContact O-N 2.82Å
129Y92.6Very high93.5Very high9 Ų931.8 Ų31.84%0.03520%0.2CC..  trans-48.5-31.3177.9-61.9-58.5000114.2F118 T122 I127 N131 F268 T272 G277 G279 V282F118-Y129 HydrophobicContact CE1-CD2 4.08Å; F118-Y129 AromaticContact CE1-CE2 3.89Å; F118-Y129 HydrophobicContact CE1-CE2 3.89Å; F118-Y129 HydrophobicContact CZ-CD2 4.47Å; F118-Y129 AromaticContact CZ-CE2 3.82Å; F118-Y129 HydrophobicContact CZ-CE2 3.82Å; T122-Y129 HydrophobicContact CG2-CD2 4.05Å; T122-Y129 HydrophobicContact CG2-CE2 3.71Å; I127-Y129 HydrophobicContact CG2-CD1 3.94Å; I127-Y129 HydrophobicContact CG2-CD2 4.41Å; I127-Y129 HydrophobicContact CG2-CE1 3.57Å; I127-Y129 HydrophobicContact CG2-CE2 4.09Å; I127-Y129 HydrophobicContact CG2-CG 4.33Å; Y129-N131 PolarHBondContact O-N 2.9Å; Y129-F268 AromaticContact CE1-CE2 3.84Å; Y129-F268 HydrophobicContact CE1-CE2 3.84Å; Y129-F268 HydrophobicContact CE1-CZ 4.49Å; Y129-F268 AromaticContact CZ-CE2 3.81Å; Y129-F268 WeakPolarHBondContact OH-CZ 3.22Å; Y129-T272 WeakPolarHBondContact OH-CG2 3.38Å; Y129-T272 PolarHBondContact OH-OG1 3.44Å; Y129-G277 WeakPolarHBondContact CA-O 3.36Å; Y129-G279 VanDerWaalsContact O-CA 3.3Å; Y129-G279 WeakPolarHBondContact O-CA 3.35Å; Y129-V282 HydrophobicContact CD1-CG2 4.08Å; Y129-V282 HydrophobicContact CD2-CG1 4.1Å; Y129-V282 HydrophobicContact CD2-CG2 4.14Å; Y129-V282 HydrophobicContact CE2-CG1 4.41Å; Y129-V282 HydrophobicContact CG-CG2 3.74Å
130G89.1Confident93.5Very high29 Ų2935.5 Ų35.530%0.29922%0.216SC..  trans73.510.1176.400000114.1R94 G128R94-G130 VanDerWaalsContact CZ-O 3.28Å; R94-G130 PolarHBondContact NH1-O 2.81Å; G128-G130 PolarHBondContact O-N 2.82Å
131N87.4Confident93.5Very high63 Ų6338 Ų3834%0.33724%0.237SC..SBendtrans-73-33.1170.566.3-42.7000112.3R94 Y129 V282R94-N131 WeakPolarHBondContact CD-O 3.21Å; Y129-N131 PolarHBondContact O-N 2.9Å; N131-V282 HydrophobicContact CB-CG2 4.25Å
132L90.1Very high93.6Very high16 Ų1640.3 Ų40.38%0.08425%0.247CC..SBendtrans-117.2124.6172.6-175.656.1000109.2V110 W111 A115 F119V110-L132 HydrophobicContact CG1-CD1 3.64Å; W111-L132 HydrophobicContact CD2-CD1 3.89Å; W111-L132 HydrophobicContact CD2-CD2 4.12Å; W111-L132 HydrophobicContact CD2-CG 4.27Å; W111-L132 HydrophobicContact CE3-CD2 3.97Å; W111-L132 HydrophobicContact CE3-CG 4.44Å; W111-L132 HydrophobicContact CG-CD1 4.28Å; W111-L132 HydrophobicContact CH2-CD1 4.32Å; W111-L132 HydrophobicContact CH2-CD2 4.13Å; W111-L132 HydrophobicContact CH2-CG 3.9Å; W111-L132 HydrophobicContact CZ2-CD1 3.65Å; W111-L132 HydrophobicContact CZ2-CD2 4.28Å; W111-L132 HydrophobicContact CZ2-CG 3.7Å; W111-L132 HydrophobicContact CZ3-CD2 3.98Å; W111-L132 HydrophobicContact CZ3-CG 4.26Å; A115-L132 HydrophobicContact CB-CD2 4.08Å; F119-L132 HydrophobicContact CB-CD2 4.04Å; F119-L132 HydrophobicContact CD2-CB 4.41Å; F119-L132 HydrophobicContact CD2-CG 4.39Å; F119-L132 VanDerWaalsContact CD2-O 3.22Å; F119-L132 WeakPolarHBondContact CD2-O 3.47Å; F119-L132 VanDerWaalsContact CE2-O 3.26Å; F119-L132 WeakPolarHBondContact CE2-O 3.43Å
133V92.1Very high93.6Very high46 Ų4640.9 Ų40.928%0.27925%0.251SS..  trans-139.3143.6-176.1-64.70000111.2M135V133-M135 HydrophobicContact CG2-SD 4.31Å; V133-M135 PolarHBondContact O-N 2.84Å
134P92.6Very high93.5Very high16 Ų1644.7 Ų44.710%0.10427%0.273CS..  trans-69.1124.7175.225.8-30.8000109.7F32 E36 F119 S139 K140F32-P134 HydrophobicContact CE1-CB 4.49Å; E36-P134 HydrophobicContact CG-CB 4.46Å; F119-P134 HydrophobicContact CZ-CG 4.13Å; P134-S139 VanDerWaalsContact CB-OG 3.3Å; P134-S139 WeakPolarHBondContact CB-OG 3.49Å; P134-K140 WeakPolarHBondContact O-CE 3.24Å; P134-K140 WeakPolarHBondContact O-CG 3.33Å
135M90.4Very high93.5Very high63 Ų6349.5 Ų49.531%0.3130%0.302SS..  trans-97.4-30.1-179-72.9-65.9-81.800112.4E36 Y95 V133 K140E36-M135 PolarHBondContact OE1-N 3.47Å; E36-M135 VanDerWaalsContact OE1-N 3.15Å; E36-M135 PolarHBondContact OE2-N 2.64Å; Y95-M135 HydrophobicContact CE2-CB 4.28Å; Y95-M135 HydrophobicContact CE2-CG 4.08Å; V133-M135 HydrophobicContact CG2-SD 4.31Å; V133-M135 PolarHBondContact O-N 2.84Å; M135-K140 WeakPolarHBondContact O-CE 3.44Å; M135-K140 PolarHBondContact O-NZ 3Å
136S93Very high93.6Very high21 Ų2149.7 Ų49.715%0.14730%0.303CS..SBendtrans-65.3142.2-179.5179.10000111.9E36 L138 S139 K140E36-S136 WeakPolarHBondContact OE1-CB 3.34Å; E36-S136 PolarHBondContact OE1-N 3.14Å; S136-L138 PolarHBondContact O-N 3.19Å; S136-L138 PolarHBondContact OG-N 3.22Å; S136-S139 WeakPolarHBondContact CB-OG 3.45Å; S136-S139 PolarHBondContact N-OG 2.87Å; S136-S139 PolarHBondContact O-N 3.37Å; S136-S139 PolarHBondContact O-OG 2.77Å; S136-K140 WeakPolarHBondContact O-CB 3.49Å; S136-K140 VanDerWaalsContact O-CG 3.31Å; S136-K140 WeakPolarHBondContact O-CG 3.36Å; S136-K140 PolarHBondContact O-N 3.13Å
137A94.5Very high93.6Very high83 Ų8346.7 Ų46.769%0.68629%0.285SS*.Hα-helixtrans-59.1-34.9174.600000111.8A141A137-A141 WeakPolarHBondContact O-CB 3.1Å; A137-A141 PolarHBondContact O-N 3.26Å
138L95.5Very high93.6Very high115 Ų11552.8 Ų52.860%0.60232%0.317SS*.Hα-helixtrans-67-47179.8179.964.4000112V35 S136 A141 F142V35-L138 HydrophobicContact CG1-CB 4.41Å; V35-L138 HydrophobicContact CG1-CD2 4.07Å; V35-L138 HydrophobicContact CG1-CG 4.47Å; V35-L138 HydrophobicContact CG2-CD2 4.11Å; S136-L138 PolarHBondContact O-N 3.19Å; S136-L138 PolarHBondContact OG-N 3.22Å; L138-A141 PolarHBondContact O-N 3.5Å; L138-F142 WeakPolarHBondContact O-CB 3.44Å; L138-F142 PolarHBondContact O-N 3.35Å
139S94.3Very high93.7Very high3 Ų355.7 Ų55.72%0.02132%0.321CS..Hα-helixtrans-71.2-33.3-179.856.80000112E36 P134 S136 F142 S143E36-S139 VanDerWaalsContact OE1-CB 3.22Å; E36-S139 WeakPolarHBondContact OE1-CB 3.4Å; E36-S139 PolarHBondContact OE1-OG 3.21Å; P134-S139 VanDerWaalsContact CB-OG 3.3Å; P134-S139 WeakPolarHBondContact CB-OG 3.49Å; S136-S139 WeakPolarHBondContact CB-OG 3.45Å; S136-S139 PolarHBondContact N-OG 2.87Å; S136-S139 PolarHBondContact O-N 3.37Å; S136-S139 PolarHBondContact O-OG 2.77Å; S139-F142 PolarHBondContact O-N 2.89Å; S139-S143 WeakPolarHBondContact O-CB 3.35Å; S139-S143 PolarHBondContact O-N 2.9Å; S139-S143 PolarHBondContact O-OG 3.15Å
140K95.2Very high93.9Very high100 Ų10055.3 Ų55.344%0.43532%0.319SS..Hα-helixtrans-63.4-43.7169.8-72.4175.6-178.2171.60111.9P134 M135 S136 S143 L144P134-K140 WeakPolarHBondContact O-CE 3.24Å; P134-K140 WeakPolarHBondContact O-CG 3.33Å; M135-K140 WeakPolarHBondContact O-CE 3.44Å; M135-K140 PolarHBondContact O-NZ 3Å; S136-K140 WeakPolarHBondContact O-CB 3.49Å; S136-K140 VanDerWaalsContact O-CG 3.31Å; S136-K140 WeakPolarHBondContact O-CG 3.36Å; S136-K140 PolarHBondContact O-N 3.13Å; K140-S143 PolarHBondContact O-N 3.46Å; K140-S143 PolarHBondContact O-OG 3.31Å; K140-L144 WeakPolarHBondContact O-CG 3.36Å; K140-L144 PolarHBondContact O-N 2.94Å
141A96Very high94.2Very high52 Ų5256.2 Ų56.243%0.4332%0.317SS..Hα-helixtrans-65.7-42.417500000111.6A137 L138 L144 V145A137-A141 WeakPolarHBondContact O-CB 3.1Å; A137-A141 PolarHBondContact O-N 3.26Å; L138-A141 PolarHBondContact O-N 3.5Å; A141-L144 PolarHBondContact O-N 2.82Å; A141-V145 PolarHBondContact O-N 2.96Å
142F96.3Very high94.6Very high48 Ų4856.2 Ų56.221%0.21132%0.32CS..Hα-helixtrans-60.6-43.9175.9174.2-103.4000112.1I31 F32 L138 S139 L144 V145 Y146I31-F142 HydrophobicContact CB-CE1 4.14Å; I31-F142 HydrophobicContact CB-CZ 4.09Å; I31-F142 HydrophobicContact CD1-CE1 4.46Å; I31-F142 HydrophobicContact CD1-CE2 3.7Å; I31-F142 HydrophobicContact CD1-CZ 3.57Å; I31-F142 HydrophobicContact CG1-CZ 4.42Å; I31-F142 HydrophobicContact CG2-CD1 4.04Å; I31-F142 HydrophobicContact CG2-CD2 4.32Å; I31-F142 HydrophobicContact CG2-CE1 3.88Å; I31-F142 HydrophobicContact CG2-CE2 4.17Å; I31-F142 HydrophobicContact CG2-CG 4.27Å; I31-F142 HydrophobicContact CG2-CZ 3.95Å; F32-F142 HydrophobicContact CD1-CD1 4.31Å; F32-F142 HydrophobicContact CD2-CE1 4.29Å; F32-F142 AromaticContact CE1-CD1 3.68Å; F32-F142 HydrophobicContact CE1-CD1 3.68Å; F32-F142 HydrophobicContact CE1-CE1 4.17Å; F32-F142 HydrophobicContact CE2-CD1 4.14Å; F32-F142 AromaticContact CE2-CE1 3.79Å; F32-F142 HydrophobicContact CE2-CE1 3.79Å; F32-F142 AromaticContact CZ-CD1 3.58Å; F32-F142 HydrophobicContact CZ-CD1 3.58Å; F32-F142 AromaticContact CZ-CE1 3.72Å; F32-F142 HydrophobicContact CZ-CE1 3.72Å; L138-F142 WeakPolarHBondContact O-CB 3.44Å; L138-F142 PolarHBondContact O-N 3.35Å; S139-F142 PolarHBondContact O-N 2.89Å; F142-L144 VanDerWaalsContact C-N 3.29Å; F142-L144 PolarHBondContact O-N 2.8Å; F142-V145 PolarHBondContact O-N 3.26Å; F142-Y146 HydrophobicContact CE1-CD1 4.31Å; F142-Y146 HydrophobicContact CE1-CD2 4.13Å; F142-Y146 AromaticContact CE1-CG 3.88Å; F142-Y146 HydrophobicContact CE1-CG 3.88Å; F142-Y146 HydrophobicContact CE2-CD2 4.23Å; F142-Y146 HydrophobicContact CE2-CG 4.46Å; F142-Y146 AromaticContact CZ-CD2 3.56Å; F142-Y146 HydrophobicContact CZ-CD2 3.56Å; F142-Y146 HydrophobicContact CZ-CE2 4.23Å; F142-Y146 AromaticContact CZ-CG 3.76Å; F142-Y146 HydrophobicContact CZ-CG 3.76Å; F142-Y146 WeakPolarHBondContact O-CB 3.4Å; F142-Y146 PolarHBondContact O-N 3.36Å
143S95.4Very high94.9Very high18 Ų1857.3 Ų57.313%0.12633%0.326CS..Hα-helixtrans-62.6-33.8-178.968.80000112.8F123 S139 K140 G147F123-S143 WeakPolarHBondContact CZ-O 3.13Å; S139-S143 WeakPolarHBondContact O-CB 3.35Å; S139-S143 PolarHBondContact O-N 2.9Å; S139-S143 PolarHBondContact O-OG 3.15Å; K140-S143 PolarHBondContact O-N 3.46Å; K140-S143 PolarHBondContact O-OG 3.31Å; S143-G147 WeakPolarHBondContact O-CA 3.38Å; S143-G147 PolarHBondContact O-N 3.4Å
144L95.1Very high95Very high133 Ų13355.4 Ų55.470%0.69631%0.314SS*.Hα-helixtrans-62.2-48.7175-65.9173.4000111.9K140 A141 F142 L148K140-L144 WeakPolarHBondContact O-CG 3.36Å; K140-L144 PolarHBondContact O-N 2.94Å; A141-L144 PolarHBondContact O-N 2.82Å; F142-L144 VanDerWaalsContact C-N 3.29Å; F142-L144 PolarHBondContact O-N 2.8Å; L144-L148 PolarHBondContact O-N 2.88Å
145V95.9Very high95Very high100 Ų10058.6 Ų58.661%0.60633%0.33SS*.Hα-helixtrans-72.1-43-178.8-1800000110.9A141 F142 L148A141-V145 PolarHBondContact O-N 2.96Å; F142-V145 PolarHBondContact O-N 3.26Å; V145-L148 PolarHBondContact O-N 3.33Å
146Y96.1Very high95.2Very high9 Ų960.6 Ų60.64%0.03534%0.341CS..Hα-helixtrans-66-41.6-180-177.4-102.5000111.6Y24 F27 F32 T120 F123 L124 F142 L148 I149 G150Y24-Y146 VanDerWaalsContact C-OH 3.32Å; Y24-Y146 AromaticContact CD1-CE2 3.9Å; Y24-Y146 HydrophobicContact CD1-CE2 3.9Å; Y24-Y146 AromaticContact CD1-CZ 3.65Å; Y24-Y146 VanDerWaalsContact CD1-OH 3.23Å; Y24-Y146 WeakPolarHBondContact CD1-OH 3.08Å; Y24-Y146 HydrophobicContact CD2-CE2 4.41Å; Y24-Y146 AromaticContact CE1-CD2 3.95Å; Y24-Y146 HydrophobicContact CE1-CD2 3.95Å; Y24-Y146 AromaticContact CE1-CE1 3.89Å; Y24-Y146 HydrophobicContact CE1-CE1 3.89Å; Y24-Y146 AromaticContact CE1-CE2 3.26Å; Y24-Y146 HydrophobicContact CE1-CE2 3.26Å; Y24-Y146 AromaticContact CE1-CZ 3.21Å; Y24-Y146 WeakPolarHBondContact CE1-OH 3.26Å; Y24-Y146 HydrophobicContact CE2-CD2 4.38Å; Y24-Y146 AromaticContact CE2-CE2 3.86Å; Y24-Y146 HydrophobicContact CE2-CE2 3.86Å; Y24-Y146 HydrophobicContact CG-CE2 4.43Å; Y24-Y146 AromaticContact CZ-CD2 3.63Å; Y24-Y146 AromaticContact CZ-CE2 3.24Å; Y24-Y146 AromaticContact CZ-CZ 3.76Å; Y24-Y146 PolarHBondContact O-OH 2.9Å; Y24-Y146 VanDerWaalsContact OH-CD2 3.26Å; Y24-Y146 WeakPolarHBondContact OH-CD2 3.32Å; Y24-Y146 WeakPolarHBondContact OH-CE2 3.23Å; Y24-Y146 PolarHBondContact OH-O 3.12Å; F27-Y146 HydrophobicContact CD1-CE2 4.47Å; F32-Y146 HydrophobicContact CE2-CD1 4.33Å; F32-Y146 HydrophobicContact CE2-CE1 4.46Å; T120-Y146 HydrophobicContact CG2-CE1 3.75Å; F123-Y146 HydrophobicContact CD1-CD1 4.44Å; F123-Y146 AromaticContact CE1-CD1 3.98Å; F123-Y146 HydrophobicContact CE1-CD1 3.98Å; L124-Y146 HydrophobicContact CD1-CE1 3.86Å; L124-Y146 HydrophobicContact CD2-CD1 4.15Å; L124-Y146 HydrophobicContact CD2-CE1 3.81Å; L124-Y146 HydrophobicContact CG-CE1 4.04Å; F142-Y146 HydrophobicContact CE1-CD1 4.31Å; F142-Y146 HydrophobicContact CE1-CD2 4.13Å; F142-Y146 AromaticContact CE1-CG 3.88Å; F142-Y146 HydrophobicContact CE1-CG 3.88Å; F142-Y146 HydrophobicContact CE2-CD2 4.23Å; F142-Y146 HydrophobicContact CE2-CG 4.46Å; F142-Y146 AromaticContact CZ-CD2 3.56Å; F142-Y146 HydrophobicContact CZ-CD2 3.56Å; F142-Y146 HydrophobicContact CZ-CE2 4.23Å; F142-Y146 AromaticContact CZ-CG 3.76Å; F142-Y146 HydrophobicContact CZ-CG 3.76Å; F142-Y146 WeakPolarHBondContact O-CB 3.4Å; F142-Y146 PolarHBondContact O-N 3.36Å; Y146-L148 PolarHBondContact O-N 3.25Å; Y146-I149 PolarHBondContact O-N 3.29Å; Y146-G150 PolarHBondContact O-N 2.89Å
147G95.6Very high95.2Very high4 Ų460 Ų604%0.04134%0.336CS..Hα-helixtrans-63.5-36.6176.900000113.9S143 I149 G150 I151S143-G147 WeakPolarHBondContact O-CA 3.38Å; S143-G147 PolarHBondContact O-N 3.4Å; G147-I149 PolarHBondContact O-N 3.38Å; G147-G150 PolarHBondContact O-N 3.45Å; G147-I151 WeakPolarHBondContact O-CB 3.47Å; G147-I151 VanDerWaalsContact O-CG1 3.29Å; G147-I151 WeakPolarHBondContact O-CG1 3.41Å; G147-I151 PolarHBondContact O-N 2.88Å
148L95.9Very high95.2Very high135 Ų13556.5 Ų56.571%0.70731%0.306SS*.Hα-helixtrans-59.2-36-179.9-175.466.4000112.8L144 V145 Y146 P152L144-L148 PolarHBondContact O-N 2.88Å; V145-L148 PolarHBondContact O-N 3.33Å; Y146-L148 PolarHBondContact O-N 3.25Å; L148-P152 VanDerWaalsContact O-CD 3.25Å; L148-P152 WeakPolarHBondContact O-CD 3.44Å; L148-P152 WeakPolarHBondContact O-CG 3.49Å
149I95.3Very high95Very high107 Ų10753.5 Ų53.555%0.54929%0.293SS..Hα-helixtrans-91.4-42.6178.8-59.9173.9000110.4Y146 G147 L153Y146-I149 PolarHBondContact O-N 3.29Å; G147-I149 PolarHBondContact O-N 3.38Å; I149-L153 WeakPolarHBondContact O-CB 3.41Å; I149-L153 PolarHBondContact O-N 3.29Å
150G95.8Very high94.8Very high0 Ų055.3 Ų55.30%030%0.302CS..Hα-helixtrans-69.4-41.2-173.400000114.4Y24 Y146 G147 L153 I154Y24-G150 PolarHBondContact OH-N 2.85Å; Y146-G150 PolarHBondContact O-N 2.89Å; G147-G150 PolarHBondContact O-N 3.45Å; G150-L153 WeakPolarHBondContact O-CB 3.47Å; G150-L153 PolarHBondContact O-N 3.21Å; G150-I154 WeakPolarHBondContact O-CG1 3.49Å; G150-I154 PolarHBondContact O-N 3.44Å
151I96.2Very high94.6Very high48 Ų4851.1 Ų51.125%0.24629%0.285CS..Hα-helixtrans-63.3-51.2-177.1-65.5165.8000110.9L124 T126 G147 L153 I154 L155L124-I151 HydrophobicContact CD2-CG1 4.42Å; T126-I151 HydrophobicContact CG2-CD1 4.37Å; T126-I151 HydrophobicContact CG2-CG1 4.29Å; T126-I151 HydrophobicContact CG2-CG2 3.67Å; G147-I151 WeakPolarHBondContact O-CB 3.47Å; G147-I151 VanDerWaalsContact O-CG1 3.29Å; G147-I151 WeakPolarHBondContact O-CG1 3.41Å; G147-I151 PolarHBondContact O-N 2.88Å; I151-L153 VanDerWaalsContact C-N 3.3Å; I151-L153 PolarHBondContact O-N 3Å; I151-I154 PolarHBondContact O-N 3.44Å; I151-L155 HydrophobicContact CG2-CD1 3.93Å; I151-L155 HydrophobicContact CG2-CG 4.35Å; I151-L155 WeakPolarHBondContact O-CB 3.31Å; I151-L155 WeakPolarHBondContact O-CG 3.3Å; I151-L155 PolarHBondContact O-N 2.99Å
152P96Very high94.4Very high64 Ų6448.7 Ų48.742%0.41627%0.265SS..Hα-helixtrans-58.5-40.6174.4-25.435000113.2L148 L155 I156L148-P152 VanDerWaalsContact O-CD 3.25Å; L148-P152 WeakPolarHBondContact O-CD 3.44Å; L148-P152 WeakPolarHBondContact O-CG 3.49Å; P152-L155 PolarHBondContact O-N 3.31Å; P152-I156 WeakPolarHBondContact O-CD1 3.44Å; P152-I156 VanDerWaalsContact O-CG1 3.23Å; P152-I156 WeakPolarHBondContact O-CG1 3.32Å; P152-I156 PolarHBondContact O-N 3.5Å
153L94.9Very high93.9Very high38 Ų3849.4 Ų49.420%0.19927%0.268CS..Hα-helixtrans-59.1-50.6177.8177.665.7000111.2L17 Y24 I149 G150 I151 I156 T157L17-L153 HydrophobicContact CD1-CD1 4.25Å; Y24-L153 HydrophobicContact CD1-CD2 4.29Å; Y24-L153 HydrophobicContact CD2-CD2 4.33Å; Y24-L153 HydrophobicContact CG-CD2 4.04Å; I149-L153 WeakPolarHBondContact O-CB 3.41Å; I149-L153 PolarHBondContact O-N 3.29Å; G150-L153 WeakPolarHBondContact O-CB 3.47Å; G150-L153 PolarHBondContact O-N 3.21Å; I151-L153 VanDerWaalsContact C-N 3.3Å; I151-L153 PolarHBondContact O-N 3Å; L153-I156 PolarHBondContact O-N 3.33Å; L153-T157 PolarHBondContact O-N 2.93Å; L153-T157 PolarHBondContact O-OG1 2.94Å
154I94.7Very high93.5Very high6 Ų651.9 Ų51.93%0.03128%0.277CS..Hα-helixtrans-65.5-40.3179.5-66.4-49.2000111.7I25 L124 T125 G150 I151 I156 T157 I158I25-I154 HydrophobicContact CD1-CD1 4.27Å; L124-I154 HydrophobicContact CB-CB 4.46Å; L124-I154 HydrophobicContact CB-CG1 3.71Å; L124-I154 HydrophobicContact CD1-CG1 4.06Å; L124-I154 HydrophobicContact CG-CG1 4.49Å; T125-I154 HydrophobicContact CG2-CG2 3.96Å; G150-I154 WeakPolarHBondContact O-CG1 3.49Å; G150-I154 PolarHBondContact O-N 3.44Å; I151-I154 PolarHBondContact O-N 3.44Å; I154-I156 PolarHBondContact O-N 3.26Å; I154-T157 WeakPolarHBondContact O-CB 3.47Å; I154-T157 PolarHBondContact O-N 3.47Å; I154-I158 HydrophobicContact CG2-CD1 3.63Å; I154-I158 HydrophobicContact CG2-CG1 4.16Å; I154-I158 WeakPolarHBondContact O-CG1 3.29Å; I154-I158 PolarHBondContact O-N 3.49Å
155L93.7Very high93.1Very high84 Ų8448 Ų4844%0.4426%0.257SS..Hα-helixtrans-60.9-43176-73174.5000112.3I151 P152 T157 I158 T159I151-L155 HydrophobicContact CG2-CD1 3.93Å; I151-L155 HydrophobicContact CG2-CG 4.35Å; I151-L155 WeakPolarHBondContact O-CB 3.31Å; I151-L155 WeakPolarHBondContact O-CG 3.3Å; I151-L155 PolarHBondContact O-N 2.99Å; P152-L155 PolarHBondContact O-N 3.31Å; L155-T157 VanDerWaalsContact C-N 3.34Å; L155-I158 PolarHBondContact O-N 3.48Å; L155-T159 WeakPolarHBondContact O-CB 3.42Å; L155-T159 PolarHBondContact O-N 3.34Å; L155-T159 PolarHBondContact O-OG1 3.49Å
156I93.1Very high92.7Very high105 Ų10543.3 Ų43.354%0.53823%0.228SC..Hα-helixtrans-63.1-43.6175.1-66.8165.7000110L17 P152 L153 I154 T159 N160L17-I156 HydrophobicContact CD2-CG2 4.13Å; P152-I156 WeakPolarHBondContact O-CD1 3.44Å; P152-I156 VanDerWaalsContact O-CG1 3.23Å; P152-I156 WeakPolarHBondContact O-CG1 3.32Å; P152-I156 PolarHBondContact O-N 3.5Å; L153-I156 PolarHBondContact O-N 3.33Å; I154-I156 PolarHBondContact O-N 3.26Å; I156-T159 PolarHBondContact O-N 3.04Å; I156-N160 WeakPolarHBondContact O-CB 3.43Å; I156-N160 PolarHBondContact O-N 3.04Å
157T93.8Very high92.2Very high8 Ų847 Ų475%0.04925%0.245CC..Hα-helixtrans-60.1-50.3177.3-57.70000111.9L17 V18 S21 L153 I154 L155 T159 N160 S161L17-T157 HydrophobicContact CD2-CG2 4.49Å; L17-T157 HydrophobicContact CG-CG2 4.31Å; L17-T157 WeakPolarHBondContact CG-OG1 3.39Å; V18-T157 HydrophobicContact CB-CG2 4.46Å; V18-T157 HydrophobicContact CG2-CG2 3.82Å; S21-T157 PolarHBondContact OG-OG1 3.19Å; L153-T157 PolarHBondContact O-N 2.93Å; L153-T157 PolarHBondContact O-OG1 2.94Å; I154-T157 WeakPolarHBondContact O-CB 3.47Å; I154-T157 PolarHBondContact O-N 3.47Å; L155-T157 VanDerWaalsContact C-N 3.34Å; T157-T159 PolarHBondContact O-N 2.87Å; T157-N160 PolarHBondContact O-N 3.19Å; T157-S161 WeakPolarHBondContact O-CB 3.48Å; T157-S161 PolarHBondContact O-N 3.37Å; T157-S161 PolarHBondContact O-OG 3.06Å; T157-S161 VanDerWaalsContact O-OG 3.09Å
158I93.9Very high91.7Very high10 Ų1049.6 Ų49.65%0.05126%0.263CS..Hα-helixtrans-61-45.2179-68.6170.2000110.6T125 I154 L155 S161 G162 L300 T304T125-I158 HydrophobicContact CG2-CD1 4.33Å; I154-I158 HydrophobicContact CG2-CD1 3.63Å; I154-I158 HydrophobicContact CG2-CG1 4.16Å; I154-I158 WeakPolarHBondContact O-CG1 3.29Å; I154-I158 PolarHBondContact O-N 3.49Å; L155-I158 PolarHBondContact O-N 3.48Å; I158-S161 PolarHBondContact O-N 3.34Å; I158-G162 PolarHBondContact O-N 3.12Å; I158-L300 HydrophobicContact CD1-CB 4.2Å; I158-L300 HydrophobicContact CD1-CD1 3.88Å; I158-L300 HydrophobicContact CG2-CB 4.23Å; I158-T304 HydrophobicContact CG2-CG2 4.5Å; I158-T304 WeakPolarHBondContact CG2-OG1 3.36Å
159T91.5Very high91.2Very high52 Ų5244.6 Ų44.632%0.31924%0.236SC..Hα-helixtrans-62.8-45.7179.5-54.80000111.4L155 I156 T157 G162 K163L155-T159 WeakPolarHBondContact O-CB 3.42Å; L155-T159 PolarHBondContact O-N 3.34Å; L155-T159 PolarHBondContact O-OG1 3.49Å; I156-T159 PolarHBondContact O-N 3.04Å; T157-T159 PolarHBondContact O-N 2.87Å; T159-G162 PolarHBondContact O-N 3.11Å; T159-K163 WeakPolarHBondContact O-CG 3.25Å; T159-K163 PolarHBondContact O-N 2.63Å
160N91Very high90.8Very high41 Ų4139.7 Ų39.722%0.21921%0.211CC..Hα-helixtrans-65.2-42.7179.2-170.236.1000111.9H14 L17 I156 T157 K163 F164H14-N160 PolarHBondContact CE1-OD1 3.43Å; H14-N160 PolarHBondContact ND1-ND2 3.07Å; H14-N160 PolarHBondContact ND1-OD1 3.2Å; L17-N160 HydrophobicContact CD2-CB 4.19Å; I156-N160 WeakPolarHBondContact O-CB 3.43Å; I156-N160 PolarHBondContact O-N 3.04Å; T157-N160 PolarHBondContact O-N 3.19Å; N160-K163 PolarHBondContact O-N 3.13Å; N160-F164 PolarHBondContact O-N 3.35Å
161S90.7Very high90.3Very high11 Ų1142.8 Ų42.88%0.07723%0.23CC..Hα-helixtrans-68.2-35.4175.1-64.50000112.7V18 T157 I158 F164 L165 M301V18-S161 WeakPolarHBondContact CG2-OG 3.3Å; T157-S161 WeakPolarHBondContact O-CB 3.48Å; T157-S161 PolarHBondContact O-N 3.37Å; T157-S161 PolarHBondContact O-OG 3.06Å; T157-S161 VanDerWaalsContact O-OG 3.09Å; I158-S161 PolarHBondContact O-N 3.34Å; S161-F164 PolarHBondContact O-N 3.15Å; S161-L165 WeakPolarHBondContact O-CB 3.24Å; S161-L165 PolarHBondContact O-N 3.06Å; S161-M301 VanDerWaalsContact CB-SD 3.55Å
162G90.5Very high89.8Confident1 Ų143.3 Ų43.31%0.0124%0.242CC..Hα-helixtrans-63-42174.700000112.4I158 T159 L165 G166I158-G162 PolarHBondContact O-N 3.12Å; T159-G162 PolarHBondContact O-N 3.11Å; G162-L165 PolarHBondContact O-N 2.96Å; G162-G166 PolarHBondContact O-N 2.87Å
163K86.8Confident89.3Confident64 Ų6443.7 Ų43.728%0.27824%0.235SC..Hα-helixtrans-59.6-47.7172.8-72.2-178.6173-169.80112T159 N160 L165 G166 E167 V226 L228T159-K163 WeakPolarHBondContact O-CG 3.25Å; T159-K163 PolarHBondContact O-N 2.63Å; N160-K163 PolarHBondContact O-N 3.13Å; K163-L165 PolarHBondContact O-N 2.98Å; K163-G166 WeakPolarHBondContact O-CA 3.35Å; K163-G166 PolarHBondContact O-N 3.43Å; K163-G166 VanDerWaalsContact O-N 3.12Å; K163-E167 PolarHBondContact O-N 3.34Å; K163-V226 PolarHBondContact NZ-O 3.16Å; K163-L228 HydrophobicContact CG-CD2 4.26Å
164F86.6Confident88.7Confident70 Ų7046 Ų4631%0.30725%0.248SC..Hα-helixtrans-58.7-45.4175.9176.2-103.5000112.2I11 N160 S161 G166 E167 C168I11-F164 HydrophobicContact CG1-CE2 3.97Å; I11-F164 HydrophobicContact CG1-CZ 4.38Å; N160-F164 PolarHBondContact O-N 3.35Å; S161-F164 PolarHBondContact O-N 3.15Å; F164-G166 VanDerWaalsContact C-N 3.26Å; F164-G166 PolarHBondContact O-N 3.24Å; F164-E167 PolarHBondContact O-N 2.82Å; F164-C168 PolarHBondContact O-N 3.39Å; F164-C168 PolarHBondContact O-SG 2.67Å
165L88Confident88Confident52 Ų5251.8 Ų51.827%0.27228%0.276SS..Hα-helixtrans-62.4-36.6176.3-171.961.4000111.8S161 G162 K163 C168 M169 M301 L302S161-L165 WeakPolarHBondContact O-CB 3.24Å; S161-L165 PolarHBondContact O-N 3.06Å; G162-L165 PolarHBondContact O-N 2.96Å; K163-L165 PolarHBondContact O-N 2.98Å; L165-C168 WeakPolarHBondContact O-CB 3.36Å; L165-C168 PolarHBondContact O-N 3.49Å; L165-M169 PolarHBondContact O-N 3.35Å; L165-M301 HydrophobicContact CD2-CB 4.22Å; L165-L302 HydrophobicContact CD2-CD2 3.39Å; L165-L302 HydrophobicContact CD2-CG 3.59Å; L165-L302 HydrophobicContact CG-CD2 4.17Å
166G86.8Confident87.1Confident0 Ų050 Ų500%028%0.278CS..Hα-helixtrans-63.5-45.1173.800000113.3G162 K163 F164 C168 M169 V170 M305G162-G166 PolarHBondContact O-N 2.87Å; K163-G166 WeakPolarHBondContact O-CA 3.35Å; K163-G166 PolarHBondContact O-N 3.43Å; K163-G166 VanDerWaalsContact O-N 3.12Å; F164-G166 VanDerWaalsContact C-N 3.26Å; F164-G166 PolarHBondContact O-N 3.24Å; G166-C168 VanDerWaalsContact C-N 3.3Å; G166-C168 PolarHBondContact O-N 2.78Å; G166-M169 CarbonylContact O-C 3.16Å; G166-M169 WeakPolarHBondContact O-CA 3.15Å; G166-M169 WeakPolarHBondContact O-CB 3.45Å; G166-M169 PolarHBondContact O-N 3.42Å; G166-M169 VanDerWaalsContact O-N 3.09Å; G166-V170 WeakPolarHBondContact O-CG2 3.43Å; G166-V170 PolarHBondContact O-N 3.04Å; G166-M305 WeakPolarHBondContact CA-SD 3.23Å
167E84.6Confident85.8Confident86 Ų8646.5 Ų46.540%0.40226%0.262SS..Hα-helixtrans-60.7-39.6174.3-69.9177.5-17100111.7K163 F164 M169 V170 T171K163-E167 PolarHBondContact O-N 3.34Å; F164-E167 PolarHBondContact O-N 2.82Å; E167-M169 VanDerWaalsContact C-N 3.35Å; E167-V170 PolarHBondContact O-N 3.33Å; E167-T171 WeakPolarHBondContact O-CB 3.36Å; E167-T171 PolarHBondContact O-N 3.5Å; E167-T171 PolarHBondContact O-OG1 2.84Å
168C85Confident84.4Confident60 Ų6048.5 Ų48.541%0.40528%0.277SS..Hα-helixtrans-61.2-43.3172.1-69.60000111.5F164 L165 G166 T171 A172F164-C168 PolarHBondContact O-N 3.39Å; F164-C168 PolarHBondContact O-SG 2.67Å; L165-C168 WeakPolarHBondContact O-CB 3.36Å; L165-C168 PolarHBondContact O-N 3.49Å; G166-C168 VanDerWaalsContact C-N 3.3Å; G166-C168 PolarHBondContact O-N 2.78Å; C168-T171 PolarHBondContact O-N 3.07Å; C168-A172 WeakPolarHBondContact O-CB 3.36Å; C168-A172 PolarHBondContact O-N 3.01Å
169M87Confident82.7Confident30 Ų3051.1 Ų51.115%0.14830%0.296CS..Hα-helixtrans-64.8-42176.6-177.4-173.265.100112L165 G166 E167 T171 A172 Y173 F231 I234 V239 V242 M305L165-M169 PolarHBondContact O-N 3.35Å; G166-M169 CarbonylContact O-C 3.16Å; G166-M169 WeakPolarHBondContact O-CA 3.15Å; G166-M169 WeakPolarHBondContact O-CB 3.45Å; G166-M169 PolarHBondContact O-N 3.42Å; G166-M169 VanDerWaalsContact O-N 3.09Å; E167-M169 VanDerWaalsContact C-N 3.35Å; M169-T171 VanDerWaalsContact C-N 3.34Å; M169-A172 PolarHBondContact O-N 2.99Å; M169-Y173 WeakPolarHBondContact O-CB 3.19Å; M169-Y173 PolarHBondContact O-N 3.36Å; M169-F231 HydrophobicContact CE-CE1 4.35Å; M169-I234 HydrophobicContact CE-CD1 4.39Å; M169-I234 HydrophobicContact CE-CG2 4.47Å; M169-V239 HydrophobicContact CE-CG2 3.51Å; M169-V239 HydrophobicContact SD-CG2 4.12Å; M169-V242 HydrophobicContact SD-CG2 4.4Å; M169-M305 HydrophobicContact CE-CE 3.44Å; M169-M305 VanDerWaalsContact CE-CE 3.44Å; M169-M305 HydrophobicContact CE-SD 4Å; M169-M305 HydrophobicContact SD-CE 3.75Å
170V86.6Confident81.2Confident4 Ų456.6 Ų56.62%0.02432%0.315CS..Hα-helixtrans-59.9-47.5175177.40000110G166 E167 A172 Y173 N174 E230 F231 I234G166-V170 WeakPolarHBondContact O-CG2 3.43Å; G166-V170 PolarHBondContact O-N 3.04Å; E167-V170 PolarHBondContact O-N 3.33Å; V170-A172 PolarHBondContact O-N 3.14Å; V170-Y173 PolarHBondContact O-N 3.23Å; V170-N174 WeakPolarHBondContact CG1-ND2 3.46Å; V170-N174 WeakPolarHBondContact O-CB 3.19Å; V170-N174 VanDerWaalsContact O-CG 3.3Å; V170-N174 PolarHBondContact O-N 2.78Å; V170-N174 PolarHBondContact O-ND2 3.39Å; V170-E230 HydrophobicContact CG1-CB 4.26Å; V170-F231 HydrophobicContact CG2-CD1 3.61Å; V170-F231 HydrophobicContact CG2-CD2 4.33Å; V170-F231 HydrophobicContact CG2-CE1 3.44Å; V170-F231 VanDerWaalsContact CG2-CE1 3.44Å; V170-F231 HydrophobicContact CG2-CE2 4.17Å; V170-F231 HydrophobicContact CG2-CG 4.08Å; V170-F231 HydrophobicContact CG2-CZ 3.75Å; V170-I234 HydrophobicContact CB-CD1 3.81Å; V170-I234 HydrophobicContact CG1-CD1 4.09Å; V170-I234 HydrophobicContact CG2-CD1 3.2Å
171T83.9Confident79.5Confident65 Ų6558.2 Ų58.240%0.39932%0.324SS..Hα-helixtrans-60.1-46.3177.8-60.70000110.8E167 C168 M169 N174 M175E167-T171 WeakPolarHBondContact O-CB 3.36Å; E167-T171 PolarHBondContact O-N 3.5Å; E167-T171 PolarHBondContact O-OG1 2.84Å; C168-T171 PolarHBondContact O-N 3.07Å; M169-T171 VanDerWaalsContact C-N 3.34Å; T171-N174 PolarHBondContact O-N 2.74Å; T171-M175 HydrophobicContact CG2-CE 3.41Å; T171-M175 VanDerWaalsContact CG2-CE 3.41Å; T171-M175 HydrophobicContact CG2-CG 4.5Å; T171-M175 HydrophobicContact CG2-SD 4.01Å; T171-M175 WeakPolarHBondContact O-CB 3.49Å; T171-M175 VanDerWaalsContact O-CG 3.23Å; T171-M175 WeakPolarHBondContact O-CG 3.27Å; T171-M175 PolarHBondContact O-N 3.37Å
172A86.1Confident77.8Confident59 Ų5965.7 Ų65.749%0.48835%0.35SS..Hα-helixtrans-63.5-42.717700000112.4C168 M169 V170 M175 G176C168-A172 WeakPolarHBondContact O-CB 3.36Å; C168-A172 PolarHBondContact O-N 3.01Å; M169-A172 PolarHBondContact O-N 2.99Å; V170-A172 PolarHBondContact O-N 3.14Å; A172-M175 PolarHBondContact O-N 2.92Å; A172-G176 PolarHBondContact O-N 3.32Å
173Y85.8Confident76.3Confident72 Ų7275.1 Ų75.128%0.28239%0.385SS..Hα-helixtrans-61.2-45.9175.7177.9-102.7000111.5M169 V170 G176 C177 I234 L238M169-Y173 WeakPolarHBondContact O-CB 3.19Å; M169-Y173 PolarHBondContact O-N 3.36Å; V170-Y173 PolarHBondContact O-N 3.23Å; Y173-G176 PolarHBondContact O-N 3.49Å; Y173-C177 VanDerWaalsContact O-CB 3.3Å; Y173-C177 WeakPolarHBondContact O-CB 3.45Å; Y173-C177 PolarHBondContact O-N 3.27Å; Y173-C177 PolarHBondContact O-SG 3.49Å; Y173-I234 HydrophobicContact CD1-CG1 4.33Å; Y173-L238 HydrophobicContact CD2-CD2 3.46Å; Y173-L238 VanDerWaalsContact CD2-CD2 3.46Å; Y173-L238 HydrophobicContact CE2-CD2 3.81Å; Y173-L238 HydrophobicContact CG-CD2 4.24Å
174N81.9Confident75.3Confident87 Ų8777.3 Ų77.347%0.46540%0.399SS..Hα-helixtrans-66.8-37.8178.1-74-28.3000112.2V170 T171 S178V170-N174 WeakPolarHBondContact CG1-ND2 3.46Å; V170-N174 WeakPolarHBondContact O-CB 3.19Å; V170-N174 VanDerWaalsContact O-CG 3.3Å; V170-N174 PolarHBondContact O-N 2.78Å; V170-N174 PolarHBondContact O-ND2 3.39Å; T171-N174 PolarHBondContact O-N 2.74Å; N174-S178 WeakPolarHBondContact O-CB 3.22Å; N174-S178 PolarHBondContact O-N 3.35Å
175M81.7Confident74.2Confident127 Ų12776.2 Ų76.263%0.62640%0.398SS*.Hα-helixtrans-67.5-44.6173.8-74.2176.6-178.400112.2T171 A172 S178 S179T171-M175 HydrophobicContact CG2-CE 3.41Å; T171-M175 VanDerWaalsContact CG2-CE 3.41Å; T171-M175 HydrophobicContact CG2-CG 4.5Å; T171-M175 HydrophobicContact CG2-SD 4.01Å; T171-M175 WeakPolarHBondContact O-CB 3.49Å; T171-M175 VanDerWaalsContact O-CG 3.23Å; T171-M175 WeakPolarHBondContact O-CG 3.27Å; T171-M175 PolarHBondContact O-N 3.37Å; A172-M175 PolarHBondContact O-N 2.92Å; M175-S178 WeakPolarHBondContact O-CB 3.46Å; M175-S178 PolarHBondContact O-N 3.21Å; M175-S179 PolarHBondContact O-N 2.9Å
176G74.4Confident72.9Confident46 Ų4677.7 Ų77.747%0.47441%0.412SS..Hα-helixtrans-62.2-46.5176.800000111.9A172 Y173 S178 S179A172-G176 PolarHBondContact O-N 3.32Å; Y173-G176 PolarHBondContact O-N 3.49Å; G176-S178 VanDerWaalsContact C-N 3.33Å; G176-S178 PolarHBondContact O-N 3.32Å; G176-S179 PolarHBondContact O-N 3.12Å; G176-S179 PolarHBondContact O-OG 3.27Å; G176-S179 VanDerWaalsContact O-OG 3.08Å
177C65Low71.7Confident31 Ų3186.8 Ų86.821%0.20945%0.446CS..Hα-helixtrans-64.9-35.3172.5-76.40000111.9Y173 S179 L181 R182Y173-C177 VanDerWaalsContact O-CB 3.3Å; Y173-C177 WeakPolarHBondContact O-CB 3.45Å; Y173-C177 PolarHBondContact O-N 3.27Å; Y173-C177 PolarHBondContact O-SG 3.49Å; C177-S179 VanDerWaalsContact C-N 3.31Å; C177-S179 PolarHBondContact O-N 3.3Å; C177-L181 HydrophobicContact CB-CB 4.01Å; C177-L181 HydrophobicContact CB-CD2 4.04Å; C177-L181 CarbonylContact O-C 3.58Å; C177-L181 VanDerWaalsContact O-C 3.3Å; C177-L181 WeakPolarHBondContact O-CA 3.37Å; C177-L181 WeakPolarHBondContact O-CB 3.37Å; C177-L181 PolarHBondContact O-N 2.85Å; C177-R182 PolarHBondContact O-N 3.38Å
178S65.2Low70.8Confident51 Ų5189 Ų8936%0.35746%0.455SS..Hα-helixtrans-60.4-37.71801750000113N174 M175 G176 R182N174-S178 WeakPolarHBondContact O-CB 3.22Å; N174-S178 PolarHBondContact O-N 3.35Å; M175-S178 WeakPolarHBondContact O-CB 3.46Å; M175-S178 PolarHBondContact O-N 3.21Å; G176-S178 VanDerWaalsContact C-N 3.33Å; G176-S178 PolarHBondContact O-N 3.32Å; S178-R182 WeakPolarHBondContact O-CB 3.18Å
179S58.1Low69.6Low65 Ų6592.9 Ų92.946%0.45547%0.465SS..Hα-helixtrans-76.4-40.5-172.566.10000114.1M175 G176 C177M175-S179 PolarHBondContact O-N 2.9Å; G176-S179 PolarHBondContact O-N 3.12Å; G176-S179 PolarHBondContact O-OG 3.27Å; G176-S179 VanDerWaalsContact O-OG 3.08Å; C177-S179 VanDerWaalsContact C-N 3.31Å; C177-S179 PolarHBondContact O-N 3.3Å
180K58.6Low68.4Low167 Ų167100 Ų10073%0.72649%0.49SS*.Hα-helixtrans-113.3-40.6-176.8-66.8-179.1-178.1175.90112.9
181L55.3Low67.2Low75 Ų75106.1 Ų106.139%0.39352%0.52SS..Hα-helixtrans-80.5-30.2-177.1-158.372.1000112C177 R183 L184 V185C177-L181 HydrophobicContact CB-CB 4.01Å; C177-L181 HydrophobicContact CB-CD2 4.04Å; C177-L181 CarbonylContact O-C 3.58Å; C177-L181 VanDerWaalsContact O-C 3.3Å; C177-L181 WeakPolarHBondContact O-CA 3.37Å; C177-L181 WeakPolarHBondContact O-CB 3.37Å; C177-L181 PolarHBondContact O-N 2.85Å; L181-R183 VanDerWaalsContact C-N 3.3Å; L181-R183 PolarHBondContact O-N 2.9Å; L181-L184 CarbonylContact O-C 3.55Å; L181-L184 PolarHBondContact O-N 3.46Å; L181-V185 HydrophobicContact CD1-CG2 4.08Å; L181-V185 HydrophobicContact CD2-CG2 4.1Å; L181-V185 HydrophobicContact CG-CG2 3.57Å; L181-V185 WeakPolarHBondContact O-CA 3.05Å; L181-V185 WeakPolarHBondContact O-CB 3.3Å; L181-V185 WeakPolarHBondContact O-CG2 3.44Å; L181-V185 PolarHBondContact O-N 3.36Å
182R56.1Low66.3Low168 Ų168106.6 Ų106.663%0.63452%0.518SS*.Hα-helixtrans-62.3-35.5175.6-156.3174.9-175.5-164.70.5112.5C177 S178 C186C177-R182 PolarHBondContact O-N 3.38Å; S178-R182 WeakPolarHBondContact O-CB 3.18Å; R182-C186 WeakPolarHBondContact O-CB 3.47Å; R182-C186 PolarHBondContact O-N 3.1Å; R182-C186 PolarHBondContact O-SG 2.88Å
183R59.6Low65Low198 Ų198111.1 Ų111.175%0.74753%0.526SS*.Hα-helixtrans-69.8-41.6174-62.7-171.7-153.1-174.64.2111.7L181 R187L181-R183 VanDerWaalsContact C-N 3.3Å; L181-R183 PolarHBondContact O-N 2.9Å; R183-R187 WeakPolarHBondContact O-CB 3.3Å; R183-R187 WeakPolarHBondContact O-CG 3.23Å; R183-R187 PolarHBondContact O-N 3.04Å
184L65.3Low63.8Low110 Ų110113 Ų11358%0.57654%0.537SS*.Hα-helixtrans-76.5-35.9-179.3-70.3169.5000113L181 R187 K188L181-L184 CarbonylContact O-C 3.55Å; L181-L184 PolarHBondContact O-N 3.46Å; L184-R187 PolarHBondContact O-N 3.2Å; L184-K188 VanDerWaalsContact O-CB 3.25Å; L184-K188 WeakPolarHBondContact O-CB 3.45Å; L184-K188 PolarHBondContact O-N 3.07Å
185V63.1Low62.7Low47 Ų47117.1 Ų117.129%0.28555%0.547SS..Hα-helixtrans-78.2-37.21781680000111.1L181 R187 K188 K189L181-V185 HydrophobicContact CD1-CG2 4.08Å; L181-V185 HydrophobicContact CD2-CG2 4.1Å; L181-V185 HydrophobicContact CG-CG2 3.57Å; L181-V185 WeakPolarHBondContact O-CA 3.05Å; L181-V185 WeakPolarHBondContact O-CB 3.3Å; L181-V185 WeakPolarHBondContact O-CG2 3.44Å; L181-V185 PolarHBondContact O-N 3.36Å; V185-R187 VanDerWaalsContact C-N 3.27Å; V185-R187 PolarHBondContact O-N 3.32Å; V185-K188 PolarHBondContact O-N 2.75Å; V185-K189 HydrophobicContact CG1-CD 3.76Å; V185-K189 HydrophobicContact CG1-CG 3.91Å; V185-K189 WeakPolarHBondContact O-CB 3.5Å; V185-K189 WeakPolarHBondContact O-CG 3.14Å; V185-K189 PolarHBondContact O-N 3.48Å
186C60.7Low61.4Low83 Ų83119 Ų11956%0.56155%0.547SS*.Hα-helixtrans-62.4-37.8168.3-75.30000111.2R182 R190R182-C186 WeakPolarHBondContact O-CB 3.47Å; R182-C186 PolarHBondContact O-N 3.1Å; R182-C186 PolarHBondContact O-SG 2.88Å; C186-R190 VanDerWaalsContact O-CB 3.29Å; C186-R190 WeakPolarHBondContact O-CB 3.28Å; C186-R190 PolarHBondContact O-N 2.84Å
187R62Low60.6Low191 Ų191124.1 Ų124.172%0.72156%0.558SS**Hα-helixtrans-66.2-46.1172.4-83.1-177.6160.3-171.4-5.5112.6R183 L184 V185 R190 M191R183-R187 WeakPolarHBondContact O-CB 3.3Å; R183-R187 WeakPolarHBondContact O-CG 3.23Å; R183-R187 PolarHBondContact O-N 3.04Å; L184-R187 PolarHBondContact O-N 3.2Å; V185-R187 VanDerWaalsContact C-N 3.27Å; V185-R187 PolarHBondContact O-N 3.32Å; R187-R190 PolarHBondContact O-N 3.36Å; R187-M191 VanDerWaalsContact O-CG 3.24Å; R187-M191 WeakPolarHBondContact O-CG 3.41Å; R187-M191 PolarHBondContact O-N 3.22Å; R187-M191 VanDerWaalsContact O-N 3.15Å
188K65.4Low60.1Low132 Ų132127.6 Ų127.657%0.57458%0.583SS**Hα-helixtrans-72.5-40.7-177.7-164.2179.2179.3-174.10112.8L184 V185 R190 M191 E192L184-K188 VanDerWaalsContact O-CB 3.25Å; L184-K188 WeakPolarHBondContact O-CB 3.45Å; L184-K188 PolarHBondContact O-N 3.07Å; V185-K188 PolarHBondContact O-N 2.75Å; K188-R190 VanDerWaalsContact C-N 3.32Å; K188-R190 PolarHBondContact O-N 2.96Å; K188-M191 PolarHBondContact O-N 3.46Å; K188-E192 WeakPolarHBondContact CE-OE1 3.33Å; K188-E192 WeakPolarHBondContact O-CB 3.49Å; K188-E192 PolarHBondContact O-N 3.44Å
189K60.2Low59.6Low142 Ų142130.9 Ų130.962%0.61759%0.593SS**Hα-helixtrans-65-33.9174.2-76.4-175.4176-176.10112.3V185 K193V185-K189 HydrophobicContact CG1-CD 3.76Å; V185-K189 HydrophobicContact CG1-CG 3.91Å; V185-K189 WeakPolarHBondContact O-CB 3.5Å; V185-K189 WeakPolarHBondContact O-CG 3.14Å; V185-K189 PolarHBondContact O-N 3.48Å; K189-K193 VanDerWaalsContact O-CB 3.25Å; K189-K193 WeakPolarHBondContact O-CB 3.49Å; K189-K193 PolarHBondContact O-N 3.46Å
190R61.3Low59.4Low181 Ų181133.7 Ų133.768%0.68361%0.607SS**Hα-helixtrans-64.9-46.8172.4-173.3174.6173176.1-1.6110.9C186 R187 K188 K193 E194C186-R190 VanDerWaalsContact O-CB 3.29Å; C186-R190 WeakPolarHBondContact O-CB 3.28Å; C186-R190 PolarHBondContact O-N 2.84Å; R187-R190 PolarHBondContact O-N 3.36Å; K188-R190 VanDerWaalsContact C-N 3.32Å; K188-R190 PolarHBondContact O-N 2.96Å; R190-K193 PolarHBondContact O-N 3.38Å; R190-E194 IonicContact NE-OE1 2.72Å; R190-E194 WeakPolarHBondContact O-CG 3.3Å; R190-E194 PolarHBondContact O-N 2.91Å
191M60.5Low59Low132 Ų132131.1 Ų131.165%0.6561%0.609SS**Hα-helixtrans-67.2-36.9177-62.8-115.6-66.800113.3R187 K188 R195R187-M191 VanDerWaalsContact O-CG 3.24Å; R187-M191 WeakPolarHBondContact O-CG 3.41Å; R187-M191 PolarHBondContact O-N 3.22Å; R187-M191 VanDerWaalsContact O-N 3.15Å; K188-M191 PolarHBondContact O-N 3.46Å; M191-R195 PolarHBondContact O-N 3.37Å
192E65.5Low58.7Low75 Ų75134.1 Ų134.135%0.3563%0.626SS.*Hα-helixtrans-74-30.5176.2-85.3173.5-176.900112.8K188 E194 R195 R196K188-E192 WeakPolarHBondContact CE-OE1 3.33Å; K188-E192 WeakPolarHBondContact O-CB 3.49Å; K188-E192 PolarHBondContact O-N 3.44Å; E192-E194 VanDerWaalsContact C-N 3.34Å; E192-R195 PolarHBondContact O-N 3.02Å; E192-R196 VanDerWaalsContact O-CB 3.27Å; E192-R196 WeakPolarHBondContact O-CB 3.39Å; E192-R196 VanDerWaalsContact O-CG 3.23Å; E192-R196 WeakPolarHBondContact O-CG 3.34Å; E192-R196 PolarHBondContact O-N 2.95Å
193K59.7Low58.7Low153 Ų153138.2 Ų138.267%0.66564%0.641SS**Hα-helixtrans-67.2-38.8172.7-165178.3-176.2-174.20110.9K189 R190 Q197K189-K193 VanDerWaalsContact O-CB 3.25Å; K189-K193 WeakPolarHBondContact O-CB 3.49Å; K189-K193 PolarHBondContact O-N 3.46Å; R190-K193 PolarHBondContact O-N 3.38Å; K193-Q197 PolarHBondContact O-N 3.47Å
194E60Low58.5Low111 Ų111137.4 Ų137.452%0.51965%0.646SS.*Hα-helixtrans-66.9-39.2172.4-71.8166.4-173.700111.8R190 E192R190-E194 IonicContact NE-OE1 2.72Å; R190-E194 WeakPolarHBondContact O-CG 3.3Å; R190-E194 PolarHBondContact O-N 2.91Å; E192-E194 VanDerWaalsContact C-N 3.34Å
195R59.6Low58Low174 Ų174136.2 Ų136.266%0.65764%0.643SS**Hα-helixtrans-68.8-43.3174.2-114.7179.9176.2-179.3-2.9113.7M191 E192 Q197 S198 E199M191-R195 PolarHBondContact O-N 3.37Å; E192-R195 PolarHBondContact O-N 3.02Å; R195-Q197 VanDerWaalsContact C-N 3.31Å; R195-Q197 PolarHBondContact O-N 3.31Å; R195-S198 PolarHBondContact O-N 3.47Å; R195-E199 PolarHBondContact O-N 3.09Å
196R54.9Low57.6Low168 Ų168136.2 Ų136.263%0.63465%0.653SS**Hα-helixtrans-68.2-27.3179.7-74.6179.2-175.7-154.10.4113.2E192 S198 T200E192-R196 VanDerWaalsContact O-CB 3.27Å; E192-R196 WeakPolarHBondContact O-CB 3.39Å; E192-R196 VanDerWaalsContact O-CG 3.23Å; E192-R196 WeakPolarHBondContact O-CG 3.34Å; E192-R196 PolarHBondContact O-N 2.95Å; R196-S198 VanDerWaalsContact C-N 3.31Å; R196-T200 PolarHBondContact O-OG1 2.96Å; R196-T200 VanDerWaalsContact O-OG1 3.04Å
197Q56.9Low57.6Low152 Ų152135.3 Ų135.371%0.7165%0.651SS**Hα-helixtrans-71-27.4170.3-104.3172.2-33.400112.4K193 R195 T200K193-Q197 PolarHBondContact O-N 3.47Å; R195-Q197 VanDerWaalsContact C-N 3.31Å; R195-Q197 PolarHBondContact O-N 3.31Å; Q197-T200 PolarHBondContact O-OG1 2.89Å
198S53.8Low57.5Low104 Ų104133.8 Ų133.873%0.72765%0.65SS**Hα-helixtrans-87.9-21.6179.1-152.20000113.5R195 R196R195-S198 PolarHBondContact O-N 3.47Å; R196-S198 VanDerWaalsContact C-N 3.31Å
199E56.1Low57.5Low121 Ų121131.4 Ų131.457%0.56564%0.644SS**  trans-96.86.5-176.8-72.9172.218000114.9R195 C201R195-E199 PolarHBondContact O-N 3.09Å; E199-C201 PolarHBondContact O-N 2.93Å
200T53.4Low58.2Low123 Ų123130.7 Ų130.776%0.75564%0.642SS**THydrogen-bonded Turntrans-70.225.2179.3-260000114.8R196 Q197R196-T200 PolarHBondContact O-OG1 2.96Å; R196-T200 VanDerWaalsContact O-OG1 3.04Å; Q197-T200 PolarHBondContact O-OG1 2.89Å
201C49.8Very low59Low114 Ų114125.1 Ų125.177%0.7763%0.626SS**THydrogen-bonded Turntrans-122.113.3-179.6-156.90000114.4E199E199-C201 PolarHBondContact O-N 2.93Å
202N50Low59.9Low138 Ų138125 Ų12574%0.73862%0.624SS**  trans-129.4125.2174.3-81.3-26.7000112.1E204 T205N202-E204 PolarHBondContact O-N 3.22Å; N202-T205 PolarHBondContact O-OG1 2.96Å
203R55.3Low60.8Low254 Ų254124.2 Ų124.296%0.95863%0.63SS**THydrogen-bonded Turntrans-88.99.4-161.6-135.9171.6178.3153.9-2.5115.1
204E56.1Low61.9Low181 Ų181119.7 Ų119.785%0.84661%0.611SS**THydrogen-bonded Turntrans-105.6-12.5-175.8-66.8-177.1165.400114.1N202 G206N202-E204 PolarHBondContact O-N 3.22Å; E204-G206 VanDerWaalsContact C-N 3.27Å; E204-G206 PolarHBondContact O-N 3.3Å
205T54.9Low63.1Low84 Ų84117.9 Ų117.952%0.51560%0.603SS.*Hα-helixtrans-77.7-11.5175.4-1.50000113.2N202 N209N202-T205 PolarHBondContact O-OG1 2.96Å; T205-N209 PolarHBondContact O-ND2 2.87Å
206G54.3Low64.4Low48 Ų48116.1 Ų116.150%0.49560%0.596SS.*Hα-helixtrans-68.7-41.3-177.300000114E204 H210E204-G206 VanDerWaalsContact C-N 3.27Å; E204-G206 PolarHBondContact O-N 3.3Å; G206-H210 WeakPolarHBondContact O-CB 3.34Å; G206-H210 PolarHBondContact O-N 3.05Å
207A59.8Low66Low64 Ų64114.1 Ų114.153%0.52959%0.594SS.*Hα-helixtrans-66.8-51.3-175.900000112.3N209 H210 D211A207-N209 VanDerWaalsContact C-N 3.26Å; A207-N209 PolarHBondContact O-N 3.5Å; A207-H210 WeakPolarHBondContact O-CB 3.21Å; A207-H210 PolarHBondContact O-N 3.41Å; A207-D211 PolarHBondContact O-N 2.99Å
208K60.4Low67.5Low158 Ų158108 Ų10869%0.68757%0.566SS**Hα-helixtrans-60.4-34.6178.8-71.8-175.6178.5176.30113.4Q212K208-Q212 WeakPolarHBondContact O-CG 3.41Å; K208-Q212 PolarHBondContact O-N 2.85Å
209N65.5Low69.1Low83 Ų83104.1 Ų104.144%0.44454%0.537SS..Hα-helixtrans-73.4-34.4177.3-74-28000111.8T205 A207 A213T205-N209 PolarHBondContact O-ND2 2.87Å; A207-N209 VanDerWaalsContact C-N 3.26Å; A207-N209 PolarHBondContact O-N 3.5Å; N209-A213 VanDerWaalsContact O-CB 3.31Å; N209-A213 WeakPolarHBondContact O-CB 3.36Å; N209-A213 PolarHBondContact O-N 3.17Å
210H73.7Confident70.6Confident127 Ų127102 Ų10259%0.58853%0.528SS*.Hα-helixtrans-66.2-47.7175.6-169.5-81.8000111.3G206 A207 Q212 A213 E214G206-H210 WeakPolarHBondContact O-CB 3.34Å; G206-H210 PolarHBondContact O-N 3.05Å; A207-H210 WeakPolarHBondContact O-CB 3.21Å; A207-H210 PolarHBondContact O-N 3.41Å; H210-Q212 VanDerWaalsContact C-N 3.35Å; H210-Q212 PolarHBondContact O-N 3.11Å; H210-A213 PolarHBondContact O-N 3.42Å; H210-A213 VanDerWaalsContact O-N 3.16Å; H210-E214 WeakPolarHBondContact O-CB 3.39Å; H210-E214 PolarHBondContact O-N 3.25Å
211D78.2Confident72.4Confident64 Ų64100 Ų10034%0.34251%0.51SS..Hα-helixtrans-58.7-44.8178.2-66.7-31.5000112.3A207 E214 Q215 Y320A207-D211 PolarHBondContact O-N 2.99Å; D211-E214 PolarHBondContact O-N 2.79Å; D211-Q215 WeakPolarHBondContact O-CB 3.21Å; D211-Q215 PolarHBondContact O-N 3.38Å; D211-Y320 WeakPolarHBondContact CB-OH 3.32Å; D211-Y320 VanDerWaalsContact CG-OH 3.3Å; D211-Y320 PolarHBondContact OD1-OH 2.88Å
212Q80.5Confident74.2Confident129 Ų12997.2 Ų97.260%0.60349%0.485SS*.Hα-helixtrans-66.5-38.1177.3-74.6-177.4-7.500112.6K208 H210 R216K208-Q212 WeakPolarHBondContact O-CG 3.41Å; K208-Q212 PolarHBondContact O-N 2.85Å; H210-Q212 VanDerWaalsContact C-N 3.35Å; H210-Q212 PolarHBondContact O-N 3.11Å; Q212-R216 VanDerWaalsContact O-CB 3.32Å; Q212-R216 WeakPolarHBondContact O-CB 3.15Å; Q212-R216 PolarHBondContact O-N 3.22Å
213A83.5Confident75.8Confident58 Ų5890.6 Ų90.648%0.47945%0.45SS..Hα-helixtrans-66.6-42.3177.300000111.2N209 H210 R216 H217N209-A213 VanDerWaalsContact O-CB 3.31Å; N209-A213 WeakPolarHBondContact O-CB 3.36Å; N209-A213 PolarHBondContact O-N 3.17Å; H210-A213 PolarHBondContact O-N 3.42Å; H210-A213 VanDerWaalsContact O-N 3.16Å; A213-R216 PolarHBondContact O-N 3.34Å; A213-H217 WeakPolarHBondContact O-CB 3.12Å; A213-H217 PolarHBondContact O-N 3.35Å
214E84.2Confident77.4Confident58 Ų5883.7 Ų83.727%0.27143%0.432SS..Hα-helixtrans-65.1-46176.6-171.5176.7-179.600111.7H210 D211 R216 H217 L218 R323H210-E214 WeakPolarHBondContact O-CB 3.39Å; H210-E214 PolarHBondContact O-N 3.25Å; D211-E214 PolarHBondContact O-N 2.79Å; E214-R216 VanDerWaalsContact C-N 3.27Å; E214-R216 PolarHBondContact O-N 2.98Å; E214-H217 WeakPolarHBondContact O-CB 3.34Å; E214-H217 PolarHBondContact O-N 3.08Å; E214-H217 VanDerWaalsContact O-N 3.13Å; E214-L218 PolarHBondContact O-N 2.91Å; E214-R323 VanDerWaalsContact CD-NH2 3.3Å; E214-R323 IonicContact OE1-CZ 3.99Å; E214-R323 IonicContact OE1-NH1 3.99Å; E214-R323 PolarHBondContact OE1-NH1 3.27Å; E214-R323 IonicContact OE1-NH2 3.81Å; E214-R323 PolarHBondContact OE1-NH2 2.89Å
215Q84.6Confident78.9Confident73 Ų7381.2 Ų81.234%0.34142%0.419SS..Hα-helixtrans-60.4-38.8175.4-168.7-175.6-10.600111.6D211 L219 V316 Y320D211-Q215 WeakPolarHBondContact O-CB 3.21Å; D211-Q215 PolarHBondContact O-N 3.38Å; Q215-L219 WeakPolarHBondContact O-CB 3.26Å; Q215-L219 PolarHBondContact O-N 3.4Å; Q215-V316 HydrophobicContact CG-CG1 4.33Å; Q215-Y320 HydrophobicContact CB-CD2 4.46Å
216R87Confident80.2Confident138 Ų13879.9 Ų79.952%0.52141%0.41SS..Hα-helixtrans-68-38.1175.1-173.2179.6179.1156.28.9112Q212 A213 E214 L219 M220 V232 D233Q212-R216 VanDerWaalsContact O-CB 3.32Å; Q212-R216 WeakPolarHBondContact O-CB 3.15Å; Q212-R216 PolarHBondContact O-N 3.22Å; A213-R216 PolarHBondContact O-N 3.34Å; E214-R216 VanDerWaalsContact C-N 3.27Å; E214-R216 PolarHBondContact O-N 2.98Å; R216-L219 PolarHBondContact O-N 3.47Å; R216-M220 WeakPolarHBondContact O-CB 3.43Å; R216-M220 PolarHBondContact O-N 3.41Å; R216-V232 HydrophobicContact CG-CG2 4.34Å; R216-D233 IonicContact CZ-OD1 2.82Å; R216-D233 IonicContact NH2-OD1 3.98Å; R216-D233 PolarHBondContact NH2-OD1 2.96Å; R216-D233 IonicContact NH2-OD2 3.01Å
217H88.6Confident81.5Confident126 Ų12679.9 Ų79.958%0.58341%0.41SS*.Hα-helixtrans-63.8-48.8176.5-176.6-83000111.1A213 E214 L219 M220 E221A213-H217 WeakPolarHBondContact O-CB 3.12Å; A213-H217 PolarHBondContact O-N 3.35Å; E214-H217 WeakPolarHBondContact O-CB 3.34Å; E214-H217 PolarHBondContact O-N 3.08Å; E214-H217 VanDerWaalsContact O-N 3.13Å; H217-L219 VanDerWaalsContact C-N 3.32Å; H217-L219 PolarHBondContact O-N 3.47Å; H217-M220 WeakPolarHBondContact O-CB 3.34Å; H217-M220 PolarHBondContact O-N 3.31Å; H217-E221 PolarHBondContact O-N 2.99Å
218L87.2Confident82.7Confident23 Ų2377.3 Ų77.312%0.1239%0.388CS..Hα-helixtrans-59.7-42.5174.6-71.3177.3000112.1E214 M220 E221 E222 V316E214-L218 PolarHBondContact O-N 2.91Å; L218-M220 VanDerWaalsContact C-N 3.32Å; L218-M220 PolarHBondContact O-N 3.24Å; L218-E221 PolarHBondContact O-N 3.43Å; L218-E222 WeakPolarHBondContact O-CG 3.49Å; L218-E222 PolarHBondContact O-N 2.92Å; L218-V316 HydrophobicContact CB-CG1 3.88Å
219L87.3Confident83.7Confident22 Ų2271.8 Ų71.812%0.11537%0.368CS..Hα-helixtrans-61.1-43.8176.2-179.263.9000111.7Q215 R216 H217 E221 E222 L223 V232 V312 R313 V316Q215-L219 WeakPolarHBondContact O-CB 3.26Å; Q215-L219 PolarHBondContact O-N 3.4Å; R216-L219 PolarHBondContact O-N 3.47Å; H217-L219 VanDerWaalsContact C-N 3.32Å; H217-L219 PolarHBondContact O-N 3.47Å; L219-E221 VanDerWaalsContact C-N 3.34Å; L219-E222 PolarHBondContact O-N 2.89Å; L219-L223 HydrophobicContact CD1-CD1 4.18Å; L219-L223 HydrophobicContact CD1-CG 4.24Å; L219-L223 HydrophobicContact CG-CD1 3.95Å; L219-L223 HydrophobicContact CG-CG 4.43Å; L219-L223 VanDerWaalsContact O-CB 3.31Å; L219-L223 WeakPolarHBondContact O-CB 3.45Å; L219-L223 VanDerWaalsContact O-CG 3.25Å; L219-L223 WeakPolarHBondContact O-CG 3.39Å; L219-L223 PolarHBondContact O-N 3.48Å; L219-V232 HydrophobicContact CD2-CG2 4.19Å; L219-V232 HydrophobicContact CG-CG2 4.45Å; L219-V312 HydrophobicContact CD1-CG1 4.07Å; L219-R313 HydrophobicContact CD1-CB 4.45Å; L219-R313 HydrophobicContact CD1-CG 3.76Å; L219-R313 HydrophobicContact CD2-CG 4.36Å; L219-V316 HydrophobicContact CB-CG1 4.16Å; L219-V316 HydrophobicContact CB-CG2 4.37Å; L219-V316 HydrophobicContact CD1-CB 4.39Å; L219-V316 HydrophobicContact CD1-CG2 3.99Å
220M89.2Confident84.5Confident78 Ų7873.2 Ų73.238%0.38437%0.372SS..Hα-helixtrans-63.9-41.4177.2-17268.3-173.200111.2R216 H217 L218 L223 N224 P229 V232R216-M220 WeakPolarHBondContact O-CB 3.43Å; R216-M220 PolarHBondContact O-N 3.41Å; H217-M220 WeakPolarHBondContact O-CB 3.34Å; H217-M220 PolarHBondContact O-N 3.31Å; L218-M220 VanDerWaalsContact C-N 3.32Å; L218-M220 PolarHBondContact O-N 3.24Å; M220-L223 PolarHBondContact O-N 3.29Å; M220-N224 VanDerWaalsContact O-CB 3.23Å; M220-N224 WeakPolarHBondContact O-CB 3.39Å; M220-N224 PolarHBondContact O-N 3.31Å; M220-P229 HydrophobicContact CE-CB 3.52Å; M220-P229 HydrophobicContact SD-CB 4.36Å; M220-V232 HydrophobicContact SD-CB 4.12Å; M220-V232 HydrophobicContact SD-CG1 4.22Å; M220-V232 HydrophobicContact SD-CG2 4.26Å
221E90.1Very high84.9Confident80 Ų8067.4 Ų67.437%0.37435%0.345SS..Hα-helixtrans-61.6-48.4177.1-169.4-172.114600111.4H217 L218 L219 N224 K225H217-E221 PolarHBondContact O-N 2.99Å; L218-E221 PolarHBondContact O-N 3.43Å; L219-E221 VanDerWaalsContact C-N 3.34Å; E221-N224 WeakPolarHBondContact O-CB 3.27Å; E221-N224 PolarHBondContact O-N 3.48Å; E221-K225 WeakPolarHBondContact O-CG 3.34Å; E221-K225 PolarHBondContact O-N 2.94Å; E221-K225 VanDerWaalsContact OE1-CE 3.3Å; E221-K225 WeakPolarHBondContact OE1-CE 3.41Å; E221-K225 IonicContact OE1-NZ 3.13Å; E221-K225 PolarHBondContact OE1-NZ 3.22Å
222E87Confident85.1Confident55 Ų5565.4 Ų65.426%0.25734%0.335SS..Hα-helixtrans-65.4-42.2178.1-69.9-57.9125.100112.2L218 L219 N224 K225 V226 V312 V316L218-E222 WeakPolarHBondContact O-CG 3.49Å; L218-E222 PolarHBondContact O-N 2.92Å; L219-E222 PolarHBondContact O-N 2.89Å; E222-N224 VanDerWaalsContact C-N 3.28Å; E222-N224 PolarHBondContact O-N 2.94Å; E222-K225 WeakPolarHBondContact O-CB 3.15Å; E222-K225 PolarHBondContact O-N 3.35Å; E222-K225 IonicContact OE1-NZ 3.94Å; E222-K225 PolarHBondContact OE1-NZ 3.03Å; E222-V226 WeakPolarHBondContact O-CG2 3.45Å; E222-V226 PolarHBondContact O-N 3.33Å; E222-V226 VanDerWaalsContact O-N 3.16Å; E222-V312 HydrophobicContact CB-CG1 3.78Å; E222-V316 HydrophobicContact CB-CG2 3.85Å; E222-V316 HydrophobicContact CG-CG2 3.64Å
223L84.9Confident85.1Confident0 Ų064 Ų640%033%0.332CS..Hα-helixtrans-62.1-37.8173.3-75.3173.3000111.6L219 M220 V226 G227 L228 V232 L309 V312L219-L223 HydrophobicContact CD1-CD1 4.18Å; L219-L223 HydrophobicContact CD1-CG 4.24Å; L219-L223 HydrophobicContact CG-CD1 3.95Å; L219-L223 HydrophobicContact CG-CG 4.43Å; L219-L223 VanDerWaalsContact O-CB 3.31Å; L219-L223 WeakPolarHBondContact O-CB 3.45Å; L219-L223 VanDerWaalsContact O-CG 3.25Å; L219-L223 WeakPolarHBondContact O-CG 3.39Å; L219-L223 PolarHBondContact O-N 3.48Å; M220-L223 PolarHBondContact O-N 3.29Å; L223-V226 PolarHBondContact O-N 3.41Å; L223-G227 PolarHBondContact O-N 2.99Å; L223-L228 HydrophobicContact CD2-CB 3.79Å; L223-L228 PolarHBondContact O-N 2.95Å; L223-V232 HydrophobicContact CD1-CB 3.94Å; L223-V232 HydrophobicContact CD1-CG2 4.34Å; L223-L309 HydrophobicContact CD2-CD1 4.3Å; L223-V312 HydrophobicContact CD2-CB 4.19Å; L223-V312 HydrophobicContact CD2-CG1 3.74Å; L223-V312 HydrophobicContact CG-CG1 3.9Å
224N89.3Confident85.2Confident108 Ų10861.4 Ų61.458%0.57831%0.31SS*.Hα-helixtrans-67.2-38.1177.3-159.420.7000111.6M220 E221 E222 V226 G227M220-N224 VanDerWaalsContact O-CB 3.23Å; M220-N224 WeakPolarHBondContact O-CB 3.39Å; M220-N224 PolarHBondContact O-N 3.31Å; E221-N224 WeakPolarHBondContact O-CB 3.27Å; E221-N224 PolarHBondContact O-N 3.48Å; E222-N224 VanDerWaalsContact C-N 3.28Å; E222-N224 PolarHBondContact O-N 2.94Å; N224-V226 VanDerWaalsContact C-N 3.27Å; N224-V226 PolarHBondContact O-N 3Å; N224-G227 PolarHBondContact O-N 3.38Å
225K86.5Confident85.3Confident130 Ų13060.9 Ų60.957%0.56531%0.311SS*.Hα-helixtrans-60.1-35.5173.2-71.9171.7-172160.60112.6E221 E222E221-K225 WeakPolarHBondContact O-CG 3.34Å; E221-K225 PolarHBondContact O-N 2.94Å; E221-K225 VanDerWaalsContact OE1-CE 3.3Å; E221-K225 WeakPolarHBondContact OE1-CE 3.41Å; E221-K225 IonicContact OE1-NZ 3.13Å; E221-K225 PolarHBondContact OE1-NZ 3.22Å; E222-K225 WeakPolarHBondContact O-CB 3.15Å; E222-K225 PolarHBondContact O-N 3.35Å; E222-K225 IonicContact OE1-NZ 3.94Å; E222-K225 PolarHBondContact OE1-NZ 3.03Å
226V83.4Confident85.4Confident55 Ų5558.7 Ų58.733%0.33331%0.306SS..Hα-helixtrans-89.6-8.7179.7-175.10000112.8K163 E222 L223 N224 L228 V312K163-V226 PolarHBondContact NZ-O 3.16Å; E222-V226 WeakPolarHBondContact O-CG2 3.45Å; E222-V226 PolarHBondContact O-N 3.33Å; E222-V226 VanDerWaalsContact O-N 3.16Å; L223-V226 PolarHBondContact O-N 3.41Å; N224-V226 VanDerWaalsContact C-N 3.27Å; N224-V226 PolarHBondContact O-N 3Å; V226-L228 HydrophobicContact CB-CD1 4.35Å; V226-L228 HydrophobicContact CG1-CD1 3.68Å; V226-L228 HydrophobicContact CG1-CG 4.22Å; V226-V312 HydrophobicContact CG2-CG2 4.05Å
227G81Confident85.5Confident49 Ų4956.2 Ų56.251%0.50531%0.309SS..THydrogen-bonded Turntrans76.732-177.300000114L223 N224L223-G227 PolarHBondContact O-N 2.99Å; N224-G227 PolarHBondContact O-N 3.38Å
228L83.8Confident85.6Confident10 Ų1052.9 Ų52.95%0.05230%0.296CS..  trans-121.338.4-179.4-65.1168.1000113.7K163 L223 V226 E230 F231 D308K163-L228 HydrophobicContact CG-CD2 4.26Å; L223-L228 HydrophobicContact CD2-CB 3.79Å; L223-L228 PolarHBondContact O-N 2.95Å; V226-L228 HydrophobicContact CB-CD1 4.35Å; V226-L228 HydrophobicContact CG1-CD1 3.68Å; V226-L228 HydrophobicContact CG1-CG 4.22Å; L228-E230 PolarHBondContact O-N 3.26Å; L228-E230 VanDerWaalsContact O-N 3.16Å; L228-F231 HydrophobicContact CB-CD2 3.76Å; L228-F231 HydrophobicContact CB-CE2 4.24Å; L228-F231 HydrophobicContact CD2-CD2 3.75Å; L228-F231 HydrophobicContact CD2-CE2 3.36Å; L228-F231 HydrophobicContact CD2-CZ 4.03Å; L228-F231 HydrophobicContact CG-CD2 4.35Å; L228-F231 HydrophobicContact CG-CE2 4.41Å; L228-F231 WeakPolarHBondContact O-CD2 3.41Å; L228-F231 PolarHBondContact O-N 3.06Å; L228-D308 HydrophobicContact CD1-CB 4.26Å
229P82.2Confident85.8Confident42 Ų4251.8 Ų51.827%0.27329%0.29SS..G310 helixtrans-62.7-28.5-172.227.5-35.8000113.6M220 F231 V232M220-P229 HydrophobicContact CE-CB 3.52Å; M220-P229 HydrophobicContact SD-CB 4.36Å; P229-F231 PolarHBondContact O-N 3.48Å; P229-V232 PolarHBondContact O-N 2.85Å
230E82.2Confident86.1Confident112 Ų11254.9 Ų54.952%0.52331%0.306SS..G310 helixtrans-68.2-17.5-177.3-55.3-168.3164.300113.4V170 L228 V232V170-E230 HydrophobicContact CG1-CB 4.26Å; L228-E230 PolarHBondContact O-N 3.26Å; L228-E230 VanDerWaalsContact O-N 3.16Å; E230-V232 VanDerWaalsContact C-N 3.32Å; E230-V232 PolarHBondContact O-N 3.21Å
231F82.9Confident86.3Confident6 Ų653.3 Ų53.33%0.02631%0.306CS..G310 helixtrans-87.30.9-175.7-62.1-99.7000113.8M169 V170 L228 P229 D233 I234 L309 R313M169-F231 HydrophobicContact CE-CE1 4.35Å; V170-F231 HydrophobicContact CG2-CD1 3.61Å; V170-F231 HydrophobicContact CG2-CD2 4.33Å; V170-F231 HydrophobicContact CG2-CE1 3.44Å; V170-F231 VanDerWaalsContact CG2-CE1 3.44Å; V170-F231 HydrophobicContact CG2-CE2 4.17Å; V170-F231 HydrophobicContact CG2-CG 4.08Å; V170-F231 HydrophobicContact CG2-CZ 3.75Å; L228-F231 HydrophobicContact CB-CD2 3.76Å; L228-F231 HydrophobicContact CB-CE2 4.24Å; L228-F231 HydrophobicContact CD2-CD2 3.75Å; L228-F231 HydrophobicContact CD2-CE2 3.36Å; L228-F231 HydrophobicContact CD2-CZ 4.03Å; L228-F231 HydrophobicContact CG-CD2 4.35Å; L228-F231 HydrophobicContact CG-CE2 4.41Å; L228-F231 WeakPolarHBondContact O-CD2 3.41Å; L228-F231 PolarHBondContact O-N 3.06Å; P229-F231 PolarHBondContact O-N 3.48Å; F231-D233 PolarHBondContact O-N 2.91Å; F231-I234 HydrophobicContact CD1-CD1 3.94Å; F231-I234 PolarHBondContact O-N 3.39Å; F231-L309 HydrophobicContact CB-CD1 3.4Å; F231-L309 VanDerWaalsContact CB-CD1 3.4Å; F231-L309 HydrophobicContact CD1-CD1 4.2Å; F231-L309 HydrophobicContact CD1-CD2 4.31Å; F231-L309 HydrophobicContact CG-CD1 4.06Å; F231-R313 PolarHBondContact O-NH2 3.42Å
232V81.8Confident86.4Confident21 Ų2152.1 Ų52.113%0.12730%0.304CS..G310 helixtrans-58.2-35-177.973.80000112.2R216 L219 M220 L223 P229 E230 R313R216-V232 HydrophobicContact CG-CG2 4.34Å; L219-V232 HydrophobicContact CD2-CG2 4.19Å; L219-V232 HydrophobicContact CG-CG2 4.45Å; M220-V232 HydrophobicContact SD-CB 4.12Å; M220-V232 HydrophobicContact SD-CG1 4.22Å; M220-V232 HydrophobicContact SD-CG2 4.26Å; L223-V232 HydrophobicContact CD1-CB 3.94Å; L223-V232 HydrophobicContact CD1-CG2 4.34Å; P229-V232 PolarHBondContact O-N 2.85Å; E230-V232 VanDerWaalsContact C-N 3.32Å; E230-V232 PolarHBondContact O-N 3.21Å; V232-R313 PolarHBondContact O-NH2 3.13Å
233D81.2Confident86.8Confident101 Ų10150.4 Ų50.454%0.5430%0.296SS..G310 helixtrans-88.9-7.2-176.5-67.6-44.9000113.8R216 F231R216-D233 IonicContact CZ-OD1 2.82Å; R216-D233 IonicContact NH2-OD1 3.98Å; R216-D233 PolarHBondContact NH2-OD1 2.96Å; R216-D233 IonicContact NH2-OD2 3.01Å; F231-D233 PolarHBondContact O-N 2.91Å
234I84.6Confident87.3Confident2 Ų255.1 Ų55.11%0.0132%0.321CS..SBendtrans-88.4117.4-173.9-62.5179.6000111.5M169 V170 Y173 F231 A236 L238 V239 R313M169-I234 HydrophobicContact CE-CD1 4.39Å; M169-I234 HydrophobicContact CE-CG2 4.47Å; V170-I234 HydrophobicContact CB-CD1 3.81Å; V170-I234 HydrophobicContact CG1-CD1 4.09Å; V170-I234 HydrophobicContact CG2-CD1 3.2Å; Y173-I234 HydrophobicContact CD1-CG1 4.33Å; F231-I234 HydrophobicContact CD1-CD1 3.94Å; F231-I234 PolarHBondContact O-N 3.39Å; I234-A236 PolarHBondContact O-N 2.74Å; I234-L238 HydrophobicContact CG2-CD2 4.16Å; I234-V239 HydrophobicContact CG2-CG2 3.8Å; I234-R313 PolarHBondContact O-NH1 2.88Å; I234-R313 PolarHBondContact O-NH2 2.99Å
235P86.5Confident87.7Confident47 Ų4754.6 Ų54.631%0.30532%0.321SS..  trans-62.7131.3179.825.3-31.9000111.7S237 L238P235-S237 PolarHBondContact O-N 2.82Å; P235-S237 VanDerWaalsContact O-N 3.12Å; P235-L238 HydrophobicContact CG-CB 3.91Å; P235-L238 WeakPolarHBondContact O-CB 3.49Å; P235-L238 PolarHBondContact O-N 2.96Å
236A87Confident88.1Confident27 Ų2750 Ų5022%0.22330%0.301CS..Hα-helixtrans-55.8-31.7179.200000113I234 L238 V239 L240 V310I234-A236 PolarHBondContact O-N 2.74Å; A236-L238 VanDerWaalsContact C-N 3.3Å; A236-L238 PolarHBondContact O-N 3.19Å; A236-V239 PolarHBondContact O-N 3.01Å; A236-L240 PolarHBondContact O-N 2.9Å; A236-V310 HydrophobicContact CB-CG2 4.35Å
237S88.7Confident88.8Confident86 Ų8647.9 Ų47.960%0.60129%0.287SS*.Hα-helixtrans-63.1-33175.254.50000113.1P235 A241P235-S237 PolarHBondContact O-N 2.82Å; P235-S237 VanDerWaalsContact O-N 3.12Å; S237-A241 VanDerWaalsContact O-CB 3.25Å; S237-A241 WeakPolarHBondContact O-CB 3.48Å; S237-A241 PolarHBondContact O-N 3.47Å
238L90.7Very high89.5Confident57 Ų5748.3 Ų48.330%0.29828%0.281SS..Hα-helixtrans-66.2-44176179.572.8000110.5Y173 I234 P235 A236 A241 V242Y173-L238 HydrophobicContact CD2-CD2 3.46Å; Y173-L238 VanDerWaalsContact CD2-CD2 3.46Å; Y173-L238 HydrophobicContact CE2-CD2 3.81Å; Y173-L238 HydrophobicContact CG-CD2 4.24Å; I234-L238 HydrophobicContact CG2-CD2 4.16Å; P235-L238 HydrophobicContact CG-CB 3.91Å; P235-L238 WeakPolarHBondContact O-CB 3.49Å; P235-L238 PolarHBondContact O-N 2.96Å; A236-L238 VanDerWaalsContact C-N 3.3Å; A236-L238 PolarHBondContact O-N 3.19Å; L238-A241 WeakPolarHBondContact O-CB 3.29Å; L238-A241 PolarHBondContact O-N 2.98Å; L238-V242 WeakPolarHBondContact O-CG2 3.25Å; L238-V242 PolarHBondContact O-N 2.79Å
239V91.5Very high90.1Very high0 Ų053.4 Ų53.40%030%0.302CS..Hα-helixtrans-66.3-43.7-179.4179.50000111.2M169 I234 A236 A241 V242 L243 M305 T306 L309M169-V239 HydrophobicContact CE-CG2 3.51Å; M169-V239 HydrophobicContact SD-CG2 4.12Å; I234-V239 HydrophobicContact CG2-CG2 3.8Å; A236-V239 PolarHBondContact O-N 3.01Å; V239-A241 VanDerWaalsContact C-N 3.3Å; V239-A241 PolarHBondContact O-N 3.31Å; V239-V242 PolarHBondContact O-N 3.12Å; V239-L243 PolarHBondContact O-N 3.44Å; V239-M305 HydrophobicContact CG1-CE 3.42Å; V239-M305 VanDerWaalsContact CG1-CE 3.42Å; V239-T306 HydrophobicContact CG1-CG2 4.08Å; V239-L309 HydrophobicContact CB-CD2 4.07Å; V239-L309 HydrophobicContact CG1-CD2 4.28Å; V239-L309 HydrophobicContact CG2-CD2 3.33Å
240L93.2Very high90.7Very high86 Ų8651.4 Ų51.445%0.4529%0.289SS..Hα-helixtrans-61.5-39.5173.2-172.864.2000111.8A236 L243 L244A236-L240 PolarHBondContact O-N 2.9Å; L240-L243 PolarHBondContact O-N 3.3Å; L240-L244 HydrophobicContact CG-CD1 4.33Å; L240-L244 WeakPolarHBondContact O-CG 3.38Å; L240-L244 PolarHBondContact O-N 2.95Å
241A93.5Very high91.4Very high46 Ų4646.1 Ų46.138%0.3827%0.265SS..Hα-helixtrans-64.3-39.7176.200000112.3S237 L238 V239 L243 L244 V245S237-A241 VanDerWaalsContact O-CB 3.25Å; S237-A241 WeakPolarHBondContact O-CB 3.48Å; S237-A241 PolarHBondContact O-N 3.47Å; L238-A241 WeakPolarHBondContact O-CB 3.29Å; L238-A241 PolarHBondContact O-N 2.98Å; V239-A241 VanDerWaalsContact C-N 3.3Å; V239-A241 PolarHBondContact O-N 3.31Å; A241-L243 VanDerWaalsContact C-N 3.35Å; A241-L244 PolarHBondContact O-N 3.24Å; A241-V245 WeakPolarHBondContact O-CB 3.28Å; A241-V245 VanDerWaalsContact O-CG2 3.24Å; A241-V245 WeakPolarHBondContact O-CG2 3.36Å; A241-V245 PolarHBondContact O-N 3.48Å
242V93.5Very high92Very high54 Ų5450.5 Ų50.533%0.32729%0.288SS..Hα-helixtrans-61.4-44.5174.3173.60000110.7M169 L238 V239 V245 Y246 L302M169-V242 HydrophobicContact SD-CG2 4.4Å; L238-V242 WeakPolarHBondContact O-CG2 3.25Å; L238-V242 PolarHBondContact O-N 2.79Å; V239-V242 PolarHBondContact O-N 3.12Å; V242-V245 PolarHBondContact O-N 3.29Å; V242-Y246 WeakPolarHBondContact O-CB 3.34Å; V242-Y246 PolarHBondContact O-N 3.12Å; V242-L302 HydrophobicContact CG1-CD2 4.22Å
243L95Very high92.6Very high20 Ų2051.8 Ų51.811%0.10529%0.294CS..Hα-helixtrans-61-47176.3179.662.7000111.7V239 L240 A241 V245 Y246 I247 L302 T303 T306V239-L243 PolarHBondContact O-N 3.44Å; L240-L243 PolarHBondContact O-N 3.3Å; A241-L243 VanDerWaalsContact C-N 3.35Å; L243-V245 PolarHBondContact O-N 3.16Å; L243-Y246 WeakPolarHBondContact O-CB 3.5Å; L243-Y246 PolarHBondContact O-N 3.46Å; L243-I247 HydrophobicContact CD1-CD1 4.13Å; L243-I247 HydrophobicContact CD1-CG1 4.38Å; L243-I247 HydrophobicContact CG-CD1 3.97Å; L243-I247 WeakPolarHBondContact O-CG1 3.23Å; L243-I247 PolarHBondContact O-N 3.22Å; L243-L302 HydrophobicContact CD1-CB 4.47Å; L243-T303 WeakPolarHBondContact CD1-OG1 3.44Å; L243-T306 HydrophobicContact CD2-CG2 3.92Å
244L95.9Very high93.3Very high98 Ų9847 Ų4751%0.51327%0.268SS..Hα-helixtrans-61.7-43.9178.1-71174.3000111.8L240 A241 Y246 I247 T248L240-L244 HydrophobicContact CG-CD1 4.33Å; L240-L244 WeakPolarHBondContact O-CG 3.38Å; L240-L244 PolarHBondContact O-N 2.95Å; A241-L244 PolarHBondContact O-N 3.24Å; L244-Y246 VanDerWaalsContact C-N 3.3Å; L244-Y246 PolarHBondContact O-N 2.98Å; L244-I247 PolarHBondContact O-N 2.83Å; L244-T248 WeakPolarHBondContact O-CG2 3.29Å; L244-T248 PolarHBondContact O-N 3.38Å; L244-T248 PolarHBondContact O-OG1 2.93Å
245V96.3Very high93.7Very high97 Ų9750.7 Ų50.759%0.58829%0.285SS*.Hα-helixtrans-60.3-42.4175.3169.90000110.6A241 V242 L243 T248 F249A241-V245 WeakPolarHBondContact O-CB 3.28Å; A241-V245 VanDerWaalsContact O-CG2 3.24Å; A241-V245 WeakPolarHBondContact O-CG2 3.36Å; A241-V245 PolarHBondContact O-N 3.48Å; V242-V245 PolarHBondContact O-N 3.29Å; L243-V245 PolarHBondContact O-N 3.16Å; V245-T248 WeakPolarHBondContact CA-OG1 3.43Å; V245-T248 PolarHBondContact O-N 2.88Å; V245-T248 PolarHBondContact O-OG1 3.1Å; V245-F249 WeakPolarHBondContact O-CB 3.41Å; V245-F249 PolarHBondContact O-N 2.84Å
246Y96.4Very high94Very high34 Ų3458 Ų5813%0.13331%0.308CS..Hα-helixtrans-64.1-41.2177.8-172.6-93.5000113.2V242 L243 L244 F249 G250 M273 Y295 V298 G299 L302V242-Y246 WeakPolarHBondContact O-CB 3.34Å; V242-Y246 PolarHBondContact O-N 3.12Å; L243-Y246 WeakPolarHBondContact O-CB 3.5Å; L243-Y246 PolarHBondContact O-N 3.46Å; L244-Y246 VanDerWaalsContact C-N 3.3Å; L244-Y246 PolarHBondContact O-N 2.98Å; Y246-F249 PolarHBondContact O-N 3.41Å; Y246-G250 PolarHBondContact O-N 2.95Å; Y246-M273 HydrophobicContact CE1-CE 3.96Å; Y246-M273 HydrophobicContact CE1-SD 4.32Å; Y246-Y295 HydrophobicContact CD1-CE2 4.03Å; Y246-Y295 AromaticContact CE1-CD2 3.9Å; Y246-Y295 HydrophobicContact CE1-CD2 3.9Å; Y246-Y295 HydrophobicContact CE1-CE1 4.48Å; Y246-Y295 AromaticContact CE1-CE2 3.3Å; Y246-Y295 HydrophobicContact CE1-CE2 3.3Å; Y246-Y295 AromaticContact CE1-CZ 3.62Å; Y246-Y295 HydrophobicContact CE2-CD2 4.4Å; Y246-Y295 HydrophobicContact CE2-CE2 4.19Å; Y246-Y295 AromaticContact CZ-CD2 3.59Å; Y246-Y295 AromaticContact CZ-CE2 3.41Å; Y246-Y295 VanDerWaalsContact CZ-CE2 3.41Å; Y246-Y295 PolarHBondContact O-OH 3.01Å; Y246-Y295 WeakPolarHBondContact OH-CD2 3.49Å; Y246-Y295 WeakPolarHBondContact OH-CE2 3.43Å; Y246-Y295 PolarHBondContact OH-O 3.5Å; Y246-V298 HydrophobicContact CE2-CB 4.48Å; Y246-V298 HydrophobicContact CE2-CG1 3.77Å; Y246-V298 WeakPolarHBondContact OH-CB 3.47Å; Y246-G299 PolarHBondContact OH-N 3.03Å; Y246-L302 HydrophobicContact CD1-CD1 3.94Å; Y246-L302 HydrophobicContact CD2-CD1 3.39Å; Y246-L302 HydrophobicContact CE1-CD1 4.37Å; Y246-L302 HydrophobicContact CE2-CD1 3.86Å; Y246-L302 HydrophobicContact CG-CD1 3.42Å; Y246-L302 VanDerWaalsContact CG-CD1 3.42Å
247I96.5Very high94.3Very high10 Ų1058.2 Ų58.25%0.05131%0.307CS..Hα-helixtrans-64.2-43.6175-67.3168.9000110L243 L244 F249 G250 A251 L266 F270 M273L243-I247 HydrophobicContact CD1-CD1 4.13Å; L243-I247 HydrophobicContact CD1-CG1 4.38Å; L243-I247 HydrophobicContact CG-CD1 3.97Å; L243-I247 WeakPolarHBondContact O-CG1 3.23Å; L243-I247 PolarHBondContact O-N 3.22Å; L244-I247 PolarHBondContact O-N 2.83Å; I247-F249 VanDerWaalsContact C-N 3.33Å; I247-F249 PolarHBondContact O-N 3.47Å; I247-G250 PolarHBondContact O-N 3.45Å; I247-A251 PolarHBondContact O-N 3.46Å; I247-L266 HydrophobicContact CG2-CD1 3.83Å; I247-F270 HydrophobicContact CD1-CD2 4.33Å; I247-F270 HydrophobicContact CG2-CB 4.44Å; I247-M273 HydrophobicContact CG1-CG 4.22Å
248T96.5Very high94.4Very high59 Ų5955.4 Ų55.436%0.36228%0.284SS..Hα-helixtrans-65.8-33.9175.959.30000113L244 V245 A251 L252 L266L244-T248 WeakPolarHBondContact O-CG2 3.29Å; L244-T248 PolarHBondContact O-N 3.38Å; L244-T248 PolarHBondContact O-OG1 2.93Å; V245-T248 WeakPolarHBondContact CA-OG1 3.43Å; V245-T248 PolarHBondContact O-N 2.88Å; V245-T248 PolarHBondContact O-OG1 3.1Å; T248-A251 WeakPolarHBondContact O-CB 3.41Å; T248-A251 PolarHBondContact O-N 3.41Å; T248-L252 PolarHBondContact O-N 3.02Å; T248-L252 VanDerWaalsContact O-N 3.12Å; T248-L266 HydrophobicContact CG2-CD1 4.04Å
249F96.4Very high94.5Very high117 Ų11761.4 Ų61.451%0.51331%0.308SS..Hα-helixtrans-64.4-41.4173.1173.3-101.5000111.4V245 Y246 I247 A251 L252 L253 Y295V245-F249 WeakPolarHBondContact O-CB 3.41Å; V245-F249 PolarHBondContact O-N 2.84Å; Y246-F249 PolarHBondContact O-N 3.41Å; I247-F249 VanDerWaalsContact C-N 3.33Å; I247-F249 PolarHBondContact O-N 3.47Å; F249-A251 VanDerWaalsContact C-N 3.34Å; F249-A251 PolarHBondContact O-N 3.27Å; F249-L252 PolarHBondContact O-N 3.38Å; F249-L253 HydrophobicContact CE1-CD1 4.41Å; F249-L253 PolarHBondContact O-N 3.26Å; F249-Y295 HydrophobicContact CD1-CE2 4.38Å
250G95.2Very high94.6Very high0 Ų063.6 Ų63.60%032%0.316CS..Hα-helixtrans-58.1-45.517100000112.6Y246 I247 L252 L253 F254 Y295Y246-G250 PolarHBondContact O-N 2.95Å; I247-G250 PolarHBondContact O-N 3.45Å; G250-L252 VanDerWaalsContact C-N 3.31Å; G250-L252 PolarHBondContact O-N 3.3Å; G250-L253 WeakPolarHBondContact O-CA 3.39Å; G250-L253 WeakPolarHBondContact O-CB 3.41Å; G250-L253 PolarHBondContact O-N 2.81Å; G250-F254 WeakPolarHBondContact O-CD2 3.45Å; G250-F254 PolarHBondContact O-N 3.31Å; G250-Y295 VanDerWaalsContact CA-CE2 3.47Å; G250-Y295 VanDerWaalsContact CA-OH 3.3Å; G250-Y295 WeakPolarHBondContact CA-OH 3.35Å
251A96.3Very high94.8Very high0 Ų065 Ų650%032%0.324CS..Hα-helixtrans-56.9-44.517800000112.2I247 T248 F249 L253 F254 Q255 F262 S265 L266 S269I247-A251 PolarHBondContact O-N 3.46Å; T248-A251 WeakPolarHBondContact O-CB 3.41Å; T248-A251 PolarHBondContact O-N 3.41Å; F249-A251 VanDerWaalsContact C-N 3.34Å; F249-A251 PolarHBondContact O-N 3.27Å; A251-L253 VanDerWaalsContact C-N 3.34Å; A251-L253 PolarHBondContact O-N 2.89Å; A251-F254 PolarHBondContact O-N 3.42Å; A251-Q255 VanDerWaalsContact O-CB 3.24Å; A251-Q255 WeakPolarHBondContact O-CB 3.26Å; A251-Q255 PolarHBondContact O-N 2.61Å; A251-F262 HydrophobicContact CB-CD2 4.14Å; A251-F262 HydrophobicContact CB-CE2 3.7Å; A251-F262 HydrophobicContact CB-CZ 4.21Å; A251-S265 WeakPolarHBondContact O-CB 3.4Å; A251-L266 HydrophobicContact CB-CB 3.86Å; A251-L266 HydrophobicContact CB-CD1 3.88Å; A251-S269 PolarHBondContact N-OG 3.45Å
252L96.3Very high94.9Very high99 Ų9966.7 Ų66.752%0.51832%0.323SS..Hα-helixtrans-64.9-37.3175.5-66.1174.5000112.5T248 F249 G250 Y256 F262T248-L252 PolarHBondContact O-N 3.02Å; T248-L252 VanDerWaalsContact O-N 3.12Å; F249-L252 PolarHBondContact O-N 3.38Å; G250-L252 VanDerWaalsContact C-N 3.31Å; G250-L252 PolarHBondContact O-N 3.3Å; L252-Y256 PolarHBondContact O-N 3.02Å; L252-F262 HydrophobicContact CD2-CD2 4.14Å; L252-F262 HydrophobicContact CD2-CE2 3.87Å; L252-F262 HydrophobicContact CG-CE2 4.25Å
253L94.2Very high95.1Very high48 Ų4869.1 Ų69.125%0.25134%0.338SS..Hα-helixtrans-65.1-49177-175.5151.4000111.2F249 G250 A251 Y256 V257F249-L253 HydrophobicContact CE1-CD1 4.41Å; F249-L253 PolarHBondContact O-N 3.26Å; G250-L253 WeakPolarHBondContact O-CA 3.39Å; G250-L253 WeakPolarHBondContact O-CB 3.41Å; G250-L253 PolarHBondContact O-N 2.81Å; A251-L253 VanDerWaalsContact C-N 3.34Å; A251-L253 PolarHBondContact O-N 2.89Å; L253-Y256 PolarHBondContact O-N 2.89Å; L253-V257 HydrophobicContact CD2-CG2 4.03Å; L253-V257 HydrophobicContact CG-CG2 4.41Å; L253-V257 WeakPolarHBondContact O-CB 3.27Å; L253-V257 VanDerWaalsContact O-CG2 3.28Å; L253-V257 WeakPolarHBondContact O-CG2 3.43Å; L253-V257 PolarHBondContact O-N 3.49Å
254F94.5Very high95.2Very high0 Ų071.4 Ų71.40%035%0.35CS..Hα-helixtrans-71.1-33.3-179.4-66.9-64000112.9G250 A251 Y256 V257 E258 K259 W260 F268 P283 V292 Y295G250-F254 WeakPolarHBondContact O-CD2 3.45Å; G250-F254 PolarHBondContact O-N 3.31Å; A251-F254 PolarHBondContact O-N 3.42Å; F254-Y256 PolarHBondContact O-N 3.35Å; F254-V257 PolarHBondContact O-N 2.92Å; F254-E258 PolarHBondContact O-N 3.35Å; F254-K259 PolarHBondContact O-N 3.28Å; F254-W260 HydrophobicContact CB-CE3 4.18Å; F254-W260 HydrophobicContact CB-CZ3 4.37Å; F254-F268 HydrophobicContact CD1-CD1 4.38Å; F254-F268 HydrophobicContact CD1-CE1 4.16Å; F254-F268 AromaticContact CD2-CD1 3.75Å; F254-F268 HydrophobicContact CD2-CD1 3.75Å; F254-F268 HydrophobicContact CD2-CE1 4.01Å; F254-F268 HydrophobicContact CE1-CD1 4.4Å; F254-F268 AromaticContact CE1-CE1 3.78Å; F254-F268 HydrophobicContact CE1-CE1 3.78Å; F254-F268 AromaticContact CE2-CD1 3.8Å; F254-F268 HydrophobicContact CE2-CD1 3.8Å; F254-F268 AromaticContact CE2-CE1 3.64Å; F254-F268 HydrophobicContact CE2-CE1 3.64Å; F254-F268 HydrophobicContact CG-CD1 4.09Å; F254-F268 HydrophobicContact CG-CE1 4.29Å; F254-F268 HydrophobicContact CZ-CD1 4.16Å; F254-F268 AromaticContact CZ-CE1 3.54Å; F254-F268 HydrophobicContact CZ-CE1 3.54Å; F254-P283 HydrophobicContact CD1-CG 4.4Å; F254-P283 HydrophobicContact CE1-CG 4.03Å; F254-V292 HydrophobicContact CE1-CB 4.41Å; F254-V292 HydrophobicContact CE1-CG1 3.98Å; F254-V292 HydrophobicContact CE1-CG2 3.72Å; F254-V292 HydrophobicContact CZ-CG1 4.03Å; F254-V292 HydrophobicContact CZ-CG2 4.39Å; F254-Y295 AromaticContact CE2-CD1 3.75Å; F254-Y295 HydrophobicContact CE2-CD1 3.75Å; F254-Y295 AromaticContact CE2-CE1 3.57Å; F254-Y295 HydrophobicContact CE2-CE1 3.57Å; F254-Y295 AromaticContact CZ-CD1 3.79Å; F254-Y295 HydrophobicContact CZ-CD1 3.79Å; F254-Y295 HydrophobicContact CZ-CE1 4.1Å
255Q94.9Very high95.2Very high79 Ų7966.8 Ų66.837%0.36933%0.326SS..Hα-helixtrans-58.9-38.9170.4179.41742600111.4A251 K259 W260 S265A251-Q255 VanDerWaalsContact O-CB 3.24Å; A251-Q255 WeakPolarHBondContact O-CB 3.26Å; A251-Q255 PolarHBondContact O-N 2.61Å; Q255-K259 VanDerWaalsContact O-CA 3.23Å; Q255-K259 WeakPolarHBondContact O-CA 3.25Å; Q255-K259 PolarHBondContact O-N 2.86Å; Q255-W260 WeakPolarHBondContact CG-O 3.31Å; Q255-S265 PolarHBondContact N-OG 3.36Å
256Y92.4Very high95.3Very high201 Ų20164.9 Ų64.979%0.78831%0.312SS*.Hα-helixtrans-75.6-44177-179.4-99.3000112.9L252 L253 F254L252-Y256 PolarHBondContact O-N 3.02Å; L253-Y256 PolarHBondContact O-N 2.89Å; F254-Y256 PolarHBondContact O-N 3.35Å
257V92.2Very high95.3Very high31 Ų3167.1 Ų67.119%0.18832%0.321CS..Hα-helixtrans-76.4-50.7-173.1173.40000112.3L253 F254 H288L253-V257 HydrophobicContact CD2-CG2 4.03Å; L253-V257 HydrophobicContact CG-CG2 4.41Å; L253-V257 WeakPolarHBondContact O-CB 3.27Å; L253-V257 VanDerWaalsContact O-CG2 3.28Å; L253-V257 WeakPolarHBondContact O-CG2 3.43Å; L253-V257 PolarHBondContact O-N 3.49Å; F254-V257 PolarHBondContact O-N 2.92Å; V257-H288 HydrophobicContact CG1-CB 3.9Å; V257-H288 VanDerWaalsContact CG1-CD2 3.41Å; V257-H288 WeakPolarHBondContact CG1-CD2 3.49Å
258E91.2Very high95.3Very high27 Ų2766.6 Ų66.613%0.12632%0.318CS..THydrogen-bonded Turntrans-98.9-7.2-173.9-62.1-64.7142.400112.6F254 W260 P283 E284 N285F254-E258 PolarHBondContact O-N 3.35Å; E258-W260 HydrophobicContact CB-CD2 3.67Å; E258-W260 HydrophobicContact CB-CE3 4.2Å; E258-W260 HydrophobicContact CB-CG 3.96Å; E258-W260 HydrophobicContact CB-CH2 4.47Å; E258-W260 HydrophobicContact CB-CZ2 3.96Å; E258-W260 HydrophobicContact CG-CD2 4.39Å; E258-W260 HydrophobicContact CG-CH2 4.17Å; E258-W260 HydrophobicContact CG-CZ2 3.95Å; E258-W260 HydrophobicContact CG-CZ3 4.46Å; E258-W260 PolarHBondContact O-N 3.29Å; E258-P283 HydrophobicContact CG-CB 4.21Å; E258-P283 WeakPolarHBondContact OE1-CB 3.5Å; E258-E284 PolarHBondContact OE2-N 3.32Å; E258-N285 PolarHBondContact OE1-N 2.96Å
259K92.7Very high95.3Very high184 Ų18463.8 Ų63.880%0.830%0.301SS*.  trans59.926.4-178.2-53.7176.9-178.6173.30113.8F254 Q255F254-K259 PolarHBondContact O-N 3.28Å; Q255-K259 VanDerWaalsContact O-CA 3.23Å; Q255-K259 WeakPolarHBondContact O-CA 3.25Å; Q255-K259 PolarHBondContact O-N 2.86Å
260W94Very high95.3Very high45 Ų4563 Ų6317%0.1730%0.298CS..  trans-73.3160172-60.6-22.1000111.3F254 Q255 E258 D264 F268 L281 V282 P283F254-W260 HydrophobicContact CB-CE3 4.18Å; F254-W260 HydrophobicContact CB-CZ3 4.37Å; Q255-W260 WeakPolarHBondContact CG-O 3.31Å; E258-W260 HydrophobicContact CB-CD2 3.67Å; E258-W260 HydrophobicContact CB-CE3 4.2Å; E258-W260 HydrophobicContact CB-CG 3.96Å; E258-W260 HydrophobicContact CB-CH2 4.47Å; E258-W260 HydrophobicContact CB-CZ2 3.96Å; E258-W260 HydrophobicContact CG-CD2 4.39Å; E258-W260 HydrophobicContact CG-CH2 4.17Å; E258-W260 HydrophobicContact CG-CZ2 3.95Å; E258-W260 HydrophobicContact CG-CZ3 4.46Å; E258-W260 PolarHBondContact O-N 3.29Å; W260-D264 HydrophobicContact CB-CB 4.38Å; W260-F268 HydrophobicContact CE3-CB 4.49Å; W260-F268 HydrophobicContact CH2-CD2 4.35Å; W260-F268 HydrophobicContact CH2-CG 4.3Å; W260-F268 HydrophobicContact CZ3-CB 3.94Å; W260-F268 AromaticContact CZ3-CD1 3.79Å; W260-F268 HydrophobicContact CZ3-CD1 3.79Å; W260-F268 HydrophobicContact CZ3-CD2 4.14Å; W260-F268 HydrophobicContact CZ3-CE1 4.38Å; W260-F268 AromaticContact CZ3-CG 3.66Å; W260-F268 HydrophobicContact CZ3-CG 3.66Å; W260-L281 HydrophobicContact CH2-CB 4.17Å; W260-L281 HydrophobicContact CZ3-CB 4.38Å; W260-V282 WeakPolarHBondContact CZ2-O 3.25Å; W260-P283 HydrophobicContact CH2-CG 4.23Å
261D96.2Very high95.3Very high116 Ų11663.2 Ų63.262%0.6230%0.298SS*.  trans-61.7152.9169.8-76.5-27.7000110.7V263 D264 S265D261-V263 PolarHBondContact O-N 2.89Å; D261-D264 HydrophobicContact CB-CB 4.49Å; D261-D264 PolarHBondContact O-N 3.35Å; D261-S265 WeakPolarHBondContact O-CB 3.39Å; D261-S265 PolarHBondContact O-N 3.41Å; D261-S265 PolarHBondContact O-OG 3.22Å
262F96.6Very high95.3Very high82 Ų8263.2 Ų63.236%0.3630%0.298SS..Hα-helixtrans-59.4-38.4-178.3177.3-99.1000112A251 L252 S265 L266A251-F262 HydrophobicContact CB-CD2 4.14Å; A251-F262 HydrophobicContact CB-CE2 3.7Å; A251-F262 HydrophobicContact CB-CZ 4.21Å; L252-F262 HydrophobicContact CD2-CD2 4.14Å; L252-F262 HydrophobicContact CD2-CE2 3.87Å; L252-F262 HydrophobicContact CG-CE2 4.25Å; F262-S265 PolarHBondContact O-N 2.93Å; F262-L266 HydrophobicContact CE1-CD2 4.44Å; F262-L266 VanDerWaalsContact O-CB 3.29Å; F262-L266 WeakPolarHBondContact O-CB 3.44Å; F262-L266 PolarHBondContact O-N 3.4Å
263V97.1Very high95.3Very high105 Ų10558.6 Ų58.664%0.63627%0.274SS*.Hα-helixtrans-66-45179.4178.50000110.8D261 S265 L266 Y267D261-V263 PolarHBondContact O-N 2.89Å; V263-S265 VanDerWaalsContact C-N 3.34Å; V263-S265 PolarHBondContact O-N 3.38Å; V263-L266 PolarHBondContact O-N 2.93Å; V263-Y267 WeakPolarHBondContact O-CB 3.28Å; V263-Y267 PolarHBondContact O-N 3.32Å
264D97.1Very high95.3Very high68 Ų6858.7 Ų58.736%0.36428%0.277SS..Hα-helixtrans-64.8-40.2177.2-69.3-9000111.4W260 D261 L266 Y267 F268 L281W260-D264 HydrophobicContact CB-CB 4.38Å; D261-D264 HydrophobicContact CB-CB 4.49Å; D261-D264 PolarHBondContact O-N 3.35Å; D264-L266 PolarHBondContact O-N 3.03Å; D264-Y267 PolarHBondContact O-N 3.48Å; D264-F268 WeakPolarHBondContact O-CB 3.26Å; D264-F268 PolarHBondContact O-N 3.36Å; D264-L281 HydrophobicContact CB-CD1 3.79Å
265S96.8Very high95.3Very high0 Ų061.4 Ų61.40%029%0.293CS..Hα-helixtrans-64.5-39.1175-57.40000112.4A251 Q255 D261 F262 V263 S269A251-S265 WeakPolarHBondContact O-CB 3.4Å; Q255-S265 PolarHBondContact N-OG 3.36Å; D261-S265 WeakPolarHBondContact O-CB 3.39Å; D261-S265 PolarHBondContact O-N 3.41Å; D261-S265 PolarHBondContact O-OG 3.22Å; F262-S265 PolarHBondContact O-N 2.93Å; V263-S265 VanDerWaalsContact C-N 3.34Å; V263-S265 PolarHBondContact O-N 3.38Å; S265-S269 WeakPolarHBondContact O-CB 3.48Å; S265-S269 PolarHBondContact O-N 3.41Å; S265-S269 PolarHBondContact O-OG 2.96Å
266L97.2Very high95.4Very high58 Ų5861.4 Ų61.430%0.30430%0.295SS..Hα-helixtrans-68.5-43.4175-173.273.5000111.3I247 T248 A251 F262 V263 D264 S269 F270I247-L266 HydrophobicContact CG2-CD1 3.83Å; T248-L266 HydrophobicContact CG2-CD1 4.04Å; A251-L266 HydrophobicContact CB-CB 3.86Å; A251-L266 HydrophobicContact CB-CD1 3.88Å; F262-L266 HydrophobicContact CE1-CD2 4.44Å; F262-L266 VanDerWaalsContact O-CB 3.29Å; F262-L266 WeakPolarHBondContact O-CB 3.44Å; F262-L266 PolarHBondContact O-N 3.4Å; V263-L266 PolarHBondContact O-N 2.93Å; D264-L266 PolarHBondContact O-N 3.03Å; L266-S269 PolarHBondContact O-N 2.9Å; L266-F270 WeakPolarHBondContact O-CB 3.5Å; L266-F270 PolarHBondContact O-N 3.49Å
267Y97Very high95.5Very high80 Ų8052.1 Ų52.131%0.31426%0.261SS..Hα-helixtrans-59.4-51.2175.2164.7-104.2000110.9V263 D264 S269 F270 I271 F278 D280 L281V263-Y267 WeakPolarHBondContact O-CB 3.28Å; V263-Y267 PolarHBondContact O-N 3.32Å; D264-Y267 PolarHBondContact O-N 3.48Å; Y267-S269 VanDerWaalsContact C-N 3.34Å; Y267-S269 PolarHBondContact O-N 3.24Å; Y267-F270 PolarHBondContact O-N 3.46Å; Y267-F270 VanDerWaalsContact O-N 3.15Å; Y267-I271 HydrophobicContact CD1-CD1 4.45Å; Y267-I271 HydrophobicContact CD2-CG2 3.97Å; Y267-I271 HydrophobicContact CE1-CD1 3.88Å; Y267-I271 HydrophobicContact CE2-CG2 3.62Å; Y267-I271 WeakPolarHBondContact O-CG1 3.49Å; Y267-I271 PolarHBondContact O-N 3.25Å; Y267-F278 VanDerWaalsContact OH-CD2 3.3Å; Y267-F278 WeakPolarHBondContact OH-CD2 3.46Å; Y267-D280 WeakPolarHBondContact CE1-OD2 3.26Å; Y267-D280 VanDerWaalsContact CZ-OD2 3.3Å; Y267-D280 PolarHBondContact OH-OD2 3.24Å; Y267-L281 HydrophobicContact CD1-CD1 3.92Å; Y267-L281 HydrophobicContact CE1-CD1 4.29Å
268F96.2Very high95.6Very high0 Ų056.9 Ų56.90%028%0.279CS..Hα-helixtrans-55.7-48.1175.1173.5-101.6000111.6Y129 F254 W260 D264 F270 I271 T272 L281 P283Y129-F268 AromaticContact CE1-CE2 3.84Å; Y129-F268 HydrophobicContact CE1-CE2 3.84Å; Y129-F268 HydrophobicContact CE1-CZ 4.49Å; Y129-F268 AromaticContact CZ-CE2 3.81Å; Y129-F268 WeakPolarHBondContact OH-CZ 3.22Å; F254-F268 HydrophobicContact CD1-CD1 4.38Å; F254-F268 HydrophobicContact CD1-CE1 4.16Å; F254-F268 AromaticContact CD2-CD1 3.75Å; F254-F268 HydrophobicContact CD2-CD1 3.75Å; F254-F268 HydrophobicContact CD2-CE1 4.01Å; F254-F268 HydrophobicContact CE1-CD1 4.4Å; F254-F268 AromaticContact CE1-CE1 3.78Å; F254-F268 HydrophobicContact CE1-CE1 3.78Å; F254-F268 AromaticContact CE2-CD1 3.8Å; F254-F268 HydrophobicContact CE2-CD1 3.8Å; F254-F268 AromaticContact CE2-CE1 3.64Å; F254-F268 HydrophobicContact CE2-CE1 3.64Å; F254-F268 HydrophobicContact CG-CD1 4.09Å; F254-F268 HydrophobicContact CG-CE1 4.29Å; F254-F268 HydrophobicContact CZ-CD1 4.16Å; F254-F268 AromaticContact CZ-CE1 3.54Å; F254-F268 HydrophobicContact CZ-CE1 3.54Å; W260-F268 HydrophobicContact CE3-CB 4.49Å; W260-F268 HydrophobicContact CH2-CD2 4.35Å; W260-F268 HydrophobicContact CH2-CG 4.3Å; W260-F268 HydrophobicContact CZ3-CB 3.94Å; W260-F268 AromaticContact CZ3-CD1 3.79Å; W260-F268 HydrophobicContact CZ3-CD1 3.79Å; W260-F268 HydrophobicContact CZ3-CD2 4.14Å; W260-F268 HydrophobicContact CZ3-CE1 4.38Å; W260-F268 AromaticContact CZ3-CG 3.66Å; W260-F268 HydrophobicContact CZ3-CG 3.66Å; D264-F268 WeakPolarHBondContact O-CB 3.26Å; D264-F268 PolarHBondContact O-N 3.36Å; F268-F270 VanDerWaalsContact C-N 3.32Å; F268-F270 PolarHBondContact O-N 3.48Å; F268-I271 WeakPolarHBondContact O-CG1 3.48Å; F268-T272 WeakPolarHBondContact O-CB 3.23Å; F268-T272 PolarHBondContact O-N 3.33Å; F268-T272 VanDerWaalsContact O-N 3.07Å; F268-T272 PolarHBondContact O-OG1 3.02Å; F268-L281 HydrophobicContact CB-CB 4.41Å; F268-L281 HydrophobicContact CB-CD1 4.44Å; F268-L281 HydrophobicContact CD2-CB 4.09Å; F268-L281 WeakPolarHBondContact CD2-O 3.34Å; F268-L281 WeakPolarHBondContact CE2-O 3.35Å; F268-P283 HydrophobicContact CE1-CG 4.23Å; F268-P283 HydrophobicContact CZ-CG 3.95Å
269S96.5Very high95.6Very high0 Ų056.5 Ų56.50%028%0.282CS..Hα-helixtrans-59.8-43.4178.4-60.20000111.3A251 S265 L266 Y267 M273A251-S269 PolarHBondContact N-OG 3.45Å; S265-S269 WeakPolarHBondContact O-CB 3.48Å; S265-S269 PolarHBondContact O-N 3.41Å; S265-S269 PolarHBondContact O-OG 2.96Å; L266-S269 PolarHBondContact O-N 2.9Å; Y267-S269 VanDerWaalsContact C-N 3.34Å; Y267-S269 PolarHBondContact O-N 3.24Å; S269-M273 WeakPolarHBondContact O-CB 3.22Å; S269-M273 WeakPolarHBondContact O-CG 3.3Å; S269-M273 PolarHBondContact O-N 3.45Å
270F96.4Very high95.6Very high101 Ų10152.2 Ų52.244%0.44327%0.268SS..Hα-helixtrans-64-55.1178.9178.2-97.6000112.6I247 L266 Y267 F268 T272 M273 T274I247-F270 HydrophobicContact CD1-CD2 4.33Å; I247-F270 HydrophobicContact CG2-CB 4.44Å; L266-F270 WeakPolarHBondContact O-CB 3.5Å; L266-F270 PolarHBondContact O-N 3.49Å; Y267-F270 PolarHBondContact O-N 3.46Å; Y267-F270 VanDerWaalsContact O-N 3.15Å; F268-F270 VanDerWaalsContact C-N 3.32Å; F268-F270 PolarHBondContact O-N 3.48Å; F270-T272 PolarHBondContact O-N 3.47Å; F270-M273 PolarHBondContact O-N 2.94Å; F270-M273 VanDerWaalsContact O-N 3.13Å; F270-T274 HydrophobicContact CD2-CG2 4.26Å; F270-T274 HydrophobicContact CE1-CG2 4.2Å; F270-T274 HydrophobicContact CE2-CG2 3.87Å; F270-T274 HydrophobicContact CZ-CG2 3.84Å; F270-T274 PolarHBondContact O-N 2.71Å; F270-T274 PolarHBondContact O-OG1 3.02Å
271I96.1Very high95.6Very high3 Ų351.8 Ų51.82%0.01527%0.269CS..Hα-helixtrans-63.1-27.4-177.165.9173.7000112.5Y267 F268 T274 T275 I276 G277 F278Y267-I271 HydrophobicContact CD1-CD1 4.45Å; Y267-I271 HydrophobicContact CD2-CG2 3.97Å; Y267-I271 HydrophobicContact CE1-CD1 3.88Å; Y267-I271 HydrophobicContact CE2-CG2 3.62Å; Y267-I271 WeakPolarHBondContact O-CG1 3.49Å; Y267-I271 PolarHBondContact O-N 3.25Å; F268-I271 WeakPolarHBondContact O-CG1 3.48Å; I271-T274 PolarHBondContact O-OG1 2.96Å; I271-T275 PolarHBondContact O-N 2.87Å; I271-I276 HydrophobicContact CB-CB 4.27Å; I271-I276 PolarHBondContact O-N 3.46Å; I271-G277 PolarHBondContact O-N 2.79Å; I271-F278 HydrophobicContact CD1-CB 4.39Å; I271-F278 HydrophobicContact CD1-CD2 4.31Å; I271-F278 HydrophobicContact CG2-CD2 4.21Å; I271-F278 HydrophobicContact CG2-CE2 4.38Å
272T96.3Very high95.5Very high0 Ų047 Ų470%024%0.244CC..Hα-helixtrans-72.8-46.8175.9-61.40000111I127 Y129 F268 F270 T275 I296I127-T272 HydrophobicContact CD1-CG2 4.18Å; Y129-T272 WeakPolarHBondContact OH-CG2 3.38Å; Y129-T272 PolarHBondContact OH-OG1 3.44Å; F268-T272 WeakPolarHBondContact O-CB 3.23Å; F268-T272 PolarHBondContact O-N 3.33Å; F268-T272 VanDerWaalsContact O-N 3.07Å; F268-T272 PolarHBondContact O-OG1 3.02Å; F270-T272 PolarHBondContact O-N 3.47Å; T272-T275 PolarHBondContact O-N 2.87Å; T272-T275 VanDerWaalsContact O-N 3.15Å; T272-I296 HydrophobicContact CG2-CD1 3.95Å; T272-I296 HydrophobicContact CG2-CG1 3.7Å; T272-I296 HydrophobicContact CG2-CG2 4.49Å
273M94.6Very high95.2Very high3 Ų343.1 Ų43.12%0.01523%0.227CC..Hα-helixtrans-68-35.6-179.8-68.9-49.2148.600113Y246 I247 S269 F270 T275 Y295 G299 T303Y246-M273 HydrophobicContact CE1-CE 3.96Å; Y246-M273 HydrophobicContact CE1-SD 4.32Å; I247-M273 HydrophobicContact CG1-CG 4.22Å; S269-M273 WeakPolarHBondContact O-CB 3.22Å; S269-M273 WeakPolarHBondContact O-CG 3.3Å; S269-M273 PolarHBondContact O-N 3.45Å; F270-M273 PolarHBondContact O-N 2.94Å; F270-M273 VanDerWaalsContact O-N 3.13Å; M273-T275 PolarHBondContact O-N 3.31Å; M273-Y295 HydrophobicContact CE-CD1 3.61Å; M273-Y295 HydrophobicContact CE-CE1 3.05Å; M273-Y295 HydrophobicContact CE-CE2 4.4Å; M273-Y295 HydrophobicContact CE-CG 4.46Å; M273-Y295 VanDerWaalsContact CE-CZ 3.5Å; M273-G299 WeakPolarHBondContact SD-CA 3.29Å; M273-T303 WeakPolarHBondContact O-CG2 3.26Å
274T94.5Very high94.7Very high49 Ų4946 Ų4630%0.30123%0.234SC..THydrogen-bonded Turntrans-827.6175600000113.3F270 I271 I276F270-T274 HydrophobicContact CD2-CG2 4.26Å; F270-T274 HydrophobicContact CE1-CG2 4.2Å; F270-T274 HydrophobicContact CE2-CG2 3.87Å; F270-T274 HydrophobicContact CZ-CG2 3.84Å; F270-T274 PolarHBondContact O-N 2.71Å; F270-T274 PolarHBondContact O-OG1 3.02Å; I271-T274 PolarHBondContact O-OG1 2.96Å; T274-I276 PolarHBondContact O-N 3.26Å; T274-I276 VanDerWaalsContact O-N 3.11Å; T274-I276 VanDerWaalsContact OG1-CD1 3.25Å; T274-I276 WeakPolarHBondContact OG1-CD1 3.28Å; T274-I276 WeakPolarHBondContact OG1-CG1 3.35Å
275T95.5Very high94.2Very high57 Ų5746 Ų4635%0.3523%0.233SC..THydrogen-bonded Turntrans50.535.3-178.762.70000113.7I127 I271 T272 M273 L300I127-T275 HydrophobicContact CG1-CG2 4.06Å; I271-T275 PolarHBondContact O-N 2.87Å; T272-T275 PolarHBondContact O-N 2.87Å; T272-T275 VanDerWaalsContact O-N 3.15Å; M273-T275 PolarHBondContact O-N 3.31Å; T275-L300 HydrophobicContact CG2-CD2 3.39Å
276I96Very high93.7Very high79 Ų7947.8 Ų47.841%0.40524%0.242SC..  trans-80.8-48.2174-66.1170.1000109.3I271 T274 F278I271-I276 HydrophobicContact CB-CB 4.27Å; I271-I276 PolarHBondContact O-N 3.46Å; T274-I276 PolarHBondContact O-N 3.26Å; T274-I276 VanDerWaalsContact O-N 3.11Å; T274-I276 VanDerWaalsContact OG1-CD1 3.25Å; T274-I276 WeakPolarHBondContact OG1-CD1 3.28Å; T274-I276 WeakPolarHBondContact OG1-CG1 3.35Å; I276-F278 HydrophobicContact CG2-CD1 3.96Å; I276-F278 HydrophobicContact CG2-CD2 3.86Å; I276-F278 HydrophobicContact CG2-CE1 3.65Å; I276-F278 HydrophobicContact CG2-CE2 3.56Å; I276-F278 HydrophobicContact CG2-CG 4.06Å; I276-F278 HydrophobicContact CG2-CZ 3.45Å; I276-F278 VanDerWaalsContact CG2-CZ 3.45Å
277G94.2Very high93.2Very high6 Ų648.2 Ų48.26%0.06225%0.254CS..  trans57.353169.200000115.7Y129 I271 G279Y129-G277 WeakPolarHBondContact CA-O 3.36Å; I271-G277 PolarHBondContact O-N 2.79Å; G277-G279 PolarHBondContact O-N 3.38Å
278F94.6Very high92.9Very high131 Ų13147.7 Ų47.758%0.57525%0.254SS*.  trans-59.1-31.4178.6-69.1-53.2000114.2Y267 I271 I276 D280Y267-F278 VanDerWaalsContact OH-CD2 3.3Å; Y267-F278 WeakPolarHBondContact OH-CD2 3.46Å; I271-F278 HydrophobicContact CD1-CB 4.39Å; I271-F278 HydrophobicContact CD1-CD2 4.31Å; I271-F278 HydrophobicContact CG2-CD2 4.21Å; I271-F278 HydrophobicContact CG2-CE2 4.38Å; I276-F278 HydrophobicContact CG2-CD1 3.96Å; I276-F278 HydrophobicContact CG2-CD2 3.86Å; I276-F278 HydrophobicContact CG2-CE1 3.65Å; I276-F278 HydrophobicContact CG2-CE2 3.56Å; I276-F278 HydrophobicContact CG2-CG 4.06Å; I276-F278 HydrophobicContact CG2-CZ 3.45Å; I276-F278 VanDerWaalsContact CG2-CZ 3.45Å; F278-D280 PolarHBondContact O-N 2.89Å
279G92.2Very high92.8Very high19 Ų1948.7 Ų48.720%0.19626%0.258CS..  trans72.314.9177.500000115.4Y129 G277Y129-G279 VanDerWaalsContact O-CA 3.3Å; Y129-G279 WeakPolarHBondContact O-CA 3.35Å; G277-G279 PolarHBondContact O-N 3.38Å
280D93.1Very high92.5Very high94 Ų9453.9 Ų53.950%0.50328%0.281SS..SBendtrans-66.3-38.3165.854.9-20.3000112Y267 F278Y267-D280 WeakPolarHBondContact CE1-OD2 3.26Å; Y267-D280 VanDerWaalsContact CZ-OD2 3.3Å; Y267-D280 PolarHBondContact OH-OD2 3.24Å; F278-D280 PolarHBondContact O-N 2.89Å
281L93.6Very high92.3Very high37 Ų3752.5 Ų52.519%0.19428%0.284CS..SBendtrans-116.8127168.1-64177.4000109.9W260 D264 Y267 F268W260-L281 HydrophobicContact CH2-CB 4.17Å; W260-L281 HydrophobicContact CZ3-CB 4.38Å; D264-L281 HydrophobicContact CB-CD1 3.79Å; Y267-L281 HydrophobicContact CD1-CD1 3.92Å; Y267-L281 HydrophobicContact CE1-CD1 4.29Å; F268-L281 HydrophobicContact CB-CB 4.41Å; F268-L281 HydrophobicContact CB-CD1 4.44Å; F268-L281 HydrophobicContact CD2-CB 4.09Å; F268-L281 WeakPolarHBondContact CD2-O 3.34Å; F268-L281 WeakPolarHBondContact CE2-O 3.35Å
282V92.8Very high92.2Very high15 Ų1552.4 Ų52.49%0.09128%0.283CS..  trans-145.9139174.2-1740000108.1F118 Y129 N131 W260 E284F118-V282 HydrophobicContact CE1-CG1 3.99Å; Y129-V282 HydrophobicContact CD1-CG2 4.08Å; Y129-V282 HydrophobicContact CD2-CG1 4.1Å; Y129-V282 HydrophobicContact CD2-CG2 4.14Å; Y129-V282 HydrophobicContact CE2-CG1 4.41Å; Y129-V282 HydrophobicContact CG-CG2 3.74Å; N131-V282 HydrophobicContact CB-CG2 4.25Å; W260-V282 WeakPolarHBondContact CZ2-O 3.25Å; V282-E284 PolarHBondContact O-N 3.46Å
283P91.9Very high92.1Very high1 Ų153.7 Ų53.71%0.00629%0.29CS..  trans-53.3126177.3-30.338.8000111F254 E258 W260 F268 Y289 V292F254-P283 HydrophobicContact CD1-CG 4.4Å; F254-P283 HydrophobicContact CE1-CG 4.03Å; E258-P283 HydrophobicContact CG-CB 4.21Å; E258-P283 WeakPolarHBondContact OE1-CB 3.5Å; W260-P283 HydrophobicContact CH2-CG 4.23Å; F268-P283 HydrophobicContact CE1-CG 4.23Å; F268-P283 HydrophobicContact CZ-CG 3.95Å; P283-Y289 HydrophobicContact CB-CE1 4.3Å; P283-Y289 VanDerWaalsContact O-CE1 3.27Å; P283-Y289 WeakPolarHBondContact O-CE1 3.32Å; P283-Y289 PolarHBondContact O-OH 3.48Å; P283-V292 HydrophobicContact CB-CG2 4.37Å; P283-V292 HydrophobicContact CG-CG1 4.07Å; P283-V292 HydrophobicContact CG-CG2 4.18Å
284E85.7Confident92.1Very high165 Ų16559.2 Ų59.277%0.77132%0.319SS*.  trans-89.8-27.4-179.7-65.2-167.3165.300111.1E258 V282 Q286E258-E284 PolarHBondContact OE2-N 3.32Å; V282-E284 PolarHBondContact O-N 3.46Å; E284-Q286 PolarHBondContact O-N 2.83Å
285N86.2Confident92.1Very high67 Ų6757.3 Ų57.336%0.35831%0.306SS..  trans-78.196.3-176.1-168.4-13000111.8E258 A287 H288 Y289E258-N285 PolarHBondContact OE1-N 2.96Å; N285-A287 PolarHBondContact O-N 2.85Å; N285-A287 VanDerWaalsContact OD1-CB 3.25Å; N285-A287 WeakPolarHBondContact OD1-CB 3.44Å; N285-A287 PolarHBondContact OD1-N 3.03Å; N285-A287 VanDerWaalsContact OD1-N 3.12Å; N285-H288 PolarHBondContact ND2-CD2 3.06Å; N285-H288 VanDerWaalsContact ND2-CD2 3.26Å; N285-H288 PolarHBondContact ND2-NE2 2.9Å; N285-H288 PolarHBondContact O-N 2.83Å; N285-Y289 WeakPolarHBondContact O-CD1 3.4Å
286Q86.3Confident92.1Very high38 Ų3854.6 Ų54.618%0.17829%0.29CS..G310 helixtrans-56.4-20179.1-61.1-169.60.200114.4T112 R114 E284 H288 Y289T112-Q286 PolarHBondContact OG1-OE1 2.78Å; R114-Q286 WeakPolarHBondContact CD-O 3.48Å; E284-Q286 PolarHBondContact O-N 2.83Å; Q286-H288 PolarHBondContact O-N 2.88Å; Q286-Y289 HydrophobicContact CB-CD2 4.45Å; Q286-Y289 HydrophobicContact CB-CE2 4.24Å; Q286-Y289 HydrophobicContact CG-CE1 4.4Å; Q286-Y289 HydrophobicContact CG-CE2 3.85Å
287A88.1Confident92Very high67 Ų6752.8 Ų52.855%0.55428%0.28SS*.G310 helixtrans-65.3-29.2176.900000112.3N285N285-A287 PolarHBondContact O-N 2.85Å; N285-A287 VanDerWaalsContact OD1-CB 3.25Å; N285-A287 WeakPolarHBondContact OD1-CB 3.44Å; N285-A287 PolarHBondContact OD1-N 3.03Å; N285-A287 VanDerWaalsContact OD1-N 3.12Å
288H90.9Very high91.9Very high70 Ų7054.9 Ų54.932%0.32429%0.292SS..G310 helixtrans-99.2-0.3-174.6-61.5-61.1000114.2V257 N285 Q286 F290 S291 V292V257-H288 HydrophobicContact CG1-CB 3.9Å; V257-H288 VanDerWaalsContact CG1-CD2 3.41Å; V257-H288 WeakPolarHBondContact CG1-CD2 3.49Å; N285-H288 PolarHBondContact ND2-CD2 3.06Å; N285-H288 VanDerWaalsContact ND2-CD2 3.26Å; N285-H288 PolarHBondContact ND2-NE2 2.9Å; N285-H288 PolarHBondContact O-N 2.83Å; Q286-H288 PolarHBondContact O-N 2.88Å; H288-F290 PolarHBondContact O-N 3Å; H288-F290 VanDerWaalsContact O-N 3.1Å; H288-S291 WeakPolarHBondContact O-CA 3.35Å; H288-S291 WeakPolarHBondContact O-CB 3.3Å; H288-S291 PolarHBondContact O-N 3.15Å; H288-V292 WeakPolarHBondContact O-CG2 3.44Å; H288-V292 PolarHBondContact O-N 3.3Å
289Y92.4Very high92Very high21 Ų2148.7 Ų48.78%0.08226%0.264CS..Hα-helixtrans-54.5-35.9-175.9-77.48.2000114.1R114 A115 F118 P283 N285 Q286 V292 L293R114-Y289 HydrophobicContact CB-CD2 4.42Å; A115-Y289 HydrophobicContact CB-CE2 3.99Å; F118-Y289 HydrophobicContact CB-CD2 3.66Å; F118-Y289 HydrophobicContact CB-CE2 4.18Å; F118-Y289 HydrophobicContact CB-CG 4.22Å; F118-Y289 HydrophobicContact CD1-CE2 4.47Å; F118-Y289 HydrophobicContact CD2-CD2 4.48Å; F118-Y289 HydrophobicContact CD2-CG 4.25Å; F118-Y289 HydrophobicContact CG-CD2 4Å; F118-Y289 HydrophobicContact CG-CE2 4.37Å; F118-Y289 HydrophobicContact CG-CG 4.22Å; P283-Y289 HydrophobicContact CB-CE1 4.3Å; P283-Y289 VanDerWaalsContact O-CE1 3.27Å; P283-Y289 WeakPolarHBondContact O-CE1 3.32Å; P283-Y289 PolarHBondContact O-OH 3.48Å; N285-Y289 WeakPolarHBondContact O-CD1 3.4Å; Q286-Y289 HydrophobicContact CB-CD2 4.45Å; Q286-Y289 HydrophobicContact CB-CE2 4.24Å; Q286-Y289 HydrophobicContact CG-CE1 4.4Å; Q286-Y289 HydrophobicContact CG-CE2 3.85Å; Y289-V292 PolarHBondContact O-N 2.7Å; Y289-L293 VanDerWaalsContact O-CB 3.26Å; Y289-L293 WeakPolarHBondContact O-CB 3.47Å; Y289-L293 PolarHBondContact O-N 3.23Å
290F91.9Very high92.1Very high109 Ų10948.1 Ų48.148%0.47826%0.257SS..Hα-helixtrans-66.4-41.8175.7-69.6-68.3000112.6R114 I117 H288 L293 L294R114-F290 HydrophobicContact CG-CE2 3.76Å; R114-F290 HydrophobicContact CG-CZ 4.16Å; I117-F290 HydrophobicContact CD1-CE1 4.08Å; I117-F290 HydrophobicContact CD1-CZ 4.17Å; I117-F290 HydrophobicContact CG2-CE1 4.46Å; H288-F290 PolarHBondContact O-N 3Å; H288-F290 VanDerWaalsContact O-N 3.1Å; F290-L293 PolarHBondContact O-N 3.43Å; F290-L294 PolarHBondContact O-N 2.63Å
291S92.1Very high92.2Very high72 Ų7245 Ų4550%0.50324%0.24SC..Hα-helixtrans-66-41.7176.4-55.50000111.1H288 L294 Y295H288-S291 WeakPolarHBondContact O-CA 3.35Å; H288-S291 WeakPolarHBondContact O-CB 3.3Å; H288-S291 PolarHBondContact O-N 3.15Å; S291-L294 PolarHBondContact O-N 3.2Å; S291-Y295 PolarHBondContact O-N 3.36Å
292V94Very high92.2Very high1 Ų144 Ų441%0.00623%0.234CC..Hα-helixtrans-62.2-45.1174.2178.60000110.7F118 F254 P283 H288 Y289 L294 Y295 I296F118-V292 HydrophobicContact CE2-CB 4.27Å; F118-V292 HydrophobicContact CE2-CG1 3.73Å; F118-V292 HydrophobicContact CZ-CG1 4.2Å; F254-V292 HydrophobicContact CE1-CB 4.41Å; F254-V292 HydrophobicContact CE1-CG1 3.98Å; F254-V292 HydrophobicContact CE1-CG2 3.72Å; F254-V292 HydrophobicContact CZ-CG1 4.03Å; F254-V292 HydrophobicContact CZ-CG2 4.39Å; P283-V292 HydrophobicContact CB-CG2 4.37Å; P283-V292 HydrophobicContact CG-CG1 4.07Å; P283-V292 HydrophobicContact CG-CG2 4.18Å; H288-V292 WeakPolarHBondContact O-CG2 3.44Å; H288-V292 PolarHBondContact O-N 3.3Å; Y289-V292 PolarHBondContact O-N 2.7Å; V292-L294 VanDerWaalsContact C-N 3.32Å; V292-L294 PolarHBondContact O-N 3.33Å; V292-Y295 WeakPolarHBondContact O-CB 3.33Å; V292-Y295 PolarHBondContact O-N 2.73Å; V292-I296 HydrophobicContact CG1-CD1 3.92Å; V292-I296 HydrophobicContact CG1-CG1 4.36Å; V292-I296 WeakPolarHBondContact O-CG1 3.25Å; V292-I296 PolarHBondContact O-N 3.3Å
293L93.8Very high92.4Very high26 Ų2643.8 Ų43.814%0.13623%0.233CC..Hα-helixtrans-62.3-40.4178.7179.959.1000111.9I117 A121 Y289 F290 Y295 I296 M297I117-L293 HydrophobicContact CG2-CD2 4.09Å; A121-L293 HydrophobicContact CB-CD1 3.4Å; A121-L293 HydrophobicContact CB-CD2 4.04Å; A121-L293 HydrophobicContact CB-CG 4.38Å; Y289-L293 VanDerWaalsContact O-CB 3.26Å; Y289-L293 WeakPolarHBondContact O-CB 3.47Å; Y289-L293 PolarHBondContact O-N 3.23Å; F290-L293 PolarHBondContact O-N 3.43Å; L293-Y295 VanDerWaalsContact C-N 3.34Å; L293-Y295 PolarHBondContact O-N 3.07Å; L293-I296 PolarHBondContact O-N 2.9Å; L293-M297 HydrophobicContact CD1-CE 4.17Å; L293-M297 HydrophobicContact CD1-CG 4.38Å; L293-M297 VanDerWaalsContact O-CG 3.27Å; L293-M297 WeakPolarHBondContact O-CG 3Å; L293-M297 PolarHBondContact O-N 2.93Å
294L93.4Very high92.4Very high119 Ų11945.3 Ų45.362%0.62324%0.242SC*.Hα-helixtrans-61.9-42.7174.7-177.766.3000111.6F290 S291 V292 M297 V298F290-L294 PolarHBondContact O-N 2.63Å; S291-L294 PolarHBondContact O-N 3.2Å; V292-L294 VanDerWaalsContact C-N 3.32Å; V292-L294 PolarHBondContact O-N 3.33Å; L294-M297 PolarHBondContact O-N 3.45Å; L294-V298 WeakPolarHBondContact O-CG2 3.48Å; L294-V298 PolarHBondContact O-N 3.05Å; L294-V298 VanDerWaalsContact O-N 3.11Å
295Y94.9Very high92.7Very high10 Ų1037.8 Ų37.84%0.03921%0.207CC..Hα-helixtrans-60.3-48.5173.5174-98.6000111.3Y246 F249 G250 F254 M273 S291 V292 L293 M297 V298 G299Y246-Y295 HydrophobicContact CD1-CE2 4.03Å; Y246-Y295 AromaticContact CE1-CD2 3.9Å; Y246-Y295 HydrophobicContact CE1-CD2 3.9Å; Y246-Y295 HydrophobicContact CE1-CE1 4.48Å; Y246-Y295 AromaticContact CE1-CE2 3.3Å; Y246-Y295 HydrophobicContact CE1-CE2 3.3Å; Y246-Y295 AromaticContact CE1-CZ 3.62Å; Y246-Y295 HydrophobicContact CE2-CD2 4.4Å; Y246-Y295 HydrophobicContact CE2-CE2 4.19Å; Y246-Y295 AromaticContact CZ-CD2 3.59Å; Y246-Y295 AromaticContact CZ-CE2 3.41Å; Y246-Y295 VanDerWaalsContact CZ-CE2 3.41Å; Y246-Y295 PolarHBondContact O-OH 3.01Å; Y246-Y295 WeakPolarHBondContact OH-CD2 3.49Å; Y246-Y295 WeakPolarHBondContact OH-CE2 3.43Å; Y246-Y295 PolarHBondContact OH-O 3.5Å; F249-Y295 HydrophobicContact CD1-CE2 4.38Å; G250-Y295 VanDerWaalsContact CA-CE2 3.47Å; G250-Y295 VanDerWaalsContact CA-OH 3.3Å; G250-Y295 WeakPolarHBondContact CA-OH 3.35Å; F254-Y295 AromaticContact CE2-CD1 3.75Å; F254-Y295 HydrophobicContact CE2-CD1 3.75Å; F254-Y295 AromaticContact CE2-CE1 3.57Å; F254-Y295 HydrophobicContact CE2-CE1 3.57Å; F254-Y295 AromaticContact CZ-CD1 3.79Å; F254-Y295 HydrophobicContact CZ-CD1 3.79Å; F254-Y295 HydrophobicContact CZ-CE1 4.1Å; M273-Y295 HydrophobicContact CE-CD1 3.61Å; M273-Y295 HydrophobicContact CE-CE1 3.05Å; M273-Y295 HydrophobicContact CE-CE2 4.4Å; M273-Y295 HydrophobicContact CE-CG 4.46Å; M273-Y295 VanDerWaalsContact CE-CZ 3.5Å; S291-Y295 PolarHBondContact O-N 3.36Å; V292-Y295 WeakPolarHBondContact O-CB 3.33Å; V292-Y295 PolarHBondContact O-N 2.73Å; L293-Y295 VanDerWaalsContact C-N 3.34Å; L293-Y295 PolarHBondContact O-N 3.07Å; Y295-M297 VanDerWaalsContact C-N 3.35Å; Y295-M297 PolarHBondContact O-N 3.36Å; Y295-V298 PolarHBondContact O-N 2.62Å; Y295-G299 PolarHBondContact O-N 3.41Å
296I95.4Very high93Very high0 Ų035.1 Ų35.10%019%0.193CC..Hα-helixtrans-57.9-46.9176.8-67.5174.1000110.9F118 I127 T272 V292 L293 V298 G299 L300F118-I296 HydrophobicContact CE2-CD1 4.1Å; F118-I296 HydrophobicContact CZ-CD1 4.32Å; I127-I296 HydrophobicContact CD1-CG2 3.5Å; I127-I296 VanDerWaalsContact CD1-CG2 3.5Å; T272-I296 HydrophobicContact CG2-CD1 3.95Å; T272-I296 HydrophobicContact CG2-CG1 3.7Å; T272-I296 HydrophobicContact CG2-CG2 4.49Å; V292-I296 HydrophobicContact CG1-CD1 3.92Å; V292-I296 HydrophobicContact CG1-CG1 4.36Å; V292-I296 WeakPolarHBondContact O-CG1 3.25Å; V292-I296 PolarHBondContact O-N 3.3Å; L293-I296 PolarHBondContact O-N 2.9Å; I296-V298 PolarHBondContact O-N 2.93Å; I296-G299 PolarHBondContact O-N 3.19Å; I296-L300 HydrophobicContact CG2-CD1 3.81Å; I296-L300 HydrophobicContact CG2-CG 4.1Å; I296-L300 WeakPolarHBondContact O-CB 3.13Å; I296-L300 VanDerWaalsContact O-CG 3.26Å; I296-L300 WeakPolarHBondContact O-CG 3.35Å; I296-L300 PolarHBondContact O-N 3.37Å
297M93.7Very high93.3Very high40 Ų4038.5 Ų38.520%0.19721%0.212CC..Hα-helixtrans-58.1-51.4180-73.9-69.4108.300112.4T125 L293 L294 Y295 G299 L300 M301T125-M297 HydrophobicContact CG2-CE 3.34Å; L293-M297 HydrophobicContact CD1-CE 4.17Å; L293-M297 HydrophobicContact CD1-CG 4.38Å; L293-M297 VanDerWaalsContact O-CG 3.27Å; L293-M297 WeakPolarHBondContact O-CG 3Å; L293-M297 PolarHBondContact O-N 2.93Å; L294-M297 PolarHBondContact O-N 3.45Å; Y295-M297 VanDerWaalsContact C-N 3.35Å; Y295-M297 PolarHBondContact O-N 3.36Å; M297-G299 VanDerWaalsContact C-N 3.32Å; M297-G299 PolarHBondContact O-N 3.29Å; M297-L300 HydrophobicContact CE-CD1 4.35Å; M297-L300 PolarHBondContact O-N 3.33Å; M297-M301 HydrophobicContact CB-CE 4.46Å; M297-M301 WeakPolarHBondContact O-CG 3.1Å; M297-M301 PolarHBondContact O-N 2.98Å; M297-M301 VanDerWaalsContact O-N 3.14Å
298V93.9Very high93.4Very high51 Ų5137.4 Ų37.431%0.30920%0.196SC..Hα-helixtrans-65.3-39.6-179.9172.60000110.9Y246 L294 Y295 I296 M301 L302Y246-V298 HydrophobicContact CE2-CB 4.48Å; Y246-V298 HydrophobicContact CE2-CG1 3.77Å; Y246-V298 WeakPolarHBondContact OH-CB 3.47Å; L294-V298 WeakPolarHBondContact O-CG2 3.48Å; L294-V298 PolarHBondContact O-N 3.05Å; L294-V298 VanDerWaalsContact O-N 3.11Å; Y295-V298 PolarHBondContact O-N 2.62Å; I296-V298 PolarHBondContact O-N 2.93Å; V298-M301 WeakPolarHBondContact O-CB 3.42Å; V298-M301 PolarHBondContact O-N 3.36Å; V298-L302 HydrophobicContact CG1-CD1 4.27Å; V298-L302 WeakPolarHBondContact O-CG 3.34Å; V298-L302 PolarHBondContact O-N 3.46Å
299G95.3Very high93.2Very high0 Ų034.2 Ų34.20%018%0.182CC..Hα-helixtrans-70.2-36.4-179.500000114.1Y246 M273 Y295 I296 M297 L302 T303Y246-G299 PolarHBondContact OH-N 3.03Å; M273-G299 WeakPolarHBondContact SD-CA 3.29Å; Y295-G299 PolarHBondContact O-N 3.41Å; I296-G299 PolarHBondContact O-N 3.19Å; M297-G299 VanDerWaalsContact C-N 3.32Å; M297-G299 PolarHBondContact O-N 3.29Å; G299-L302 PolarHBondContact O-N 3.47Å; G299-T303 WeakPolarHBondContact O-CB 3.43Å; G299-T303 PolarHBondContact O-N 3.25Å; G299-T303 PolarHBondContact O-OG1 3.21Å
300L95.5Very high93.1Very high7 Ų734.6 Ų34.64%0.03719%0.186CC..Hα-helixtrans-63.5-42.4170.5-70.4178000110.8T125 I127 I158 T275 I296 M297 L302 T303 T304T125-L300 HydrophobicContact CG2-CD1 3.65Å; I127-L300 HydrophobicContact CD1-CD1 4.26Å; I158-L300 HydrophobicContact CD1-CB 4.2Å; I158-L300 HydrophobicContact CD1-CD1 3.88Å; I158-L300 HydrophobicContact CG2-CB 4.23Å; T275-L300 HydrophobicContact CG2-CD2 3.39Å; I296-L300 HydrophobicContact CG2-CD1 3.81Å; I296-L300 HydrophobicContact CG2-CG 4.1Å; I296-L300 WeakPolarHBondContact O-CB 3.13Å; I296-L300 VanDerWaalsContact O-CG 3.26Å; I296-L300 WeakPolarHBondContact O-CG 3.35Å; I296-L300 PolarHBondContact O-N 3.37Å; M297-L300 HydrophobicContact CE-CD1 4.35Å; M297-L300 PolarHBondContact O-N 3.33Å; L300-L302 VanDerWaalsContact C-N 3.35Å; L300-L302 PolarHBondContact O-N 2.93Å; L300-T303 PolarHBondContact O-N 2.97Å; L300-T304 WeakPolarHBondContact O-CB 3.47Å; L300-T304 PolarHBondContact O-N 3.03Å; L300-T304 PolarHBondContact O-OG1 3Å; L300-T304 VanDerWaalsContact O-OG1 3.06Å
301M94.2Very high93.1Very high30 Ų3030.8 Ų30.815%0.14818%0.177CC..Hα-helixtrans-58.9-44.4174.7-65.9166.9-170.300112S161 L165 M297 V298 M305S161-M301 VanDerWaalsContact CB-SD 3.55Å; L165-M301 HydrophobicContact CD2-CB 4.22Å; M297-M301 HydrophobicContact CB-CE 4.46Å; M297-M301 WeakPolarHBondContact O-CG 3.1Å; M297-M301 PolarHBondContact O-N 2.98Å; M297-M301 VanDerWaalsContact O-N 3.14Å; V298-M301 WeakPolarHBondContact O-CB 3.42Å; V298-M301 PolarHBondContact O-N 3.36Å; M301-M305 VanDerWaalsContact O-CB 3.3Å; M301-M305 WeakPolarHBondContact O-CB 3.37Å; M301-M305 PolarHBondContact O-N 3.43Å
302L94.8Very high92.9Very high15 Ų1527.9 Ų27.98%0.07916%0.157CC..Hα-helixtrans-65.1-39.8176.5-76.8171.5000112.5L165 V242 L243 Y246 V298 G299 L300 T306L165-L302 HydrophobicContact CD2-CD2 3.39Å; L165-L302 HydrophobicContact CD2-CG 3.59Å; L165-L302 HydrophobicContact CG-CD2 4.17Å; V242-L302 HydrophobicContact CG1-CD2 4.22Å; L243-L302 HydrophobicContact CD1-CB 4.47Å; Y246-L302 HydrophobicContact CD1-CD1 3.94Å; Y246-L302 HydrophobicContact CD2-CD1 3.39Å; Y246-L302 HydrophobicContact CE1-CD1 4.37Å; Y246-L302 HydrophobicContact CE2-CD1 3.86Å; Y246-L302 HydrophobicContact CG-CD1 3.42Å; Y246-L302 VanDerWaalsContact CG-CD1 3.42Å; V298-L302 HydrophobicContact CG1-CD1 4.27Å; V298-L302 WeakPolarHBondContact O-CG 3.34Å; V298-L302 PolarHBondContact O-N 3.46Å; G299-L302 PolarHBondContact O-N 3.47Å; L300-L302 VanDerWaalsContact C-N 3.35Å; L300-L302 PolarHBondContact O-N 2.93Å; L302-T306 WeakPolarHBondContact O-CB 3.46Å; L302-T306 PolarHBondContact O-N 3.11Å; L302-T306 PolarHBondContact O-OG1 3.42Å
303T95.1Very high92.6Very high11 Ų1130.5 Ų30.57%0.06717%0.166CC..Hα-helixtrans-68.7-46.9-179.8-55.60000110.6L243 M273 G299 L300 M305 T306 I307L243-T303 WeakPolarHBondContact CD1-OG1 3.44Å; M273-T303 WeakPolarHBondContact O-CG2 3.26Å; G299-T303 WeakPolarHBondContact O-CB 3.43Å; G299-T303 PolarHBondContact O-N 3.25Å; G299-T303 PolarHBondContact O-OG1 3.21Å; L300-T303 PolarHBondContact O-N 2.97Å; T303-M305 PolarHBondContact O-N 3.16Å; T303-T306 WeakPolarHBondContact O-CB 3.37Å; T303-T306 PolarHBondContact O-N 3.04Å; T303-T306 VanDerWaalsContact O-N 3.13Å; T303-I307 HydrophobicContact CG2-CD1 4.05Å; T303-I307 WeakPolarHBondContact O-CG1 3.41Å; T303-I307 PolarHBondContact O-N 3.25Å
304T93.5Very high92.3Very high32 Ų3236 Ų3620%0.19619%0.187CC..Hα-helixtrans-58.5-46.8174.2-59.20000111.4I158 L300 T306 I307 D308I158-T304 HydrophobicContact CG2-CG2 4.5Å; I158-T304 WeakPolarHBondContact CG2-OG1 3.36Å; L300-T304 WeakPolarHBondContact O-CB 3.47Å; L300-T304 PolarHBondContact O-N 3.03Å; L300-T304 PolarHBondContact O-OG1 3Å; L300-T304 VanDerWaalsContact O-OG1 3.06Å; T304-T306 VanDerWaalsContact C-N 3.27Å; T304-T306 PolarHBondContact O-N 2.84Å; T304-I307 PolarHBondContact O-N 3.06Å; T304-D308 WeakPolarHBondContact O-CB 3.39Å; T304-D308 PolarHBondContact O-N 3.22Å
305M91.4Very high92Very high8 Ų835.3 Ų35.34%0.03918%0.182CC..Hα-helixtrans-58.8-39.4175.6-173.2-154.783.300112.3G166 M169 V239 M301 T303 L309G166-M305 WeakPolarHBondContact CA-SD 3.23Å; M169-M305 HydrophobicContact CE-CE 3.44Å; M169-M305 VanDerWaalsContact CE-CE 3.44Å; M169-M305 HydrophobicContact CE-SD 4Å; M169-M305 HydrophobicContact SD-CE 3.75Å; V239-M305 HydrophobicContact CG1-CE 3.42Å; V239-M305 VanDerWaalsContact CG1-CE 3.42Å; M301-M305 VanDerWaalsContact O-CB 3.3Å; M301-M305 WeakPolarHBondContact O-CB 3.37Å; M301-M305 PolarHBondContact O-N 3.43Å; T303-M305 PolarHBondContact O-N 3.16Å; M305-L309 WeakPolarHBondContact O-CB 3.48Å; M305-L309 PolarHBondContact O-N 2.72Å; M305-L309 VanDerWaalsContact O-N 3.07Å
306T92.9Very high91.6Very high10 Ų1035 Ų356%0.06118%0.181CC..Hα-helixtrans-66.2-46.3177.3-58.70000110.9V239 L243 L302 T303 T304 L309 V310V239-T306 HydrophobicContact CG1-CG2 4.08Å; L243-T306 HydrophobicContact CD2-CG2 3.92Å; L302-T306 WeakPolarHBondContact O-CB 3.46Å; L302-T306 PolarHBondContact O-N 3.11Å; L302-T306 PolarHBondContact O-OG1 3.42Å; T303-T306 WeakPolarHBondContact O-CB 3.37Å; T303-T306 PolarHBondContact O-N 3.04Å; T303-T306 VanDerWaalsContact O-N 3.13Å; T304-T306 VanDerWaalsContact C-N 3.27Å; T304-T306 PolarHBondContact O-N 2.84Å; T306-L309 PolarHBondContact O-N 3.1Å; T306-V310 HydrophobicContact CG2-CG2 3.97Å; T306-V310 WeakPolarHBondContact O-CB 3.33Å; T306-V310 WeakPolarHBondContact O-CG2 3.48Å; T306-V310 PolarHBondContact O-N 3.39Å
307I92.2Very high91.1Very high110 Ų11041 Ų4156%0.56421%0.207SC*.Hα-helixtrans-60.6-46.1177.1-68169.1000110.5T303 T304 G311T303-I307 HydrophobicContact CG2-CD1 4.05Å; T303-I307 WeakPolarHBondContact O-CG1 3.41Å; T303-I307 PolarHBondContact O-N 3.25Å; T304-I307 PolarHBondContact O-N 3.06Å; I307-G311 VanDerWaalsContact O-CA 3.23Å; I307-G311 WeakPolarHBondContact O-CA 3.45Å; I307-G311 PolarHBondContact O-N 2.66Å
308D89.2Confident90.8Very high44 Ų4444 Ų4424%0.23523%0.227CC..Hα-helixtrans-60.6-49.7179.9-73.5-12.8000111.6L228 T304 V312L228-D308 HydrophobicContact CD1-CB 4.26Å; T304-D308 WeakPolarHBondContact O-CB 3.39Å; T304-D308 PolarHBondContact O-N 3.22Å; D308-V312 WeakPolarHBondContact O-CG2 3.43Å; D308-V312 PolarHBondContact O-N 3.41Å
309L87.8Confident90.2Very high2 Ų246.1 Ų46.11%0.0123%0.234CC..Hα-helixtrans-71.3-48.8-176.9-179.665.3000112.6L223 F231 V239 M305 T306 G311 R313L223-L309 HydrophobicContact CD2-CD1 4.3Å; F231-L309 HydrophobicContact CB-CD1 3.4Å; F231-L309 VanDerWaalsContact CB-CD1 3.4Å; F231-L309 HydrophobicContact CD1-CD1 4.2Å; F231-L309 HydrophobicContact CD1-CD2 4.31Å; F231-L309 HydrophobicContact CG-CD1 4.06Å; V239-L309 HydrophobicContact CB-CD2 4.07Å; V239-L309 HydrophobicContact CG1-CD2 4.28Å; V239-L309 HydrophobicContact CG2-CD2 3.33Å; M305-L309 WeakPolarHBondContact O-CB 3.48Å; M305-L309 PolarHBondContact O-N 2.72Å; M305-L309 VanDerWaalsContact O-N 3.07Å; T306-L309 PolarHBondContact O-N 3.1Å; L309-G311 VanDerWaalsContact C-N 3.32Å; L309-R313 PolarHBondContact O-N 3.35Å
310V90.8Very high89.4Confident30 Ų3048.9 Ų48.918%0.18225%0.245CC..Hα-helixtrans-68.6-39.2-177.1176.30000109.3A236 T306 R313 Y314A236-V310 HydrophobicContact CB-CG2 4.35Å; T306-V310 HydrophobicContact CG2-CG2 3.97Å; T306-V310 WeakPolarHBondContact O-CB 3.33Å; T306-V310 WeakPolarHBondContact O-CG2 3.48Å; T306-V310 PolarHBondContact O-N 3.39Å; V310-R313 PolarHBondContact O-N 2.96Å; V310-Y314 HydrophobicContact CG1-CD2 3.41Å; V310-Y314 VanDerWaalsContact CG1-CD2 3.41Å; V310-Y314 HydrophobicContact CG1-CE2 3.36Å; V310-Y314 VanDerWaalsContact O-CD2 3.27Å; V310-Y314 WeakPolarHBondContact O-CD2 3.41Å; V310-Y314 PolarHBondContact O-N 3.36Å
311G90.5Very high88.8Confident28 Ų2855.2 Ų55.229%0.28927%0.272SS..Hα-helixtrans-55.1-54.2174.900000112.3I307 L309 R313 Y314 I315I307-G311 VanDerWaalsContact O-CA 3.23Å; I307-G311 WeakPolarHBondContact O-CA 3.45Å; I307-G311 PolarHBondContact O-N 2.66Å; L309-G311 VanDerWaalsContact C-N 3.32Å; G311-R313 VanDerWaalsContact C-N 3.3Å; G311-R313 PolarHBondContact O-N 2.86Å; G311-Y314 PolarHBondContact O-N 3.4Å; G311-I315 WeakPolarHBondContact O-CB 3.4Å; G311-I315 VanDerWaalsContact O-CG1 3.23Å; G311-I315 WeakPolarHBondContact O-CG1 3.44Å; G311-I315 PolarHBondContact O-N 3.23Å
312V88.5Confident88.1Confident12 Ų1255.3 Ų55.37%0.07328%0.281CS..Hα-helixtrans-58.3-42178.3172.50000111.8L219 E222 L223 V226 D308 I315 V316L219-V312 HydrophobicContact CD1-CG1 4.07Å; E222-V312 HydrophobicContact CB-CG1 3.78Å; L223-V312 HydrophobicContact CD2-CB 4.19Å; L223-V312 HydrophobicContact CD2-CG1 3.74Å; L223-V312 HydrophobicContact CG-CG1 3.9Å; V226-V312 HydrophobicContact CG2-CG2 4.05Å; D308-V312 WeakPolarHBondContact O-CG2 3.43Å; D308-V312 PolarHBondContact O-N 3.41Å; V312-I315 PolarHBondContact O-N 2.99Å; V312-V316 VanDerWaalsContact O-CG2 3.26Å; V312-V316 WeakPolarHBondContact O-CG2 3.43Å; V312-V316 PolarHBondContact O-N 2.92Å
313R87.2Confident87.3Confident55 Ų5557.4 Ų57.421%0.20829%0.288CS..Hα-helixtrans-63.9-42.6178.2-76.2179.5171.7-125.8-11.3113.2L219 F231 V232 I234 L309 V310 G311 K317L219-R313 HydrophobicContact CD1-CB 4.45Å; L219-R313 HydrophobicContact CD1-CG 3.76Å; L219-R313 HydrophobicContact CD2-CG 4.36Å; F231-R313 PolarHBondContact O-NH2 3.42Å; V232-R313 PolarHBondContact O-NH2 3.13Å; I234-R313 PolarHBondContact O-NH1 2.88Å; I234-R313 PolarHBondContact O-NH2 2.99Å; L309-R313 PolarHBondContact O-N 3.35Å; V310-R313 PolarHBondContact O-N 2.96Å; G311-R313 VanDerWaalsContact C-N 3.3Å; G311-R313 PolarHBondContact O-N 2.86Å; R313-K317 PolarHBondContact O-N 3.38Å; R313-K317 VanDerWaalsContact O-N 3.09Å
314Y88.5Confident86.3Confident143 Ų14358.7 Ų58.756%0.56130%0.3SS*.Hα-helixtrans-71.9-37.9177.6-82.9-72.3000111.8V310 G311 V316 K317 V318V310-Y314 HydrophobicContact CG1-CD2 3.41Å; V310-Y314 VanDerWaalsContact CG1-CD2 3.41Å; V310-Y314 HydrophobicContact CG1-CE2 3.36Å; V310-Y314 VanDerWaalsContact O-CD2 3.27Å; V310-Y314 WeakPolarHBondContact O-CD2 3.41Å; V310-Y314 PolarHBondContact O-N 3.36Å; G311-Y314 PolarHBondContact O-N 3.4Å; Y314-V316 VanDerWaalsContact C-N 3.31Å; Y314-V316 PolarHBondContact O-N 2.93Å; Y314-K317 PolarHBondContact O-N 2.94Å; Y314-K317 VanDerWaalsContact O-N 3.15Å; Y314-V318 WeakPolarHBondContact O-CB 3.35Å; Y314-V318 VanDerWaalsContact O-CG2 3.29Å; Y314-V318 WeakPolarHBondContact O-CG2 3.35Å; Y314-V318 PolarHBondContact O-N 2.92Å
315I87.4Confident85.3Confident104 Ų10461.4 Ų61.453%0.53331%0.312SS..Hα-helixtrans-57.2-46.3174-70.8164.4000110.3G311 V312 K317 V318 H319G311-I315 WeakPolarHBondContact O-CB 3.4Å; G311-I315 VanDerWaalsContact O-CG1 3.23Å; G311-I315 WeakPolarHBondContact O-CG1 3.44Å; G311-I315 PolarHBondContact O-N 3.23Å; V312-I315 PolarHBondContact O-N 2.99Å; I315-K317 VanDerWaalsContact C-N 3.34Å; I315-K317 PolarHBondContact O-N 2.9Å; I315-V318 PolarHBondContact O-N 3.27Å; I315-H319 WeakPolarHBondContact O-CB 3.45Å; I315-H319 PolarHBondContact O-N 3.25Å
316V85.8Confident84.3Confident3 Ų364.7 Ų64.72%0.01833%0.327CS..Hα-helixtrans-64.4-39.6177.3172.90000111.5Q215 L218 L219 E222 V312 Y314 V318 H319 Y320Q215-V316 HydrophobicContact CG-CG1 4.33Å; L218-V316 HydrophobicContact CB-CG1 3.88Å; L219-V316 HydrophobicContact CB-CG1 4.16Å; L219-V316 HydrophobicContact CB-CG2 4.37Å; L219-V316 HydrophobicContact CD1-CB 4.39Å; L219-V316 HydrophobicContact CD1-CG2 3.99Å; E222-V316 HydrophobicContact CB-CG2 3.85Å; E222-V316 HydrophobicContact CG-CG2 3.64Å; V312-V316 VanDerWaalsContact O-CG2 3.26Å; V312-V316 WeakPolarHBondContact O-CG2 3.43Å; V312-V316 PolarHBondContact O-N 2.92Å; Y314-V316 VanDerWaalsContact C-N 3.31Å; Y314-V316 PolarHBondContact O-N 2.93Å; V316-V318 VanDerWaalsContact C-N 3.35Å; V316-H319 PolarHBondContact O-N 2.96Å; V316-Y320 WeakPolarHBondContact O-CB 3.42Å; V316-Y320 PolarHBondContact O-N 3.49Å
317K85.9Confident83.2Confident125 Ų12567.3 Ų67.354%0.54334%0.341SS..Hα-helixtrans-65.3-39.9176.6-168.8176.3-178.5-179.10111.6R313 Y314 I315 F321R313-K317 PolarHBondContact O-N 3.38Å; R313-K317 VanDerWaalsContact O-N 3.09Å; Y314-K317 PolarHBondContact O-N 2.94Å; Y314-K317 VanDerWaalsContact O-N 3.15Å; I315-K317 VanDerWaalsContact C-N 3.34Å; I315-K317 PolarHBondContact O-N 2.9Å; K317-F321 WeakPolarHBondContact O-CB 3.22Å; K317-F321 PolarHBondContact O-N 3.19Å
318V85.3Confident81.8Confident103 Ų10363.8 Ų63.862%0.62433%0.329SS*.Hα-helixtrans-65.5-43.9174.1170.70000110.3Y314 I315 V316 F321 G322Y314-V318 WeakPolarHBondContact O-CB 3.35Å; Y314-V318 VanDerWaalsContact O-CG2 3.29Å; Y314-V318 WeakPolarHBondContact O-CG2 3.35Å; Y314-V318 PolarHBondContact O-N 2.92Å; I315-V318 PolarHBondContact O-N 3.27Å; V316-V318 VanDerWaalsContact C-N 3.35Å; V318-F321 PolarHBondContact O-N 3.4Å; V318-G322 PolarHBondContact O-N 3.15Å
319H81.5Confident80.7Confident97 Ų9763.6 Ų63.645%0.44933%0.33SS..Hα-helixtrans-62.2-44.2176.1-177.280.1000112I315 V316 G322 R323I315-H319 WeakPolarHBondContact O-CB 3.45Å; I315-H319 PolarHBondContact O-N 3.25Å; V316-H319 PolarHBondContact O-N 2.96Å; H319-G322 PolarHBondContact O-N 3.02Å; H319-R323 PolarHBondContact NE2-NE 3.37Å; H319-R323 PolarHBondContact O-N 2.47Å
320Y79.8Confident79.7Confident57 Ų5770.5 Ų70.522%0.22436%0.357CS..Hα-helixtrans-62.9-44.5175-178.2-91.5000111.7D211 Q215 V316 G322 R323 A324D211-Y320 WeakPolarHBondContact CB-OH 3.32Å; D211-Y320 VanDerWaalsContact CG-OH 3.3Å; D211-Y320 PolarHBondContact OD1-OH 2.88Å; Q215-Y320 HydrophobicContact CB-CD2 4.46Å; V316-Y320 WeakPolarHBondContact O-CB 3.42Å; V316-Y320 PolarHBondContact O-N 3.49Å; Y320-G322 VanDerWaalsContact C-N 3.33Å; Y320-G322 PolarHBondContact O-N 2.86Å; Y320-R323 PolarHBondContact O-N 3.44Å; Y320-A324 WeakPolarHBondContact O-CB 3.39Å; Y320-A324 PolarHBondContact O-N 2.76Å
321F82.6Confident78.6Confident140 Ų14072 Ų7261%0.61437%0.366SS*.Hα-helixtrans-62.4-40.2175.9-175.1-104.1000112.1K317 V318 A324 I325K317-F321 WeakPolarHBondContact O-CB 3.22Å; K317-F321 PolarHBondContact O-N 3.19Å; V318-F321 PolarHBondContact O-N 3.4Å; F321-A324 PolarHBondContact O-N 3.49Å; F321-I325 HydrophobicContact CD1-CD1 3.77Å; F321-I325 HydrophobicContact CE1-CD1 3.42Å; F321-I325 VanDerWaalsContact CE1-CD1 3.42Å; F321-I325 HydrophobicContact CE1-CG1 4.35Å; F321-I325 HydrophobicContact CZ-CD1 3.92Å; F321-I325 HydrophobicContact CZ-CG1 4.47Å; F321-I325 WeakPolarHBondContact O-CG1 3.31Å; F321-I325 PolarHBondContact O-N 2.98Å; F321-I325 VanDerWaalsContact O-N 3.08Å
322G80.3Confident77.9Confident32 Ų3276 Ų7633%0.3338%0.381SS..Hα-helixtrans-60.2-43.4173.500000112.8V318 H319 Y320 I325 Q326V318-G322 PolarHBondContact O-N 3.15Å; H319-G322 PolarHBondContact O-N 3.02Å; Y320-G322 VanDerWaalsContact C-N 3.33Å; Y320-G322 PolarHBondContact O-N 2.86Å; G322-I325 PolarHBondContact O-N 3.37Å; G322-Q326 PolarHBondContact O-N 3Å
323R77.4Confident77.4Confident59 Ų5978 Ų7822%0.22339%0.393CS..Hα-helixtrans-68.8-41.5174.7-69.9-165.5-57.4146.517.5112.5E214 H319 Y320 I325 Q326 D327E214-R323 VanDerWaalsContact CD-NH2 3.3Å; E214-R323 IonicContact OE1-CZ 3.99Å; E214-R323 IonicContact OE1-NH1 3.99Å; E214-R323 PolarHBondContact OE1-NH1 3.27Å; E214-R323 IonicContact OE1-NH2 3.81Å; E214-R323 PolarHBondContact OE1-NH2 2.89Å; H319-R323 PolarHBondContact NE2-NE 3.37Å; H319-R323 PolarHBondContact O-N 2.47Å; Y320-R323 PolarHBondContact O-N 3.44Å; R323-I325 PolarHBondContact O-N 3.5Å; R323-Q326 CarbonylContact O-C 3.3Å; R323-Q326 WeakPolarHBondContact O-CA 3.46Å; R323-Q326 WeakPolarHBondContact O-CB 3.3Å; R323-Q326 PolarHBondContact O-N 3.4Å; R323-D327 WeakPolarHBondContact O-CB 3.37Å; R323-D327 VanDerWaalsContact O-CG 3.32Å; R323-D327 PolarHBondContact O-N 2.99Å
324A74.1Confident77Confident38 Ų3880.5 Ų80.531%0.31441%0.41SS..Hα-helixtrans-59.4-32.6176.400000112.7Y320 F321 D327 A328Y320-A324 WeakPolarHBondContact O-CB 3.39Å; Y320-A324 PolarHBondContact O-N 2.76Å; F321-A324 PolarHBondContact O-N 3.49Å; A324-D327 PolarHBondContact O-N 2.86Å; A324-A328 VanDerWaalsContact O-CB 3.31Å; A324-A328 WeakPolarHBondContact O-CB 3.32Å; A324-A328 PolarHBondContact O-N 2.92Å
325I72.9Confident76.4Confident90 Ų9077 Ų7746%0.46240%0.4SS..Hα-helixtrans-68.4-44.3172.4-69.5165.7000111.4F321 G322 R323 D327 S329F321-I325 HydrophobicContact CD1-CD1 3.77Å; F321-I325 HydrophobicContact CE1-CD1 3.42Å; F321-I325 VanDerWaalsContact CE1-CD1 3.42Å; F321-I325 HydrophobicContact CE1-CG1 4.35Å; F321-I325 HydrophobicContact CZ-CD1 3.92Å; F321-I325 HydrophobicContact CZ-CG1 4.47Å; F321-I325 WeakPolarHBondContact O-CG1 3.31Å; F321-I325 PolarHBondContact O-N 2.98Å; F321-I325 VanDerWaalsContact O-N 3.08Å; G322-I325 PolarHBondContact O-N 3.37Å; R323-I325 PolarHBondContact O-N 3.5Å; I325-D327 PolarHBondContact O-N 3.23Å; I325-S329 PolarHBondContact O-N 3.07Å; I325-S329 PolarHBondContact O-OG 3.33Å
326Q70.5Confident75.7Confident76 Ų7676.2 Ų76.236%0.35542%0.418SS..Hα-helixtrans-62.6-37.3174.6-68.9179.5-39.900111.1G322 R323 S329 A388G322-Q326 PolarHBondContact O-N 3Å; R323-Q326 CarbonylContact O-C 3.3Å; R323-Q326 WeakPolarHBondContact O-CA 3.46Å; R323-Q326 WeakPolarHBondContact O-CB 3.3Å; R323-Q326 PolarHBondContact O-N 3.4Å; Q326-S329 VanDerWaalsContact O-CB 3.31Å; Q326-S329 WeakPolarHBondContact O-CB 3.26Å; Q326-S329 PolarHBondContact O-N 2.81Å; Q326-A388 PolarHBondContact NE2-O 3.24Å
327D69.3Low75.5Confident65 Ų6579.2 Ų79.235%0.34845%0.45SS..Hα-helixtrans-70.6-43.8-179.3-72-33.7000112.4R323 A324 I325 S329 Y330R323-D327 WeakPolarHBondContact O-CB 3.37Å; R323-D327 VanDerWaalsContact O-CG 3.32Å; R323-D327 PolarHBondContact O-N 2.99Å; A324-D327 PolarHBondContact O-N 2.86Å; I325-D327 PolarHBondContact O-N 3.23Å; D327-S329 PolarHBondContact O-N 3.1Å; D327-Y330 HydrophobicContact CB-CE1 3.84Å; D327-Y330 HydrophobicContact CB-CE2 4.46Å; D327-Y330 WeakPolarHBondContact CB-OH 2.83Å; D327-Y330 WeakPolarHBondContact O-CD1 3.41Å; D327-Y330 WeakPolarHBondContact O-CD2 3.5Å; D327-Y330 WeakPolarHBondContact O-CE1 3.27Å; D327-Y330 WeakPolarHBondContact O-CE2 3.46Å; D327-Y330 VanDerWaalsContact O-CG 3.22Å; D327-Y330 VanDerWaalsContact O-CZ 3.26Å; D327-Y330 PolarHBondContact O-N 2.82Å; D327-Y330 WeakPolarHBondContact OD1-CE1 3.42Å; D327-Y330 VanDerWaalsContact OD1-CZ 3.24Å; D327-Y330 PolarHBondContact OD1-OH 2.85Å
328A63.5Low75.2Confident37 Ų3782.2 Ų82.231%0.30646%0.458SS..Hα-helixtrans-58-32.4173.100000111.9A324 Y330 T331 L342A324-A328 VanDerWaalsContact O-CB 3.31Å; A324-A328 WeakPolarHBondContact O-CB 3.32Å; A324-A328 PolarHBondContact O-N 2.92Å; A328-Y330 VanDerWaalsContact C-N 3.26Å; A328-Y330 PolarHBondContact O-N 3.49Å; A328-T331 WeakPolarHBondContact O-CB 3.38Å; A328-T331 PolarHBondContact O-N 2.83Å; A328-T331 PolarHBondContact O-OG1 3.39Å; A328-L342 HydrophobicContact CB-CD2 4.05Å; A328-L342 VanDerWaalsContact O-CB 3.26Å; A328-L342 WeakPolarHBondContact O-CB 3.35Å; A328-L342 WeakPolarHBondContact O-CD2 3.5Å
329S66Low74.8Confident39 Ų3982.9 Ų82.927%0.27346%0.457SS..Hα-helixtrans-61.3-30.9-177.4-58.20000113.2I325 Q326 D327 E343I325-S329 PolarHBondContact O-N 3.07Å; I325-S329 PolarHBondContact O-OG 3.33Å; Q326-S329 VanDerWaalsContact O-CB 3.31Å; Q326-S329 WeakPolarHBondContact O-CB 3.26Å; Q326-S329 PolarHBondContact O-N 2.81Å; D327-S329 PolarHBondContact O-N 3.1Å; S329-E343 PolarHBondContact O-N 2.91Å
330Y65.8Low74.5Confident147 Ų14781.1 Ų81.158%0.57645%0.45SS*.THydrogen-bonded Turntrans-91.9-3.7176.759.4-115.3000114.7D327 A328 L332D327-Y330 HydrophobicContact CB-CE1 3.84Å; D327-Y330 HydrophobicContact CB-CE2 4.46Å; D327-Y330 WeakPolarHBondContact CB-OH 2.83Å; D327-Y330 WeakPolarHBondContact O-CD1 3.41Å; D327-Y330 WeakPolarHBondContact O-CD2 3.5Å; D327-Y330 WeakPolarHBondContact O-CE1 3.27Å; D327-Y330 WeakPolarHBondContact O-CE2 3.46Å; D327-Y330 VanDerWaalsContact O-CG 3.22Å; D327-Y330 VanDerWaalsContact O-CZ 3.26Å; D327-Y330 PolarHBondContact O-N 2.82Å; D327-Y330 WeakPolarHBondContact OD1-CE1 3.42Å; D327-Y330 VanDerWaalsContact OD1-CZ 3.24Å; D327-Y330 PolarHBondContact OD1-OH 2.85Å; A328-Y330 VanDerWaalsContact C-N 3.26Å; A328-Y330 PolarHBondContact O-N 3.49Å; Y330-L332 PolarHBondContact O-N 2.75Å
331T67.8Low74.5Confident61 Ų6179.5 Ų79.537%0.37445%0.447SS..PPolyproline II helixtrans-64.7130.4179.658.40000110.4A328 S341 L342A328-T331 WeakPolarHBondContact O-CB 3.38Å; A328-T331 PolarHBondContact O-N 2.83Å; A328-T331 PolarHBondContact O-OG1 3.39Å; T331-S341 CarbonylContact O-C 3.57Å; T331-L342 PolarHBondContact O-N 3.5Å
332L75.3Confident74.2Confident113 Ų11375 Ų7559%0.59243%0.429SS*.EExtended strand (participates in β ladder)trans-84116.7177.8-66.7165.6000109.4Y330 L339 M340Y330-L332 PolarHBondContact O-N 2.75Å; L332-L339 HydrophobicContact CB-CB 4.24Å; L332-L339 HydrophobicContact CB-CD2 3.46Å; L332-L339 VanDerWaalsContact CB-CD2 3.46Å; L332-L339 HydrophobicContact CB-CG 4.46Å; L332-L339 HydrophobicContact CD1-CD2 4.09Å; L332-L339 HydrophobicContact CD2-CB 4.44Å; L332-L339 HydrophobicContact CG-CD2 4.36Å; L332-M340 CarbonylContact C-O 3.4Å; L332-M340 VanDerWaalsContact CA-O 3.31Å; L332-M340 WeakPolarHBondContact CA-O 3.22Å
333V77.7Confident74Confident53 Ų5379.6 Ų79.632%0.32144%0.442SS..EExtended strand (participates in β ladder)trans-98.3130.4175.2-172.50000108.5I335 M340 L342V333-I335 HydrophobicContact CG1-CD1 4.39Å; V333-I335 HydrophobicContact CG1-CG1 4.01Å; V333-I335 PolarHBondContact O-N 3.4Å; V333-M340 PolarHBondContact N-O 3.46Å; V333-M340 PolarHBondContact O-N 3.35Å; V333-L342 HydrophobicContact CG2-CB 4.45Å; V333-L342 HydrophobicContact CG2-CD1 3.83Å
334N79.6Confident74Confident108 Ų10879.9 Ų79.958%0.57845%0.448SS*.EExtended strand (participates in β ladder)trans-81.6109.1174.6-1774.2000109.8G337 R338N334-G337 WeakPolarHBondContact OD1-CA 3.18Å; N334-G337 PolarHBondContact OD1-N 3.04Å; N334-G337 VanDerWaalsContact OD1-N 3.08Å; N334-R338 PolarHBondContact OD1-N 2.84Å
335I75.3Confident74.1Confident69 Ų6979.1 Ų79.135%0.35444%0.44SS..EExtended strand (participates in β ladder)trans-119.6114.3174.8-57.4-177.9000107.8V333 G337 R338 V345V333-I335 HydrophobicContact CG1-CD1 4.39Å; V333-I335 HydrophobicContact CG1-CG1 4.01Å; V333-I335 PolarHBondContact O-N 3.4Å; I335-G337 VanDerWaalsContact C-N 3.32Å; I335-G337 PolarHBondContact O-N 3.14Å; I335-R338 PolarHBondContact N-O 3.35Å; I335-R338 PolarHBondContact O-N 3.49Å; I335-V345 HydrophobicContact CD1-CB 4.26Å; I335-V345 HydrophobicContact CD1-CG1 3.64Å; I335-V345 HydrophobicContact CD1-CG2 3.52Å
336G73.5Confident74.3Confident88 Ų8879.8 Ų79.891%0.90744%0.443SS*.THydrogen-bonded Turntrans66.627.7176.900000114.9R338G336-R338 VanDerWaalsContact C-N 3.32Å
337G81.2Confident74.8Confident67 Ų6783.1 Ų83.169%0.69146%0.457SS*.THydrogen-bonded Turntrans84.80.6-179.100000114.3N334 I335N334-G337 WeakPolarHBondContact OD1-CA 3.18Å; N334-G337 PolarHBondContact OD1-N 3.04Å; N334-G337 VanDerWaalsContact OD1-N 3.08Å; I335-G337 VanDerWaalsContact C-N 3.32Å; I335-G337 PolarHBondContact O-N 3.14Å
338R79.6Confident75.2Confident187 Ų18784.8 Ų84.871%0.70646%0.459SS*.EExtended strand (participates in β ladder)trans-108.8130.8170.5-71.4-173.1176.3-172.9-0.6109.9N334 I335 G336 M340N334-R338 PolarHBondContact OD1-N 2.84Å; I335-R338 PolarHBondContact N-O 3.35Å; I335-R338 PolarHBondContact O-N 3.49Å; G336-R338 VanDerWaalsContact C-N 3.32Å; R338-M340 PolarHBondContact O-N 2.96Å
339L78.2Confident75.7Confident117 Ų11784.9 Ų84.961%0.61346%0.459SS*.EExtended strand (participates in β ladder)trans-74.3120.7166.7-79.3119.9000108.8L332L332-L339 HydrophobicContact CB-CB 4.24Å; L332-L339 HydrophobicContact CB-CD2 3.46Å; L332-L339 VanDerWaalsContact CB-CD2 3.46Å; L332-L339 HydrophobicContact CB-CG 4.46Å; L332-L339 HydrophobicContact CD1-CD2 4.09Å; L332-L339 HydrophobicContact CD2-CB 4.44Å; L332-L339 HydrophobicContact CG-CD2 4.36Å
340M74.7Confident76.2Confident61 Ų6186.7 Ų86.730%0.347%0.47SS..EExtended strand (participates in β ladder)trans-120.2143.9173.7-73-175.2157.700109.3L332 V333 R338 V345L332-M340 CarbonylContact C-O 3.4Å; L332-M340 VanDerWaalsContact CA-O 3.31Å; L332-M340 WeakPolarHBondContact CA-O 3.22Å; V333-M340 PolarHBondContact N-O 3.46Å; V333-M340 PolarHBondContact O-N 3.35Å; R338-M340 PolarHBondContact O-N 2.96Å; M340-V345 HydrophobicContact CB-CG2 3.81Å
341S79.5Confident76.5Confident22 Ų2284 Ų8415%0.15447%0.466CS..EExtended strand (participates in β ladder)trans-64.3146.217370.80000109.9T331 E343 D344 V345T331-S341 CarbonylContact O-C 3.57Å; S341-E343 PolarHBondContact O-N 3.37Å; S341-D344 WeakPolarHBondContact O-CA 3.3Å; S341-D344 WeakPolarHBondContact O-CB 3.5Å; S341-D344 PolarHBondContact O-N 3.07Å; S341-D344 WeakPolarHBondContact OG-CB 3.22Å; S341-D344 PolarHBondContact OG-N 3.29Å; S341-D344 PolarHBondContact OG-OD2 3.36Å; S341-V345 WeakPolarHBondContact O-CG2 3.46Å; S341-V345 PolarHBondContact O-N 3.43Å
342L76.1Confident76.4Confident46 Ų4685.9 Ų85.924%0.24147%0.469CS..Hα-helixtrans-57.9-33.3176-170.572.5000110.7A328 T331 V333 V345 L346A328-L342 HydrophobicContact CB-CD2 4.05Å; A328-L342 VanDerWaalsContact O-CB 3.26Å; A328-L342 WeakPolarHBondContact O-CB 3.35Å; A328-L342 WeakPolarHBondContact O-CD2 3.5Å; T331-L342 PolarHBondContact O-N 3.5Å; V333-L342 HydrophobicContact CG2-CB 4.45Å; V333-L342 HydrophobicContact CG2-CD1 3.83Å; L342-V345 PolarHBondContact O-N 3.46Å; L342-L346 HydrophobicContact CD2-CD1 4.16Å; L342-L346 HydrophobicContact CG-CD1 3.87Å; L342-L346 HydrophobicContact CG-CG 4.21Å; L342-L346 VanDerWaalsContact O-CB 3.29Å; L342-L346 WeakPolarHBondContact O-CB 3.14Å; L342-L346 VanDerWaalsContact O-CG 3.27Å; L342-L346 WeakPolarHBondContact O-CG 3.4Å; L342-L346 PolarHBondContact O-N 2.88Å
343E75.2Confident76Confident129 Ų12986.2 Ų86.260%0.60347%0.467SS*.Hα-helixtrans-57.9-47.1170.9-170.1178.6174.900112.1S329 S341 L346 K347S329-E343 PolarHBondContact O-N 2.91Å; S341-E343 PolarHBondContact O-N 3.37Å; E343-L346 PolarHBondContact O-N 3.5Å; E343-K347 WeakPolarHBondContact O-CB 3.46Å; E343-K347 PolarHBondContact O-N 2.83Å
344D78.6Confident75.6Confident64 Ų6492.5 Ų92.534%0.34249%0.485SS..Hα-helixtrans-63.4-43.8174.7-68.3-47.2000111.2S341 L346 K347 Y348S341-D344 WeakPolarHBondContact O-CA 3.3Å; S341-D344 WeakPolarHBondContact O-CB 3.5Å; S341-D344 PolarHBondContact O-N 3.07Å; S341-D344 WeakPolarHBondContact OG-CB 3.22Å; S341-D344 PolarHBondContact OG-N 3.29Å; S341-D344 PolarHBondContact OG-OD2 3.36Å; D344-L346 PolarHBondContact O-N 3.08Å; D344-K347 PolarHBondContact O-N 3Å; D344-Y348 HydrophobicContact CB-CD2 4.39Å; D344-Y348 HydrophobicContact CB-CE2 4.28Å; D344-Y348 WeakPolarHBondContact O-CD2 3.26Å; D344-Y348 PolarHBondContact O-N 2.96Å
345V76Confident74.9Confident23 Ų2393.4 Ų93.414%0.13949%0.486CS..Hα-helixtrans-61.6-45.2178.61770000111I335 M340 S341 L342 Y348 A349I335-V345 HydrophobicContact CD1-CB 4.26Å; I335-V345 HydrophobicContact CD1-CG1 3.64Å; I335-V345 HydrophobicContact CD1-CG2 3.52Å; M340-V345 HydrophobicContact CB-CG2 3.81Å; S341-V345 WeakPolarHBondContact O-CG2 3.46Å; S341-V345 PolarHBondContact O-N 3.43Å; L342-V345 PolarHBondContact O-N 3.46Å; V345-Y348 CarbonylContact O-C 3.56Å; V345-Y348 PolarHBondContact O-N 3.07Å; V345-A349 WeakPolarHBondContact O-CA 3.17Å; V345-A349 WeakPolarHBondContact O-CB 3.4Å; V345-A349 PolarHBondContact O-N 3.46Å
346L77.8Confident74.4Confident103 Ų10393.8 Ų93.854%0.53949%0.491SS..Hα-helixtrans-68.5-35.6177.8-74.1169000111.7L342 E343 D344 Y348 A349 P350L342-L346 HydrophobicContact CD2-CD1 4.16Å; L342-L346 HydrophobicContact CG-CD1 3.87Å; L342-L346 HydrophobicContact CG-CG 4.21Å; L342-L346 VanDerWaalsContact O-CB 3.29Å; L342-L346 WeakPolarHBondContact O-CB 3.14Å; L342-L346 VanDerWaalsContact O-CG 3.27Å; L342-L346 WeakPolarHBondContact O-CG 3.4Å; L342-L346 PolarHBondContact O-N 2.88Å; E343-L346 PolarHBondContact O-N 3.5Å; D344-L346 PolarHBondContact O-N 3.08Å; L346-Y348 VanDerWaalsContact C-N 3.32Å; L346-Y348 PolarHBondContact O-N 2.8Å; L346-A349 WeakPolarHBondContact O-CB 3.4Å; L346-A349 PolarHBondContact O-N 2.86Å; L346-P350 WeakPolarHBondContact O-CD 3.26Å
347K80Confident73.8Confident146 Ų14693 Ų9364%0.63547%0.466SS*.Hα-helixtrans-65.2-35.5174.1-173.7178-178.3179.80112.2E343 D344E343-K347 WeakPolarHBondContact O-CB 3.46Å; E343-K347 PolarHBondContact O-N 2.83Å; D344-K347 PolarHBondContact O-N 3Å
348Y77Confident73.1Confident101 Ų10192.3 Ų92.340%0.39645%0.454SS..Hα-helixtrans-92.4-7.3175.2-62.1-59.7000113.7D344 V345 L346 P350 L351 F352D344-Y348 HydrophobicContact CB-CD2 4.39Å; D344-Y348 HydrophobicContact CB-CE2 4.28Å; D344-Y348 WeakPolarHBondContact O-CD2 3.26Å; D344-Y348 PolarHBondContact O-N 2.96Å; V345-Y348 CarbonylContact O-C 3.56Å; V345-Y348 PolarHBondContact O-N 3.07Å; L346-Y348 VanDerWaalsContact C-N 3.32Å; L346-Y348 PolarHBondContact O-N 2.8Å; Y348-P350 VanDerWaalsContact C-CD 3.44Å; Y348-P350 VanDerWaalsContact C-N 3.31Å; Y348-L351 HydrophobicContact CD1-CD1 3.71Å; Y348-L351 HydrophobicContact CE1-CD1 4.36Å; Y348-L351 WeakPolarHBondContact O-CA 3.23Å; Y348-L351 VanDerWaalsContact O-CB 3.32Å; Y348-L351 WeakPolarHBondContact O-CB 3.39Å; Y348-L351 PolarHBondContact O-N 3.07Å; Y348-F352 VanDerWaalsContact O-CD2 3.27Å; Y348-F352 WeakPolarHBondContact O-CD2 3.31Å; Y348-F352 PolarHBondContact O-N 2.92Å
349A75.8Confident72.3Confident38 Ų3890.2 Ų90.231%0.31445%0.452SS..Hα-helixtrans-54.5-40.3178.200000112.7V345 L346 L351 F352 H353V345-A349 WeakPolarHBondContact O-CA 3.17Å; V345-A349 WeakPolarHBondContact O-CB 3.4Å; V345-A349 PolarHBondContact O-N 3.46Å; L346-A349 WeakPolarHBondContact O-CB 3.4Å; L346-A349 PolarHBondContact O-N 2.86Å; A349-L351 VanDerWaalsContact C-N 3.26Å; A349-L351 PolarHBondContact O-N 2.67Å; A349-F352 PolarHBondContact O-N 3.39Å; A349-H353 WeakPolarHBondContact O-CB 3.33Å; A349-H353 PolarHBondContact O-N 3.03Å
350P75Confident71.5Confident77 Ų7788.7 Ų88.750%0.544%0.444SS..Hα-helixtrans-64.6-28.4172.9-20.332000113.4L346 Y348 R354L346-P350 WeakPolarHBondContact O-CD 3.26Å; Y348-P350 VanDerWaalsContact C-CD 3.44Å; Y348-P350 VanDerWaalsContact C-N 3.31Å; P350-R354 WeakPolarHBondContact O-CB 3.45Å; P350-R354 WeakPolarHBondContact O-CG 3.39Å; P350-R354 PolarHBondContact O-N 3.4Å
351L72.6Confident70.6Confident92 Ų9289.1 Ų89.148%0.48245%0.453SS..Hα-helixtrans-74.7-39.9174.8-64.2-175.6000111.5Y348 A349 H353 R354 Q355Y348-L351 HydrophobicContact CD1-CD1 3.71Å; Y348-L351 HydrophobicContact CE1-CD1 4.36Å; Y348-L351 WeakPolarHBondContact O-CA 3.23Å; Y348-L351 VanDerWaalsContact O-CB 3.32Å; Y348-L351 WeakPolarHBondContact O-CB 3.39Å; Y348-L351 PolarHBondContact O-N 3.07Å; A349-L351 VanDerWaalsContact C-N 3.26Å; A349-L351 PolarHBondContact O-N 2.67Å; L351-H353 VanDerWaalsContact C-N 3.33Å; L351-R354 CarbonylContact O-C 3.45Å; L351-R354 PolarHBondContact O-N 3.39Å; L351-Q355 PolarHBondContact O-N 3.33Å
352F66.8Low69.6Low99 Ų9998.6 Ų98.643%0.43449%0.486SS..Hα-helixtrans-63.1-42.9171.9-71.4-67.5000111Y348 A349 R354 Q355 V356Y348-F352 VanDerWaalsContact O-CD2 3.27Å; Y348-F352 WeakPolarHBondContact O-CD2 3.31Å; Y348-F352 PolarHBondContact O-N 2.92Å; A349-F352 PolarHBondContact O-N 3.39Å; F352-R354 VanDerWaalsContact C-N 3.32Å; F352-R354 PolarHBondContact O-N 3.31Å; F352-Q355 PolarHBondContact O-N 3.05Å; F352-V356 WeakPolarHBondContact O-CB 3.24Å; F352-V356 VanDerWaalsContact O-CG2 3.31Å; F352-V356 WeakPolarHBondContact O-CG2 3.49Å; F352-V356 PolarHBondContact O-N 3.25Å
353H66.2Low68.7Low121 Ų121105.7 Ų105.756%0.5651%0.514SS*.Hα-helixtrans-60.1-43.8172.9-127.6-70.9000110.7A349 L351 Q355 V356 D357A349-H353 WeakPolarHBondContact O-CB 3.33Å; A349-H353 PolarHBondContact O-N 3.03Å; L351-H353 VanDerWaalsContact C-N 3.33Å; H353-Q355 PolarHBondContact O-N 3.48Å; H353-V356 PolarHBondContact O-N 3.02Å; H353-D357 IonicContact CE1-OD2 2.76Å; H353-D357 IonicContact CG-OD2 2.77Å; H353-D357 IonicContact ND1-OD1 3.69Å; H353-D357 IonicContact ND1-OD2 3.99Å; H353-D357 PolarHBondContact ND1-OD2 2.83Å; H353-D357 WeakPolarHBondContact O-CA 3.45Å; H353-D357 WeakPolarHBondContact O-CB 3.32Å; H353-D357 PolarHBondContact O-N 3.47Å; H353-D357 VanDerWaalsContact O-OD2 3.04Å
354R68.9Low67.7Low184 Ų184106 Ų10669%0.69452%0.516SS*.Hα-helixtrans-65.7-34.4175.3-83.2-177.4175.2176.40.4114.2P350 L351 F352 A358P350-R354 WeakPolarHBondContact O-CB 3.45Å; P350-R354 WeakPolarHBondContact O-CG 3.39Å; P350-R354 PolarHBondContact O-N 3.4Å; L351-R354 CarbonylContact O-C 3.45Å; L351-R354 PolarHBondContact O-N 3.39Å; F352-R354 VanDerWaalsContact C-N 3.32Å; F352-R354 PolarHBondContact O-N 3.31Å; R354-A358 WeakPolarHBondContact O-CA 3.36Å; R354-A358 WeakPolarHBondContact O-CB 3.44Å; R354-A358 PolarHBondContact O-N 2.96Å
355Q65.9Low66.1Low127 Ų127107.9 Ų107.959%0.59353%0.534SS*.Hα-helixtrans-72-43.8176.7-79.2-179.2-24.800111L351 F352 H353 A358 E359L351-Q355 PolarHBondContact O-N 3.33Å; F352-Q355 PolarHBondContact O-N 3.05Å; H353-Q355 PolarHBondContact O-N 3.48Å; Q355-A358 PolarHBondContact O-N 3.43Å; Q355-E359 WeakPolarHBondContact O-CB 3.47Å; Q355-E359 PolarHBondContact O-N 3.35Å
356V63.6Low64.4Low78 Ų78116.4 Ų116.447%0.47357%0.569SS.*Hα-helixtrans-64.3-43.4174.4172.50000110.4F352 H353 A358 E359 L360F352-V356 WeakPolarHBondContact O-CB 3.24Å; F352-V356 VanDerWaalsContact O-CG2 3.31Å; F352-V356 WeakPolarHBondContact O-CG2 3.49Å; F352-V356 PolarHBondContact O-N 3.25Å; H353-V356 PolarHBondContact O-N 3.02Å; V356-A358 VanDerWaalsContact C-N 3.35Å; V356-A358 PolarHBondContact O-N 3.12Å; V356-E359 PolarHBondContact O-N 3.49Å; V356-L360 HydrophobicContact CG1-CD1 3.72Å; V356-L360 VanDerWaalsContact O-CB 3.24Å; V356-L360 WeakPolarHBondContact O-CB 3.45Å; V356-L360 WeakPolarHBondContact O-CD1 3.45Å; V356-L360 WeakPolarHBondContact O-CG 3.35Å; V356-L360 PolarHBondContact O-N 3.23Å
357D61.4Low62.8Low72 Ų72122.7 Ų122.739%0.38559%0.586SS.*Hα-helixtrans-69.3-30.4175.8-69.4-30.2000111.7H353 S361H353-D357 IonicContact CE1-OD2 2.76Å; H353-D357 IonicContact CG-OD2 2.77Å; H353-D357 IonicContact ND1-OD1 3.69Å; H353-D357 IonicContact ND1-OD2 3.99Å; H353-D357 PolarHBondContact ND1-OD2 2.83Å; H353-D357 WeakPolarHBondContact O-CA 3.45Å; H353-D357 WeakPolarHBondContact O-CB 3.32Å; H353-D357 PolarHBondContact O-N 3.47Å; H353-D357 VanDerWaalsContact O-OD2 3.04Å; D357-S361 WeakPolarHBondContact O-CA 3.39Å; D357-S361 WeakPolarHBondContact O-CB 3.41Å; D357-S361 PolarHBondContact O-N 3Å; D357-S361 PolarHBondContact O-OG 3.41Å
358A65.4Low60.9Low52 Ų52122.8 Ų122.843%0.4360%0.599SS.*Hα-helixtrans-75.9-35.4174.400000112.1R354 Q355 V356 R362R354-A358 WeakPolarHBondContact O-CA 3.36Å; R354-A358 WeakPolarHBondContact O-CB 3.44Å; R354-A358 PolarHBondContact O-N 2.96Å; Q355-A358 PolarHBondContact O-N 3.43Å; V356-A358 VanDerWaalsContact C-N 3.35Å; V356-A358 PolarHBondContact O-N 3.12Å; A358-R362 WeakPolarHBondContact O-CB 3.33Å; A358-R362 WeakPolarHBondContact O-CG 3.5Å; A358-R362 PolarHBondContact O-N 3.47Å
359E64Low59.2Low143 Ų143129.9 Ų129.967%0.66863%0.625SS**Hα-helixtrans-70.5-41.9171.4-77.4-168.3159.500111.5Q355 V356 S361 R362 K363Q355-E359 WeakPolarHBondContact O-CB 3.47Å; Q355-E359 PolarHBondContact O-N 3.35Å; V356-E359 PolarHBondContact O-N 3.49Å; E359-S361 VanDerWaalsContact C-N 3.35Å; E359-R362 PolarHBondContact O-N 2.91Å; E359-K363 PolarHBondContact O-N 3.4Å
360L61.6Low57.9Low84 Ų84137.4 Ų137.444%0.4465%0.654SS.*Hα-helixtrans-63.8-39.9171.1-82.8157.4000111V356 K363 Q364V356-L360 HydrophobicContact CG1-CD1 3.72Å; V356-L360 VanDerWaalsContact O-CB 3.24Å; V356-L360 WeakPolarHBondContact O-CB 3.45Å; V356-L360 WeakPolarHBondContact O-CD1 3.45Å; V356-L360 WeakPolarHBondContact O-CG 3.35Å; V356-L360 PolarHBondContact O-N 3.23Å; L360-K363 CarbonylContact O-C 3.57Å; L360-K363 PolarHBondContact O-N 3.32Å; L360-Q364 WeakPolarHBondContact O-CA 3.28Å; L360-Q364 WeakPolarHBondContact O-CB 3.37Å; L360-Q364 WeakPolarHBondContact O-CG 3.23Å; L360-Q364 PolarHBondContact O-N 3.5Å
361S55.1Low56.9Low71 Ų71137.2 Ų137.250%0.49767%0.666SS.*Hα-helixtrans-73.7-28.6177-66.40000112.9D357 E359 K363 Q364 S365D357-S361 WeakPolarHBondContact O-CA 3.39Å; D357-S361 WeakPolarHBondContact O-CB 3.41Å; D357-S361 PolarHBondContact O-N 3Å; D357-S361 PolarHBondContact O-OG 3.41Å; E359-S361 VanDerWaalsContact C-N 3.35Å; S361-K363 VanDerWaalsContact C-N 3.35Å; S361-Q364 CarbonylContact O-C 3.48Å; S361-Q364 PolarHBondContact O-N 3.13Å; S361-S365 VanDerWaalsContact O-CA 3.29Å; S361-S365 WeakPolarHBondContact O-CA 3.34Å; S361-S365 PolarHBondContact O-N 3.02Å
362R58.6Low56.3Low221 Ų221137.6 Ų137.683%0.83468%0.682SS**Hα-helixtrans-69.2-35.2168.1-86.9-177.2172.4174.5-1.2111.2A358 E359A358-R362 WeakPolarHBondContact O-CB 3.33Å; A358-R362 WeakPolarHBondContact O-CG 3.5Å; A358-R362 PolarHBondContact O-N 3.47Å; E359-R362 PolarHBondContact O-N 2.91Å
363K57.7Low56.5Low194 Ų194142.3 Ų142.384%0.84370%0.698SS**Hα-helixtrans-75.2-24169.5-75.1-176.1176.9177.40113.4E359 L360 S361E359-K363 PolarHBondContact O-N 3.4Å; L360-K363 CarbonylContact O-C 3.57Å; L360-K363 PolarHBondContact O-N 3.32Å; S361-K363 VanDerWaalsContact C-N 3.35Å
364Q53.4Low56.7Low137 Ų137141.3 Ų141.364%0.6470%0.7SS**THydrogen-bonded Turntrans-110.732.7178.6-70.2-171.9-21.300112.4L360 S361 K366 R367L360-Q364 WeakPolarHBondContact O-CA 3.28Å; L360-Q364 WeakPolarHBondContact O-CB 3.37Å; L360-Q364 WeakPolarHBondContact O-CG 3.23Å; L360-Q364 PolarHBondContact O-N 3.5Å; S361-Q364 CarbonylContact O-C 3.48Å; S361-Q364 PolarHBondContact O-N 3.13Å; Q364-K366 PolarHBondContact O-N 3.29Å; Q364-R367 PolarHBondContact O-N 3.37Å
365S44.6Very low57Low102 Ų102135.1 Ų135.171%0.71368%0.684SS**THydrogen-bonded Turntrans-64.641.9-178-1710000114.4S361S361-S365 VanDerWaalsContact O-CA 3.29Å; S361-S365 WeakPolarHBondContact O-CA 3.34Å; S361-S365 PolarHBondContact O-N 3.02Å
366K41Very low57.5Low202 Ų202137.9 Ų137.988%0.87870%0.697SS**THydrogen-bonded Turntrans-137.63.4172.8-88.2-172.7174.21780115.2Q364Q364-K366 PolarHBondContact O-N 3.29Å
367R45.1Very low58.2Low236 Ų236139.2 Ų139.289%0.89170%0.701SS**  trans-143.5102.9174.2-78-172.7171.3166.1-3.2114.4Q364Q364-R367 PolarHBondContact O-N 3.37Å
368T39.1Very low58.7Low148 Ų148139.5 Ų139.591%0.90870%0.702SS**  trans-71.7120.9161.738.40000110.6
369R40.9Very low58.7Low249 Ų249146 Ų14694%0.9472%0.72SS**  trans-124.1131158-88.6-168.2171.9-168-1.9109.2
370Q48.7Very low59.1Low197 Ų197143.3 Ų143.392%0.92172%0.718SS**PPolyproline II helixtrans-65.2139.2177-71.5168.1-22.400110.6
371G53.4Low59.1Low73 Ų73143.4 Ų143.475%0.75372%0.718SS**PPolyproline II helixtrans-71.5165172.800000112.8
372A60.4Low59.3Low100 Ų100149.9 Ų149.983%0.82673%0.731SS**PPolyproline II helixtrans-63.3142179.300000112.5
373Y70.7Confident59.3Low198 Ų198149.8 Ų149.878%0.77673%0.733SS**PPolyproline II helixtrans-67.6132.3176.8176.5-97.6000111.5P375Y373-P375 HydrophobicContact CD1-CG 4.37Å; Y373-P375 HydrophobicContact CE1-CB 4.24Å; Y373-P375 HydrophobicContact CE1-CG 4.03Å
374V72.2Confident59.3Low99 Ų99146 Ų14660%0.672%0.72SS**  trans-111.8121.1171.1178.20000107.8I378V374-I378 HydrophobicContact CG1-CD1 4.41Å; V374-I378 HydrophobicContact CG1-CG2 4.45Å
375P75.1Confident59Low55 Ų55144.9 Ų144.936%0.35772%0.719SS.*  trans-63.3140.8177.7-18.630.4000112.4Y373 D377 I378Y373-P375 HydrophobicContact CD1-CG 4.37Å; Y373-P375 HydrophobicContact CE1-CB 4.24Å; Y373-P375 HydrophobicContact CE1-CG 4.03Å; P375-D377 WeakPolarHBondContact CB-OD1 3.31Å; P375-D377 PolarHBondContact O-N 3.23Å; P375-I378 PolarHBondContact O-N 2.99Å
376E75.6Confident59.2Low185 Ų185146.4 Ų146.486%0.86472%0.717SS**G310 helixtrans-65.2-22.5-178.5-64.9-170.6165.100113.5
377D78.5Confident59.3Low105 Ų105142.1 Ų142.156%0.56171%0.71SS**G310 helixtrans-90.55.2-175.359.3-41.7000114.1P375 K379 S380P375-D377 WeakPolarHBondContact CB-OD1 3.31Å; P375-D377 PolarHBondContact O-N 3.23Å; D377-K379 PolarHBondContact O-N 2.89Å; D377-S380 VanDerWaalsContact O-CB 3.26Å; D377-S380 WeakPolarHBondContact O-CB 3.4Å; D377-S380 PolarHBondContact O-N 2.95Å; D377-S380 PolarHBondContact O-OG 2.9Å
378I72Confident59.3Low79 Ų79133.8 Ų133.841%0.40569%0.692SS.*G310 helixtrans-55.1-28.6177-162.7160.3000112.8V374 P375 S380 I381V374-I378 HydrophobicContact CG1-CD1 4.41Å; V374-I378 HydrophobicContact CG1-CG2 4.45Å; P375-I378 PolarHBondContact O-N 2.99Å; I378-S380 PolarHBondContact O-N 3.27Å; I378-I381 PolarHBondContact O-N 2.84Å
379K65.7Low59.1Low187 Ų187137.9 Ų137.981%0.81369%0.691SS**G310 helixtrans-67.9-15.7175.2-66.1-178.7-179.7175.40114.4D377 I381D377-K379 PolarHBondContact O-N 2.89Å; K379-I381 VanDerWaalsContact C-N 3.27Å
380S72.1Confident59Low87 Ų87131.6 Ų131.661%0.60868%0.682SS**G310 helixtrans-74.6-19.9177.868.90000112.5D377 I378 R382D377-S380 VanDerWaalsContact O-CB 3.26Å; D377-S380 WeakPolarHBondContact O-CB 3.4Å; D377-S380 PolarHBondContact O-N 2.95Å; D377-S380 PolarHBondContact O-OG 2.9Å; I378-S380 PolarHBondContact O-N 3.27Å; S380-R382 PolarHBondContact O-N 3.35Å; S380-R382 VanDerWaalsContact O-N 3.14Å
381I61.9Low58.5Low86 Ų86127 Ų12744%0.44167%0.672SS.*  trans-88.583.5179.5-46.8173.3000109.2I378 K379 Y383 I384I378-I381 PolarHBondContact O-N 2.84Å; K379-I381 VanDerWaalsContact C-N 3.27Å; I381-Y383 PolarHBondContact O-N 2.91Å; I381-I384 HydrophobicContact CB-CD1 4.12Å; I381-I384 HydrophobicContact CB-CG1 4.46Å; I381-I384 HydrophobicContact CD1-CD1 4.08Å; I381-I384 HydrophobicContact CG2-CB 4.41Å; I381-I384 HydrophobicContact CG2-CD1 3.47Å; I381-I384 VanDerWaalsContact CG2-CD1 3.47Å; I381-I384 HydrophobicContact CG2-CG1 3.66Å; I381-I384 PolarHBondContact O-N 2.94Å
382R57.5Low57.5Low207 Ų207128.2 Ų128.278%0.78167%0.669SS**THydrogen-bonded Turntrans-58.2-13.4-176.4-96.1-174.1-81.6-155.6-4.2116.1S380S380-R382 PolarHBondContact O-N 3.35Å; S380-R382 VanDerWaalsContact O-N 3.14Å
383Y59.5Low56.1Low220 Ų220132.1 Ų132.186%0.86367%0.674SS**THydrogen-bonded Turntrans-100.5-3.4-173.4-77-87000115I381I381-Y383 PolarHBondContact O-N 2.91Å
384I57.5Low54.3Low114 Ų114126.9 Ų126.959%0.58567%0.666SS**SBendtrans-94.4-25.2-174.5-66.4178.2000113.3I381I381-I384 HydrophobicContact CB-CD1 4.12Å; I381-I384 HydrophobicContact CB-CG1 4.46Å; I381-I384 HydrophobicContact CD1-CD1 4.08Å; I381-I384 HydrophobicContact CG2-CB 4.41Å; I381-I384 HydrophobicContact CG2-CD1 3.47Å; I381-I384 VanDerWaalsContact CG2-CD1 3.47Å; I381-I384 HydrophobicContact CG2-CG1 3.66Å; I381-I384 PolarHBondContact O-N 2.94Å
385D48.4Very low52.3Low114 Ų114130.9 Ų130.961%0.6168%0.678SS**SBendtrans-122.631.9-167.5-70.2-29.2000116P387D385-P387 WeakPolarHBondContact O-CD 3.42Å
386I47.2Very low50.5Low133 Ų133135.3 Ų135.368%0.68270%0.704SS**  trans-102.296174.2-51.2175.5000110.1A388I386-A388 PolarHBondContact O-N 2.92Å
387P43.1Very low48.3Very low113 Ų113137.7 Ų137.773%0.73471%0.705SS**  trans-65.211715627.2-28.9000107.2D385 R389D385-P387 WeakPolarHBondContact O-CD 3.42Å; P387-R389 PolarHBondContact O-N 3.48Å
388A45.2Very low46Very low61 Ų61141.3 Ų141.350%0.50472%0.723SS.*  trans-59.2108174.300000109.3Q326 I386Q326-A388 PolarHBondContact NE2-O 3.24Å; I386-A388 PolarHBondContact O-N 2.92Å
389R36.4Very low44.1Very low233 Ų233142.7 Ų142.788%0.87974%0.74SS**  trans-58.2128164.5-91-179.8174.1174.8-1.4108.2P387 S391P387-R389 PolarHBondContact O-N 3.48Å; R389-S391 PolarHBondContact O-N 3.38Å
390P38.6Very low42.7Very low118 Ų118142.9 Ų142.977%0.76674%0.744SS**  trans-69.9103.3162.720.7-15.7000107.6S392P390-S392 PolarHBondContact O-N 3.21Å
391S38.2Very low40.9Very low100 Ų100147.6 Ų147.670%0.69976%0.756SS**  trans-64.7111.2167.748.70000109.6R389R389-S391 PolarHBondContact O-N 3.38Å
392S31.5Very low39.6Very low99 Ų99153.7 Ų153.769%0.69278%0.78SS**  trans47.286.3141.363.70000117.6P390P390-S392 PolarHBondContact O-N 3.21Å
393I31.5Very low38.6Very low181 Ų181149 Ų14993%0.92878%0.779SS**  trans-113.489.3146.7-61.1175.9000106.6
394S31.7Very low37.7Very low88 Ų88146.7 Ų146.762%0.61578%0.779SS**  trans-150.9133.9165540000107.2
395H32Very low36.7Very low183 Ų183146.6 Ų146.685%0.84779%0.789SS**  trans94.172.3-176.1-52-71000116.5
396V35.5Very low36.5Very low148 Ų148148.3 Ų148.390%0.89780%0.798SS**  trans-122.4122.4136.9178.30000107.5
397R30.1Very low36.2Very low235 Ų235151 Ų15189%0.88781%0.808SS**  trans-64.6129.2-171.4-70.7168.8178.5158.4-0.9111.8
398L30.5Very low36.5Very low182 Ų182150.5 Ų150.595%0.95381%0.813SS**  trans-13981.3157.8-101.6163.2000107.6
399S32.9Very low36.6Very low108 Ų108155.6 Ų155.676%0.75583%0.832SS**  trans-164.287.1167.459.90000109.5
400Q35.7Very low37Very low191 Ų191157.4 Ų157.489%0.89385%0.85SS**  trans-165.192158-113.6-179.7-2.700108.6
401Q34.1Very low36.9Very low185 Ų185159.4 Ų159.486%0.86486%0.855SS**SBendtrans165.1105.8149-95.6170.5-10.500106.3
402F34Very low36.8Very low214 Ų214162.5 Ų162.594%0.93986%0.863SS**  trans146.280.6156.8-87.3-71.7000110
403S36.7Very low37.1Very low109 Ų109166.1 Ų166.176%0.76287%0.872SS**  trans-167112.3154.652.90000106.8
404I39.8Very low37.5Very low171 Ų171165.2 Ų165.288%0.87787%0.869SS**  trans176.495.6136.9-79.4146.8000105.3
405S37.4Very low37.8Very low112 Ų112170 Ų17078%0.78389%0.885SS**  trans-154.783.715760.10000106.9
406N44Very low38.2Very low150 Ų150169.1 Ų169.180%0.80289%0.887SS**  trans-129101.6154-86.50.7000103
407E41.2Very low38.4Very low191 Ų191170.6 Ų170.689%0.89389%0.887SS**  53.794.898.9-77.2-171.7162.500112
408A49.5Very low39Very low101 Ų101165.7 Ų165.784%0.83589%0.887SS**  trans-124.4103.2154.400000106.2
409N46.5Very low39.7Very low168 Ų168164.3 Ų164.390%0.89888%0.881SS**  trans-140.286.8166.8-123.913.3000105.4
410E45.2Very low40.4Very low272 Ų272169.5 Ų169.5100%1.27189%0.892SS**  trans1770147.3-101.6-176.2170.800109.7

Retrieved 410 of 410 residues in 605.1 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).