A0A087XU31_POEFO Loading...

Solute carrier family 13 member 2

AlphaFold DB , UniProt , Accession A0A087XU31, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 601 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
1V56.6Low82.1Confident145 Ų145118.2 Ų118.288%0.87957%0.572SS**  0110.70-178.20000107L5V1-L5 HydrophobicContact CG1-CB 3.92Å; V1-L5 HydrophobicContact CG1-CD2 3.53Å; V1-L5 HydrophobicContact CG1-CG 4.34Å
2S80.5Confident82.6Confident71 Ų71117.2 Ų117.250%0.49756%0.558SS.*  trans-61.1150.9-168.566.70000112.3V4 L5 K6S2-V4 PolarHBondContact O-N 3Å; S2-V4 VanDerWaalsContact O-N 3.16Å; S2-L5 WeakPolarHBondContact O-CB 3.05Å; S2-L5 PolarHBondContact O-N 3.04Å; S2-L5 PolarHBondContact OG-N 3.43Å; S2-K6 PolarHBondContact O-N 3.43Å
3D84.6Confident83Confident125 Ų125112.4 Ų112.467%0.66854%0.537SS*.Hα-helixtrans-59.3-26.7178.5-65.8-42000112.6K6 W7D3-K6 PolarHBondContact O-N 2.81Å; D3-W7 WeakPolarHBondContact O-CB 3.45Å; D3-W7 PolarHBondContact O-N 2.93Å
4V82.8Confident83.5Confident97 Ų97116.4 Ų116.459%0.58855%0.546SS*.Hα-helixtrans-61.9-43.8170.5-179.70000111.4S2 K6 W7 L8S2-V4 PolarHBondContact O-N 3Å; S2-V4 VanDerWaalsContact O-N 3.16Å; V4-K6 VanDerWaalsContact C-N 3.32Å; V4-K6 PolarHBondContact O-N 2.8Å; V4-W7 PolarHBondContact O-N 2.89Å; V4-L8 HydrophobicContact CG1-CD1 4.07Å; V4-L8 HydrophobicContact CG1-CG 4.39Å; V4-L8 WeakPolarHBondContact O-CB 3.35Å; V4-L8 VanDerWaalsContact O-CG 3.28Å; V4-L8 WeakPolarHBondContact O-CG 3.4Å; V4-L8 PolarHBondContact O-N 3.33Å
5L81.6Confident83.8Confident102 Ų102111.9 Ų111.953%0.53453%0.527SS..Hα-helixtrans-66.8-36.8179.6-146.385.3000111.5V1 S2 W9V1-L5 HydrophobicContact CG1-CB 3.92Å; V1-L5 HydrophobicContact CG1-CD2 3.53Å; V1-L5 HydrophobicContact CG1-CG 4.34Å; S2-L5 WeakPolarHBondContact O-CB 3.05Å; S2-L5 PolarHBondContact O-N 3.04Å; S2-L5 PolarHBondContact OG-N 3.43Å; L5-W9 WeakPolarHBondContact O-CB 3.3Å; L5-W9 PolarHBondContact O-N 2.77Å
6K83.9Confident84.2Confident125 Ų125107.5 Ų107.554%0.54351%0.507SS..Hα-helixtrans-66.2-43.1173.7-68.5179-176.6168.30111.5S2 D3 V4 W9 Y10S2-K6 PolarHBondContact O-N 3.43Å; D3-K6 PolarHBondContact O-N 2.81Å; V4-K6 VanDerWaalsContact C-N 3.32Å; V4-K6 PolarHBondContact O-N 2.8Å; K6-W9 PolarHBondContact O-N 3.08Å; K6-Y10 WeakPolarHBondContact O-CB 3.47Å; K6-Y10 PolarHBondContact O-N 2.77Å
7W89.3Confident84.6Confident145 Ų145104.1 Ų104.155%0.54949%0.492SS..Hα-helixtrans-62-46.2176.8-176.290.6000111.7D3 V4 W9 Y10 H11 I15D3-W7 WeakPolarHBondContact O-CB 3.45Å; D3-W7 PolarHBondContact O-N 2.93Å; V4-W7 PolarHBondContact O-N 2.89Å; W7-W9 VanDerWaalsContact C-N 3.32Å; W7-W9 PolarHBondContact O-N 3.19Å; W7-Y10 PolarHBondContact O-N 3.07Å; W7-H11 AromaticContact CD1-CE1 3.58Å; W7-H11 AromaticContact CD1-ND1 3.68Å; W7-H11 AromaticContact CD2-ND1 3.77Å; W7-H11 AromaticContact CE2-CE1 3.78Å; W7-H11 AromaticContact CE2-ND1 3.54Å; W7-H11 AromaticContact CG-ND1 3.86Å; W7-H11 AromaticContact NE1-CE1 3.28Å; W7-H11 PolarHBondContact NE1-CE1 3.48Å; W7-H11 VanDerWaalsContact NE1-CE1 3.28Å; W7-H11 AromaticContact NE1-ND1 3.48Å; W7-H11 PolarHBondContact NE1-ND1 2.94Å; W7-H11 PolarHBondContact O-N 3.18Å; W7-H11 PolarHBondContact O-ND1 3.05Å; W7-I15 HydrophobicContact CZ3-CD1 4.21Å
8L84.3Confident84.9Confident74 Ų74103.2 Ų103.239%0.38750%0.495SS..Hα-helixtrans-59.6-43175-73.8171.4000111.4V4 Y10 H11 R12 I15V4-L8 HydrophobicContact CG1-CD1 4.07Å; V4-L8 HydrophobicContact CG1-CG 4.39Å; V4-L8 WeakPolarHBondContact O-CB 3.35Å; V4-L8 VanDerWaalsContact O-CG 3.28Å; V4-L8 WeakPolarHBondContact O-CG 3.4Å; V4-L8 PolarHBondContact O-N 3.33Å; L8-Y10 VanDerWaalsContact C-N 3.35Å; L8-Y10 PolarHBondContact O-N 3.14Å; L8-H11 CarbonylContact O-C 3.57Å; L8-H11 PolarHBondContact O-N 3.48Å; L8-R12 VanDerWaalsContact O-CA 3.31Å; L8-R12 WeakPolarHBondContact O-CA 3.25Å; L8-R12 WeakPolarHBondContact O-CB 3.25Å; L8-R12 PolarHBondContact O-N 2.93Å; L8-I15 HydrophobicContact CD2-CD1 3.56Å
9W83.9Confident85.2Confident176 Ų176102 Ų10267%0.66749%0.494SS*.Hα-helixtrans-68.1-34.6180-166.482.5000113L5 K6 W7 R12L5-W9 WeakPolarHBondContact O-CB 3.3Å; L5-W9 PolarHBondContact O-N 2.77Å; K6-W9 PolarHBondContact O-N 3.08Å; W7-W9 VanDerWaalsContact C-N 3.32Å; W7-W9 PolarHBondContact O-N 3.19Å; W9-R12 WeakPolarHBondContact O-CD 3.44Å; W9-R12 WeakPolarHBondContact O-CG 3.43Å; W9-R12 PolarHBondContact O-NH1 3.23Å
10Y87.1Confident85.5Confident184 Ų18497.8 Ų97.872%0.72248%0.475SS*.Hα-helixtrans-71-38.5175.9-164.9-93.9000112.1K6 W7 L8K6-Y10 WeakPolarHBondContact O-CB 3.47Å; K6-Y10 PolarHBondContact O-N 2.77Å; W7-Y10 PolarHBondContact O-N 3.07Å; L8-Y10 VanDerWaalsContact C-N 3.35Å; L8-Y10 PolarHBondContact O-N 3.14Å
11H88.8Confident85.8Confident56 Ų5694.5 Ų94.526%0.25946%0.461SS..SBendtrans-95.810.5-179.5-61.584.8000113.6W7 L8 N13 Y14 I15W7-H11 AromaticContact CD1-CE1 3.58Å; W7-H11 AromaticContact CD1-ND1 3.68Å; W7-H11 AromaticContact CD2-ND1 3.77Å; W7-H11 AromaticContact CE2-CE1 3.78Å; W7-H11 AromaticContact CE2-ND1 3.54Å; W7-H11 AromaticContact CG-ND1 3.86Å; W7-H11 AromaticContact NE1-CE1 3.28Å; W7-H11 PolarHBondContact NE1-CE1 3.48Å; W7-H11 VanDerWaalsContact NE1-CE1 3.28Å; W7-H11 AromaticContact NE1-ND1 3.48Å; W7-H11 PolarHBondContact NE1-ND1 2.94Å; W7-H11 PolarHBondContact O-N 3.18Å; W7-H11 PolarHBondContact O-ND1 3.05Å; L8-H11 CarbonylContact O-C 3.57Å; L8-H11 PolarHBondContact O-N 3.48Å; H11-N13 PolarHBondContact O-N 3.05Å; H11-N13 VanDerWaalsContact O-N 3.09Å; H11-Y14 PolarHBondContact O-N 3.12Å; H11-I15 HydrophobicContact CB-CD1 4.1Å; H11-I15 HydrophobicContact CB-CG1 4.39Å; H11-I15 WeakPolarHBondContact O-CG1 3.19Å; H11-I15 PolarHBondContact O-N 3.16Å
12R88.3Confident87.4Confident106 Ų10692.8 Ų92.840%0.445%0.447SS..Hα-helixtrans-52.8-39.3-171.771.6-177.6179.3-99.43.9113.1L8 W9 I15 I16L8-R12 VanDerWaalsContact O-CA 3.31Å; L8-R12 WeakPolarHBondContact O-CA 3.25Å; L8-R12 WeakPolarHBondContact O-CB 3.25Å; L8-R12 PolarHBondContact O-N 2.93Å; W9-R12 WeakPolarHBondContact O-CD 3.44Å; W9-R12 WeakPolarHBondContact O-CG 3.43Å; W9-R12 PolarHBondContact O-NH1 3.23Å; R12-I15 PolarHBondContact O-N 3.13Å; R12-I16 WeakPolarHBondContact O-CB 3.11Å; R12-I16 WeakPolarHBondContact O-CD1 3.47Å; R12-I16 WeakPolarHBondContact O-CG1 3.36Å; R12-I16 PolarHBondContact O-N 3.04Å
13N87.8Confident87.8Confident55 Ų5592.5 Ų92.529%0.29445%0.448SS..Hα-helixtrans-65.7-47.2-178.5-69.29.2000110.8H11 I15 I16 I17 C53H11-N13 PolarHBondContact O-N 3.05Å; H11-N13 VanDerWaalsContact O-N 3.09Å; N13-I15 VanDerWaalsContact C-N 3.31Å; N13-I15 PolarHBondContact O-N 3.35Å; N13-I16 PolarHBondContact O-N 3.23Å; N13-I17 WeakPolarHBondContact O-CB 3.37Å; N13-I17 WeakPolarHBondContact O-CD1 3.25Å; N13-I17 WeakPolarHBondContact O-CG1 3.47Å; N13-I17 PolarHBondContact O-N 3.38Å; N13-C53 HydrophobicContact CB-CB 4.27Å
14Y89.3Confident88Confident169 Ų16990 Ų9066%0.66343%0.432SS*.Hα-helixtrans-62.5-40.4176.3-62-73.5000111.9H11 I17 V18H11-Y14 PolarHBondContact O-N 3.12Å; Y14-I17 PolarHBondContact O-N 2.83Å; Y14-V18 WeakPolarHBondContact O-CG2 3.43Å; Y14-V18 PolarHBondContact O-N 3.26Å
15I88.5Confident88.2Confident49 Ų4988.8 Ų88.825%0.25142%0.421SS..Hα-helixtrans-62.3-48.8177.3-64.9165.7000109.8W7 L8 H11 R12 N13 I17 V18 V19W7-I15 HydrophobicContact CZ3-CD1 4.21Å; L8-I15 HydrophobicContact CD2-CD1 3.56Å; H11-I15 HydrophobicContact CB-CD1 4.1Å; H11-I15 HydrophobicContact CB-CG1 4.39Å; H11-I15 WeakPolarHBondContact O-CG1 3.19Å; H11-I15 PolarHBondContact O-N 3.16Å; R12-I15 PolarHBondContact O-N 3.13Å; N13-I15 VanDerWaalsContact C-N 3.31Å; N13-I15 PolarHBondContact O-N 3.35Å; I15-I17 VanDerWaalsContact C-N 3.34Å; I15-I17 PolarHBondContact O-N 3.22Å; I15-V18 PolarHBondContact O-N 3.04Å; I15-V19 HydrophobicContact CG2-CG2 3.84Å; I15-V19 WeakPolarHBondContact O-CB 3.44Å; I15-V19 VanDerWaalsContact O-CG2 3.22Å; I15-V19 WeakPolarHBondContact O-CG2 3.34Å; I15-V19 PolarHBondContact O-N 3.16Å
16I89.9Confident88.5Confident41 Ų4187.1 Ų87.121%0.2142%0.416CS..Hα-helixtrans-60.3-45.7177.4-67.7162.2000110.3R12 N13 V18 T20 Y48 T51 C53R12-I16 WeakPolarHBondContact O-CB 3.11Å; R12-I16 WeakPolarHBondContact O-CD1 3.47Å; R12-I16 WeakPolarHBondContact O-CG1 3.36Å; R12-I16 PolarHBondContact O-N 3.04Å; N13-I16 PolarHBondContact O-N 3.23Å; I16-V18 VanDerWaalsContact C-N 3.3Å; I16-V18 PolarHBondContact O-N 3.46Å; I16-T20 WeakPolarHBondContact O-CB 3.45Å; I16-T20 PolarHBondContact O-N 3.37Å; I16-T20 PolarHBondContact O-OG1 3.09Å; I16-Y48 HydrophobicContact CG2-CD1 4.25Å; I16-Y48 HydrophobicContact CG2-CE1 4.22Å; I16-T51 HydrophobicContact CD1-CG2 4.15Å; I16-C53 HydrophobicContact CB-CB 4.24Å; I16-C53 HydrophobicContact CG2-CB 4.01Å
17I91.2Very high88.5Confident50 Ų5084 Ų8426%0.25641%0.406SS..Hα-helixtrans-59.4-40.5-179.5-69.6162.7000111.6N13 Y14 I15 P21 Y48 C53 M54N13-I17 WeakPolarHBondContact O-CB 3.37Å; N13-I17 WeakPolarHBondContact O-CD1 3.25Å; N13-I17 WeakPolarHBondContact O-CG1 3.47Å; N13-I17 PolarHBondContact O-N 3.38Å; Y14-I17 PolarHBondContact O-N 2.83Å; I15-I17 VanDerWaalsContact C-N 3.34Å; I15-I17 PolarHBondContact O-N 3.22Å; I17-P21 WeakPolarHBondContact O-CD 3.42Å; I17-P21 WeakPolarHBondContact O-CG 3.38Å; I17-Y48 WeakPolarHBondContact CA-OH 3.39Å; I17-Y48 PolarHBondContact O-OH 3.36Å; I17-C53 HydrophobicContact CG1-CB 4.19Å; I17-M54 HydrophobicContact CD1-CG 3.58Å; I17-M54 HydrophobicContact CD1-SD 4.29Å; I17-M54 HydrophobicContact CG1-CG 3.83Å; I17-M54 HydrophobicContact CG1-SD 4.3Å
18V90.5Very high88.1Confident88 Ų8877.7 Ų77.753%0.53338%0.383SS..Hα-helixtrans-87.2-42.6-177.3177.50000112.4Y14 I15 I16 P21 L22Y14-V18 WeakPolarHBondContact O-CG2 3.43Å; Y14-V18 PolarHBondContact O-N 3.26Å; I15-V18 PolarHBondContact O-N 3.04Å; I16-V18 VanDerWaalsContact C-N 3.3Å; I16-V18 PolarHBondContact O-N 3.46Å; V18-P21 WeakPolarHBondContact O-CD 3.24Å; V18-L22 HydrophobicContact CG1-CD1 3.95Å; V18-L22 WeakPolarHBondContact O-CD1 3.32Å; V18-L22 VanDerWaalsContact O-CG 3.28Å; V18-L22 WeakPolarHBondContact O-CG 3.42Å
19V90.7Very high88Confident80 Ų8079.4 Ų79.449%0.48539%0.392SS..Hα-helixtrans-74.5-39.1-173.8175.90000111.4I15 L22 A23I15-V19 HydrophobicContact CG2-CG2 3.84Å; I15-V19 WeakPolarHBondContact O-CB 3.44Å; I15-V19 VanDerWaalsContact O-CG2 3.22Å; I15-V19 WeakPolarHBondContact O-CG2 3.34Å; I15-V19 PolarHBondContact O-N 3.16Å; V19-L22 PolarHBondContact O-N 3.43Å; V19-A23 VanDerWaalsContact O-CB 3.24Å; V19-A23 WeakPolarHBondContact O-CB 3.46Å; V19-A23 PolarHBondContact O-N 3.33Å
20T91.3Very high87.6Confident18 Ų1876.2 Ų76.211%0.1139%0.392CS..Hα-helixtrans-60.4-50.8-177.3-62.20000112.7I16 L22 A23 F24 L47 Y48I16-T20 WeakPolarHBondContact O-CB 3.45Å; I16-T20 PolarHBondContact O-N 3.37Å; I16-T20 PolarHBondContact O-OG1 3.09Å; T20-L22 VanDerWaalsContact C-N 3.3Å; T20-L22 PolarHBondContact O-N 3.32Å; T20-A23 PolarHBondContact O-N 3.45Å; T20-F24 HydrophobicContact CG2-CD2 4.08Å; T20-F24 HydrophobicContact CG2-CE2 4.34Å; T20-F24 WeakPolarHBondContact O-CD2 3.43Å; T20-F24 PolarHBondContact O-N 3.4Å; T20-F24 VanDerWaalsContact O-N 3.16Å; T20-L47 HydrophobicContact CG2-CB 4.18Å; T20-L47 HydrophobicContact CG2-CD1 3.47Å; T20-L47 VanDerWaalsContact CG2-CD1 3.47Å; T20-L47 HydrophobicContact CG2-CG 4.48Å; T20-Y48 HydrophobicContact CG2-CE1 4.21Å
21P90.7Very high86.8Confident29 Ų2971 Ų7119%0.18838%0.379CS..Hα-helixtrans-59.2-39.4176.4-2332.9000113.2I17 V18 L25 Y40 L44 Y48I17-P21 WeakPolarHBondContact O-CD 3.42Å; I17-P21 WeakPolarHBondContact O-CG 3.38Å; V18-P21 WeakPolarHBondContact O-CD 3.24Å; P21-L25 WeakPolarHBondContact O-CB 3.45Å; P21-L25 PolarHBondContact O-N 2.9Å; P21-Y40 VanDerWaalsContact CA-OH 3.27Å; P21-Y40 WeakPolarHBondContact CA-OH 3.39Å; P21-Y40 WeakPolarHBondContact CB-OH 3.48Å; P21-Y40 PolarHBondContact O-OH 3.42Å; P21-L44 HydrophobicContact CB-CD1 3.89Å; P21-L44 HydrophobicContact CG-CD1 3.78Å; P21-Y48 WeakPolarHBondContact CD-OH 3.41Å; P21-Y48 WeakPolarHBondContact CG-OH 3.37Å
22L89.9Confident85.6Confident109 Ų10975.6 Ų75.657%0.57140%0.401SS*.Hα-helixtrans-69.5-40.9179.6-68.9173.8000112.2V18 V19 T20 F24 L25V18-L22 HydrophobicContact CG1-CD1 3.95Å; V18-L22 WeakPolarHBondContact O-CD1 3.32Å; V18-L22 VanDerWaalsContact O-CG 3.28Å; V18-L22 WeakPolarHBondContact O-CG 3.42Å; V19-L22 PolarHBondContact O-N 3.43Å; T20-L22 VanDerWaalsContact C-N 3.3Å; T20-L22 PolarHBondContact O-N 3.32Å; L22-F24 VanDerWaalsContact C-N 3.34Å; L22-F24 PolarHBondContact O-N 3.23Å; L22-L25 WeakPolarHBondContact O-CB 3.34Å; L22-L25 PolarHBondContact O-N 3.12Å
23A90.1Very high85.3Confident64 Ų6472.8 Ų72.853%0.52940%0.396SS..Hα-helixtrans-65.5-37.8-179.700000112V19 T20 P26V19-A23 VanDerWaalsContact O-CB 3.24Å; V19-A23 WeakPolarHBondContact O-CB 3.46Å; V19-A23 PolarHBondContact O-N 3.33Å; T20-A23 PolarHBondContact O-N 3.45Å; A23-P26 WeakPolarHBondContact O-CD 3.44Å
24F89.3Confident85.2Confident74 Ų7474.8 Ų74.833%0.32540%0.404SS..Hα-helixtrans-93.1-5.5178.6-70.7-80000113.7T20 L22 P26 L27 P28 Y40 I43 L47T20-F24 HydrophobicContact CG2-CD2 4.08Å; T20-F24 HydrophobicContact CG2-CE2 4.34Å; T20-F24 WeakPolarHBondContact O-CD2 3.43Å; T20-F24 PolarHBondContact O-N 3.4Å; T20-F24 VanDerWaalsContact O-N 3.16Å; L22-F24 VanDerWaalsContact C-N 3.34Å; L22-F24 PolarHBondContact O-N 3.23Å; F24-P26 VanDerWaalsContact C-N 3.3Å; F24-L27 WeakPolarHBondContact O-CB 3.38Å; F24-L27 PolarHBondContact O-N 2.9Å; F24-P28 VanDerWaalsContact O-CD 3.31Å; F24-P28 WeakPolarHBondContact O-CD 3.47Å; F24-Y40 VanDerWaalsContact C-CE2 3.44Å; F24-Y40 HydrophobicContact CB-CD2 3.74Å; F24-Y40 HydrophobicContact CB-CE2 3.69Å; F24-Y40 VanDerWaalsContact O-CD2 3.3Å; F24-Y40 WeakPolarHBondContact O-CD2 3.16Å; F24-I43 HydrophobicContact CD1-CD1 4.48Å; F24-I43 HydrophobicContact CD1-CG2 3.93Å; F24-I43 HydrophobicContact CD2-CG2 4.07Å; F24-I43 HydrophobicContact CE1-CG2 3.82Å; F24-I43 HydrophobicContact CE2-CG2 3.97Å; F24-I43 HydrophobicContact CG-CG2 4.06Å; F24-I43 HydrophobicContact CZ-CG2 3.84Å; F24-L47 HydrophobicContact CD2-CD1 4.2Å; F24-L47 HydrophobicContact CE2-CD1 3.49Å; F24-L47 VanDerWaalsContact CE2-CD1 3.49Å; F24-L47 HydrophobicContact CZ-CD1 4.12Å
25L87.1Confident85.1Confident70 Ų7069.6 Ų69.637%0.36639%0.385SS..THydrogen-bonded Turntrans-55.8-33.3178.5-161.577.1000114.4P21 L22 L27 P28 L29P21-L25 WeakPolarHBondContact O-CB 3.45Å; P21-L25 PolarHBondContact O-N 2.9Å; L22-L25 WeakPolarHBondContact O-CB 3.34Å; L22-L25 PolarHBondContact O-N 3.12Å; L25-L27 PolarHBondContact O-N 3.47Å; L25-P28 WeakPolarHBondContact O-CD 3.47Å; L25-P28 WeakPolarHBondContact O-CG 3.41Å; L25-L29 HydrophobicContact CD2-CD1 3.91Å; L25-L29 HydrophobicContact CG-CD1 3.79Å; L25-L29 WeakPolarHBondContact O-CG 3.29Å
26P86.3Confident85.1Confident67 Ų6767.9 Ų67.944%0.43538%0.379SS..Hα-helixtrans-58.8-30.3174.7-26.736.6000112.9A23 F24 L29 T30A23-P26 WeakPolarHBondContact O-CD 3.44Å; F24-P26 VanDerWaalsContact C-N 3.3Å; P26-L29 PolarHBondContact O-N 3.07Å; P26-L29 VanDerWaalsContact O-N 3.15Å; P26-T30 HydrophobicContact CB-CG2 4.35Å; P26-T30 WeakPolarHBondContact O-CB 3.3Å; P26-T30 WeakPolarHBondContact O-CG2 3.36Å; P26-T30 PolarHBondContact O-N 2.9Å; P26-T30 PolarHBondContact O-OG1 3.12Å
27L83.8Confident85.2Confident60 Ų6068.8 Ų68.831%0.31438%0.381SS..Hα-helixtrans-59.2-53.5-175.4-167.9121.3000113.1F24 L25 L29 V31 A36F24-L27 WeakPolarHBondContact O-CB 3.38Å; F24-L27 PolarHBondContact O-N 2.9Å; L25-L27 PolarHBondContact O-N 3.47Å; L27-L29 VanDerWaalsContact C-N 3.28Å; L27-L29 PolarHBondContact O-N 3.02Å; L27-V31 PolarHBondContact O-N 3.08Å; L27-A36 HydrophobicContact CD2-CB 4.25Å; L27-A36 WeakPolarHBondContact CD2-O 3.21Å
28P82.3Confident85.2Confident13 Ų1366.4 Ų66.48%0.08437%0.369CS..Hα-helixtrans-72.5-1517528.6-37.2000114.7F24 L25 K37 Y40F24-P28 VanDerWaalsContact O-CD 3.31Å; F24-P28 WeakPolarHBondContact O-CD 3.47Å; L25-P28 WeakPolarHBondContact O-CD 3.47Å; L25-P28 WeakPolarHBondContact O-CG 3.41Å; P28-K37 HydrophobicContact CB-CG 4.14Å; P28-Y40 HydrophobicContact CG-CD2 4.04Å; P28-Y40 HydrophobicContact CG-CG 4.05Å
29L80.7Confident85.2Confident110 Ų11062.7 Ų62.758%0.57635%0.349SS*.Hα-helixtrans-95.9-31.5-175.7-68.4177.9000113.9L25 P26 L27L25-L29 HydrophobicContact CD2-CD1 3.91Å; L25-L29 HydrophobicContact CG-CD1 3.79Å; L25-L29 WeakPolarHBondContact O-CG 3.29Å; P26-L29 PolarHBondContact O-N 3.07Å; P26-L29 VanDerWaalsContact O-N 3.15Å; L27-L29 VanDerWaalsContact C-N 3.28Å; L27-L29 PolarHBondContact O-N 3.02Å
30T75.6Confident85.3Confident108 Ų10859.4 Ų59.466%0.66333%0.328SS*.Hα-helixtrans-100.2-25.1-176.263.60000112.9P26P26-T30 HydrophobicContact CB-CG2 4.35Å; P26-T30 WeakPolarHBondContact O-CB 3.3Å; P26-T30 WeakPolarHBondContact O-CG2 3.36Å; P26-T30 PolarHBondContact O-N 2.9Å; P26-T30 PolarHBondContact O-OG1 3.12Å
31V70.5Confident85.4Confident74 Ų7458.6 Ų58.645%0.44832%0.322SS..SBendtrans-113.8111.3179.9-169.30000106.3L27 P33 A36L27-V31 PolarHBondContact O-N 3.08Å; V31-P33 HydrophobicContact CG1-CG 3.84Å; V31-P33 WeakPolarHBondContact O-CD 3.35Å; V31-A36 HydrophobicContact CB-CB 4.34Å; V31-A36 HydrophobicContact CG1-CB 4.41Å
32H64.2Low85.3Confident154 Ų15458.3 Ų58.371%0.71332%0.319SS*.  trans-101.373.1177.6-74.2-37.2000114.4
33P82.1Confident85.4Confident47 Ų4755.7 Ų55.731%0.30531%0.305SS..SBendtrans-116.2150.9150.440-32.3000109.6V31 E35 A36V31-P33 HydrophobicContact CG1-CG 3.84Å; V31-P33 WeakPolarHBondContact O-CD 3.35Å; P33-E35 HydrophobicContact CB-CB 4.36Å; P33-E35 WeakPolarHBondContact CB-OE2 3.04Å; P33-E35 HydrophobicContact CG-CB 4.4Å; P33-E35 PolarHBondContact O-N 3.29Å; P33-A36 HydrophobicContact CG-CB 3.91Å; P33-A36 PolarHBondContact O-N 3.2Å; P33-A36 VanDerWaalsContact O-N 3.11Å
34E84.5Confident85.6Confident96 Ų9653 Ų5345%0.44928%0.282SS..Hα-helixtrans-60.7-28.4178.3-67.9-167.9163.200111.4A36 K37 C38E34-A36 VanDerWaalsContact C-N 3.32Å; E34-A36 PolarHBondContact O-N 3.46Å; E34-K37 PolarHBondContact O-N 3.16Å; E34-C38 PolarHBondContact O-N 3.2Å; E34-C38 VanDerWaalsContact O-N 3.11Å
35E87.1Confident85.7Confident60 Ų6049.5 Ų49.528%0.2827%0.266SS..Hα-helixtrans-51.7-44.5171.9-62.387.7143.500112.2P33 C38 G39 S460 L462 W465P33-E35 HydrophobicContact CB-CB 4.36Å; P33-E35 WeakPolarHBondContact CB-OE2 3.04Å; P33-E35 HydrophobicContact CG-CB 4.4Å; P33-E35 PolarHBondContact O-N 3.29Å; E35-C38 PolarHBondContact O-N 3.11Å; E35-G39 PolarHBondContact O-N 3.19Å; E35-S460 VanDerWaalsContact CD-O 3.29Å; E35-S460 VanDerWaalsContact CG-O 3.24Å; E35-S460 WeakPolarHBondContact CG-O 3.37Å; E35-S460 PolarHBondContact N-O 2.99Å; E35-L462 HydrophobicContact CB-CB 4.32Å; E35-L462 HydrophobicContact CB-CD1 4.25Å; E35-L462 HydrophobicContact CG-CB 4.5Å; E35-W465 HydrophobicContact CG-CB 4.39Å
36A90Very high85.7Confident13 Ų1346.9 Ų46.911%0.10726%0.255CS..Hα-helixtrans-69.6-37.2-17800000111.6L27 V31 P33 E34 G39 Y40L27-A36 HydrophobicContact CD2-CB 4.25Å; L27-A36 WeakPolarHBondContact CD2-O 3.21Å; V31-A36 HydrophobicContact CB-CB 4.34Å; V31-A36 HydrophobicContact CG1-CB 4.41Å; P33-A36 HydrophobicContact CG-CB 3.91Å; P33-A36 PolarHBondContact O-N 3.2Å; P33-A36 VanDerWaalsContact O-N 3.11Å; E34-A36 VanDerWaalsContact C-N 3.32Å; E34-A36 PolarHBondContact O-N 3.46Å; A36-G39 PolarHBondContact O-N 3.29Å; A36-Y40 PolarHBondContact O-N 3.31Å
37K91.6Very high86Confident60 Ų6046.6 Ų46.626%0.26125%0.249SC..Hα-helixtrans-65.6-43.2176.2-62.1174.1174.8-179.50111.1P28 E34 Y40 V41 M70 I72P28-K37 HydrophobicContact CB-CG 4.14Å; E34-K37 PolarHBondContact O-N 3.16Å; K37-Y40 WeakPolarHBondContact O-CB 3.31Å; K37-Y40 PolarHBondContact O-N 3.25Å; K37-V41 PolarHBondContact O-N 3.45Å; K37-M70 HydrophobicContact CB-CB 4.29Å; K37-M70 HydrophobicContact CB-SD 4.21Å; K37-M70 HydrophobicContact CD-CB 4.29Å; K37-M70 WeakPolarHBondContact CD-O 3.43Å; K37-M70 PolarHBondContact NZ-O 3.48Å; K37-I72 HydrophobicContact CB-CD1 3.96Å; K37-I72 HydrophobicContact CB-CG1 4.2Å
38C90.7Very high86.4Confident0 Ų044.1 Ų44.10%024%0.236CC..Hα-helixtrans-64.9-45.2174.8-170.90000111.5E34 E35 Y40 V41 I42 I72 G456 S460 L462E34-C38 PolarHBondContact O-N 3.2Å; E34-C38 VanDerWaalsContact O-N 3.11Å; E35-C38 PolarHBondContact O-N 3.11Å; C38-Y40 VanDerWaalsContact C-N 3.28Å; C38-Y40 PolarHBondContact O-N 3.47Å; C38-V41 PolarHBondContact O-N 2.91Å; C38-I42 PolarHBondContact O-N 3.23Å; C38-I72 HydrophobicContact CB-CD1 4.1Å; C38-G456 PolarHBondContact SG-O 3.49Å; C38-S460 WeakPolarHBondContact CB-OG 3.4Å; C38-L462 HydrophobicContact CB-CB 4.45Å; C38-L462 HydrophobicContact CB-CD2 4.08Å
39G90.1Very high86.7Confident11 Ų1143.6 Ų43.611%0.11323%0.232CC..Hα-helixtrans-58.2-38.2177.400000112.8E35 A36 V41 I42 I43E35-G39 PolarHBondContact O-N 3.19Å; A36-G39 PolarHBondContact O-N 3.29Å; G39-V41 PolarHBondContact O-N 2.95Å; G39-I42 PolarHBondContact O-N 2.9Å; G39-I43 WeakPolarHBondContact O-CB 3.42Å; G39-I43 VanDerWaalsContact O-CG1 3.24Å; G39-I43 WeakPolarHBondContact O-CG1 3.4Å; G39-I43 PolarHBondContact O-N 3.37Å
40Y92.9Very high86.8Confident11 Ų1140.6 Ų40.64%0.04322%0.22CC..Hα-helixtrans-57.3-48172.9173.1-95000112.4P21 F24 P28 A36 K37 C38 I43 L44 M70P21-Y40 VanDerWaalsContact CA-OH 3.27Å; P21-Y40 WeakPolarHBondContact CA-OH 3.39Å; P21-Y40 WeakPolarHBondContact CB-OH 3.48Å; P21-Y40 PolarHBondContact O-OH 3.42Å; F24-Y40 VanDerWaalsContact C-CE2 3.44Å; F24-Y40 HydrophobicContact CB-CD2 3.74Å; F24-Y40 HydrophobicContact CB-CE2 3.69Å; F24-Y40 VanDerWaalsContact O-CD2 3.3Å; F24-Y40 WeakPolarHBondContact O-CD2 3.16Å; P28-Y40 HydrophobicContact CG-CD2 4.04Å; P28-Y40 HydrophobicContact CG-CG 4.05Å; A36-Y40 PolarHBondContact O-N 3.31Å; K37-Y40 WeakPolarHBondContact O-CB 3.31Å; K37-Y40 PolarHBondContact O-N 3.25Å; C38-Y40 VanDerWaalsContact C-N 3.28Å; C38-Y40 PolarHBondContact O-N 3.47Å; Y40-I43 PolarHBondContact O-N 3.14Å; Y40-L44 HydrophobicContact CE1-CD1 3.89Å; Y40-L44 VanDerWaalsContact O-CB 3.27Å; Y40-L44 WeakPolarHBondContact O-CB 3.11Å; Y40-L44 PolarHBondContact O-N 3.37Å; Y40-M70 HydrophobicContact CD1-CE 3.4Å; Y40-M70 HydrophobicContact CD1-SD 4.12Å; Y40-M70 HydrophobicContact CE1-CE 3.5Å; Y40-M70 VanDerWaalsContact CE1-CE 3.5Å; Y40-M70 HydrophobicContact CG-CE 4.42Å
41V92.9Very high87.4Confident0 Ų038.2 Ų38.20%021%0.206CC..Hα-helixtrans-65.1-42.4179.8179.80000110.9K37 C38 G39 L44 M45 L66 F67 M70 L453K37-V41 PolarHBondContact O-N 3.45Å; C38-V41 PolarHBondContact O-N 2.91Å; G39-V41 PolarHBondContact O-N 2.95Å; V41-L44 PolarHBondContact O-N 3.31Å; V41-M45 HydrophobicContact CG1-CG 4.36Å; V41-M45 HydrophobicContact CG1-SD 3.92Å; V41-M45 WeakPolarHBondContact O-CB 3.44Å; V41-M45 WeakPolarHBondContact O-CG 3.15Å; V41-M45 PolarHBondContact O-N 3.5Å; V41-L66 HydrophobicContact CG1-CB 4.41Å; V41-L66 HydrophobicContact CG1-CD1 4.16Å; V41-L66 HydrophobicContact CG2-CB 3.72Å; V41-L66 HydrophobicContact CG2-CD1 3.98Å; V41-L66 HydrophobicContact CG2-CG 4.5Å; V41-F67 HydrophobicContact CB-CD1 4.34Å; V41-F67 HydrophobicContact CB-CE1 3.73Å; V41-F67 HydrophobicContact CG1-CD1 4.14Å; V41-F67 HydrophobicContact CG1-CE1 3.54Å; V41-F67 HydrophobicContact CG1-CZ 4.34Å; V41-F67 HydrophobicContact CG2-CD1 4.04Å; V41-F67 HydrophobicContact CG2-CE1 3.91Å; V41-M70 HydrophobicContact CG2-SD 3.91Å; V41-L453 HydrophobicContact CG1-CD2 4.22Å
42I90.4Very high88.2Confident24 Ų2439.8 Ų39.812%0.12321%0.208CC..Hα-helixtrans-62-47.1177.2-68172.6000111.1C38 G39 L44 M45 A46 L453 S457 L462 L504C38-I42 PolarHBondContact O-N 3.23Å; G39-I42 PolarHBondContact O-N 2.9Å; I42-L44 VanDerWaalsContact C-N 3.32Å; I42-L44 PolarHBondContact O-N 3.04Å; I42-M45 PolarHBondContact O-N 2.99Å; I42-A46 WeakPolarHBondContact O-CB 3.4Å; I42-A46 PolarHBondContact O-N 3Å; I42-L453 HydrophobicContact CG1-CD2 3.72Å; I42-S457 WeakPolarHBondContact CD1-OG 3.31Å; I42-L462 HydrophobicContact CD1-CD2 3.49Å; I42-L462 VanDerWaalsContact CD1-CD2 3.49Å; I42-L504 HydrophobicContact CG2-CD1 4.05Å
43I91.3Very high89.4Confident54 Ų5433 Ų3328%0.27718%0.177SC..Hα-helixtrans-60.8-44.9178.8-71.1165.7000110.4F24 G39 Y40 A46 L47F24-I43 HydrophobicContact CD1-CD1 4.48Å; F24-I43 HydrophobicContact CD1-CG2 3.93Å; F24-I43 HydrophobicContact CD2-CG2 4.07Å; F24-I43 HydrophobicContact CE1-CG2 3.82Å; F24-I43 HydrophobicContact CE2-CG2 3.97Å; F24-I43 HydrophobicContact CG-CG2 4.06Å; F24-I43 HydrophobicContact CZ-CG2 3.84Å; G39-I43 WeakPolarHBondContact O-CB 3.42Å; G39-I43 VanDerWaalsContact O-CG1 3.24Å; G39-I43 WeakPolarHBondContact O-CG1 3.4Å; G39-I43 PolarHBondContact O-N 3.37Å; Y40-I43 PolarHBondContact O-N 3.14Å; I43-A46 PolarHBondContact O-N 3.31Å; I43-L47 HydrophobicContact CG2-CD1 3.89Å; I43-L47 HydrophobicContact CG2-CG 4.45Å; I43-L47 WeakPolarHBondContact O-CB 3.29Å; I43-L47 VanDerWaalsContact O-CG 3.31Å; I43-L47 WeakPolarHBondContact O-CG 3.34Å; I43-L47 PolarHBondContact O-N 3.04Å
44L93.3Very high89.7Confident7 Ų732.2 Ų32.24%0.03717%0.17CC..Hα-helixtrans-63.2-46.3179.9-174.2151.4000111.1P21 Y40 V41 I42 L47 Y48 L62P21-L44 HydrophobicContact CB-CD1 3.89Å; P21-L44 HydrophobicContact CG-CD1 3.78Å; Y40-L44 HydrophobicContact CE1-CD1 3.89Å; Y40-L44 VanDerWaalsContact O-CB 3.27Å; Y40-L44 WeakPolarHBondContact O-CB 3.11Å; Y40-L44 PolarHBondContact O-N 3.37Å; V41-L44 PolarHBondContact O-N 3.31Å; I42-L44 VanDerWaalsContact C-N 3.32Å; I42-L44 PolarHBondContact O-N 3.04Å; L44-L47 PolarHBondContact O-N 3.44Å; L44-Y48 HydrophobicContact CD2-CD2 3.68Å; L44-Y48 HydrophobicContact CD2-CE2 3.38Å; L44-Y48 HydrophobicContact CD2-CG 4.48Å; L44-Y48 HydrophobicContact CG-CD2 4.43Å; L44-Y48 HydrophobicContact CG-CE2 4.01Å; L44-Y48 WeakPolarHBondContact O-CB 3.34Å; L44-Y48 VanDerWaalsContact O-CG 3.24Å; L44-Y48 PolarHBondContact O-N 3.48Å; L44-L62 HydrophobicContact CD2-CD1 3.32Å; L44-L62 HydrophobicContact CD2-CG 4.47Å
45M92.1Very high90Very high0 Ų032 Ų320%018%0.177CC..Hα-helixtrans-64.1-43175.2-73.4-178.868.600112.4V41 I42 L47 Y48 W49 T59 L62 P63 L453V41-M45 HydrophobicContact CG1-CG 4.36Å; V41-M45 HydrophobicContact CG1-SD 3.92Å; V41-M45 WeakPolarHBondContact O-CB 3.44Å; V41-M45 WeakPolarHBondContact O-CG 3.15Å; V41-M45 PolarHBondContact O-N 3.5Å; I42-M45 PolarHBondContact O-N 2.99Å; M45-L47 PolarHBondContact O-N 2.68Å; M45-Y48 PolarHBondContact O-N 3.25Å; M45-W49 HydrophobicContact CB-CE3 4.39Å; M45-W49 HydrophobicContact CB-CZ3 4.38Å; M45-W49 HydrophobicContact CE-CH2 3.35Å; M45-W49 HydrophobicContact CE-CZ2 3.42Å; M45-W49 VanDerWaalsContact CE-CZ2 3.42Å; M45-W49 HydrophobicContact CE-CZ3 4.11Å; M45-W49 WeakPolarHBondContact O-CB 3.41Å; M45-W49 PolarHBondContact O-N 2.89Å; M45-T59 HydrophobicContact CB-CG2 4.3Å; M45-T59 HydrophobicContact CG-CG2 4.26Å; M45-L62 HydrophobicContact CG-CB 4.17Å; M45-L62 HydrophobicContact CG-CD1 3.84Å; M45-L62 HydrophobicContact SD-CB 4.26Å; M45-P63 HydrophobicContact CE-CG 3.88Å; M45-P63 VanDerWaalsContact SD-CD 3.57Å; M45-P63 HydrophobicContact SD-CG 3.46Å; M45-P63 WeakPolarHBondContact SD-CG 3.17Å; M45-L453 HydrophobicContact CE-CD1 3.72Å; M45-L453 HydrophobicContact CE-CD2 4.33Å; M45-L453 HydrophobicContact CE-CG 3.97Å; M45-L453 HydrophobicContact SD-CD1 3.85Å; M45-L453 HydrophobicContact SD-CD2 3.49Å; M45-L453 WeakPolarHBondContact SD-CD2 3.28Å; M45-L453 HydrophobicContact SD-CG 3.8Å
46A88.4Confident90.1Very high15 Ų1530.6 Ų30.612%0.12417%0.171CC..Hα-helixtrans-58.7-49.2177.700000111I42 I43 Y48 W49 C50 L504I42-A46 WeakPolarHBondContact O-CB 3.4Å; I42-A46 PolarHBondContact O-N 3Å; I43-A46 PolarHBondContact O-N 3.31Å; A46-Y48 PolarHBondContact O-N 2.71Å; A46-W49 PolarHBondContact O-N 2.99Å; A46-C50 WeakPolarHBondContact O-CB 3.41Å; A46-C50 PolarHBondContact O-N 2.99Å; A46-C50 PolarHBondContact O-SG 2.95Å; A46-L504 HydrophobicContact CB-CD1 3.67Å; A46-L504 HydrophobicContact CB-CD2 3.93Å; A46-L504 HydrophobicContact CB-CG 4.46Å
47L90.7Very high90.1Very high61 Ų6130.6 Ų30.632%0.31917%0.171SC..Hα-helixtrans-64.1-40.7178.8-70.8172.6000111.9T20 F24 I43 L44 M45 C50 T51T20-L47 HydrophobicContact CG2-CB 4.18Å; T20-L47 HydrophobicContact CG2-CD1 3.47Å; T20-L47 VanDerWaalsContact CG2-CD1 3.47Å; T20-L47 HydrophobicContact CG2-CG 4.48Å; F24-L47 HydrophobicContact CD2-CD1 4.2Å; F24-L47 HydrophobicContact CE2-CD1 3.49Å; F24-L47 VanDerWaalsContact CE2-CD1 3.49Å; F24-L47 HydrophobicContact CZ-CD1 4.12Å; I43-L47 HydrophobicContact CG2-CD1 3.89Å; I43-L47 HydrophobicContact CG2-CG 4.45Å; I43-L47 WeakPolarHBondContact O-CB 3.29Å; I43-L47 VanDerWaalsContact O-CG 3.31Å; I43-L47 WeakPolarHBondContact O-CG 3.34Å; I43-L47 PolarHBondContact O-N 3.04Å; L44-L47 PolarHBondContact O-N 3.44Å; M45-L47 PolarHBondContact O-N 2.68Å; L47-C50 PolarHBondContact O-N 3.35Å; L47-T51 WeakPolarHBondContact O-CB 3.32Å; L47-T51 WeakPolarHBondContact O-CG2 3.36Å; L47-T51 PolarHBondContact O-N 3.45Å; L47-T51 PolarHBondContact O-OG1 2.99Å
48Y92.3Very high90.2Very high8 Ų831.3 Ų31.33%0.03118%0.181CC..Hα-helixtrans-69-35.9177.8-73.1-0.9000113.1I16 I17 T20 P21 L44 M45 A46 E52 C53 M54 T59 L62I16-Y48 HydrophobicContact CG2-CD1 4.25Å; I16-Y48 HydrophobicContact CG2-CE1 4.22Å; I17-Y48 WeakPolarHBondContact CA-OH 3.39Å; I17-Y48 PolarHBondContact O-OH 3.36Å; T20-Y48 HydrophobicContact CG2-CE1 4.21Å; P21-Y48 WeakPolarHBondContact CD-OH 3.41Å; P21-Y48 WeakPolarHBondContact CG-OH 3.37Å; L44-Y48 HydrophobicContact CD2-CD2 3.68Å; L44-Y48 HydrophobicContact CD2-CE2 3.38Å; L44-Y48 HydrophobicContact CD2-CG 4.48Å; L44-Y48 HydrophobicContact CG-CD2 4.43Å; L44-Y48 HydrophobicContact CG-CE2 4.01Å; L44-Y48 WeakPolarHBondContact O-CB 3.34Å; L44-Y48 VanDerWaalsContact O-CG 3.24Å; L44-Y48 PolarHBondContact O-N 3.48Å; M45-Y48 PolarHBondContact O-N 3.25Å; A46-Y48 PolarHBondContact O-N 2.71Å; Y48-E52 VanDerWaalsContact O-CA 3.29Å; Y48-E52 WeakPolarHBondContact O-CA 3.18Å; Y48-E52 PolarHBondContact O-N 3.47Å; Y48-C53 WeakPolarHBondContact CD1-SG 3.48Å; Y48-M54 HydrophobicContact CD2-CE 3.39Å; Y48-M54 HydrophobicContact CE2-CE 3.6Å; Y48-M54 HydrophobicContact CE2-SD 4.46Å; Y48-M54 HydrophobicContact CG-CE 4.35Å; Y48-T59 HydrophobicContact CD2-CG2 4.24Å; Y48-T59 HydrophobicContact CG-CG2 4.46Å; Y48-L62 HydrophobicContact CD2-CD1 3.79Å; Y48-L62 HydrophobicContact CE2-CD1 4.08Å
49W88.5Confident90.3Very high3 Ų331.3 Ų31.31%0.01118%0.181CC..Hα-helixtrans-70.8-39.6173-78.3-28.1000112.6M45 A46 E52 L56 T59 A60 L446 L453 A500 T503M45-W49 HydrophobicContact CB-CE3 4.39Å; M45-W49 HydrophobicContact CB-CZ3 4.38Å; M45-W49 HydrophobicContact CE-CH2 3.35Å; M45-W49 HydrophobicContact CE-CZ2 3.42Å; M45-W49 VanDerWaalsContact CE-CZ2 3.42Å; M45-W49 HydrophobicContact CE-CZ3 4.11Å; M45-W49 WeakPolarHBondContact O-CB 3.41Å; M45-W49 PolarHBondContact O-N 2.89Å; A46-W49 PolarHBondContact O-N 2.99Å; W49-E52 WeakPolarHBondContact O-CG 3.41Å; W49-L56 HydrophobicContact CG-CD2 4.32Å; W49-L56 PolarHBondContact NE1-O 3.47Å; W49-T59 HydrophobicContact CD2-CG2 4.33Å; W49-T59 HydrophobicContact CG-CG2 4.1Å; W49-A60 HydrophobicContact CZ2-CB 4.3Å; W49-L446 HydrophobicContact CZ2-CD2 4.36Å; W49-L446 HydrophobicContact CZ2-CG 4.41Å; W49-L453 HydrophobicContact CH2-CD1 3.81Å; W49-L453 HydrophobicContact CZ3-CD1 3.82Å; W49-A500 HydrophobicContact CB-CB 3.76Å; W49-A500 HydrophobicContact CD2-CB 4.06Å; W49-A500 HydrophobicContact CE3-CB 4.39Å; W49-A500 HydrophobicContact CG-CB 3.81Å; W49-T503 HydrophobicContact CH2-CG2 3.39Å; W49-T503 HydrophobicContact CZ2-CG2 4.35Å; W49-T503 HydrophobicContact CZ3-CG2 3.73Å
50C84.6Confident90.4Very high46 Ų4630.8 Ų30.831%0.31118%0.175SC..Hα-helixtrans-67.4-38.1177.4-670000112.7A46 L47 F492A46-C50 WeakPolarHBondContact O-CB 3.41Å; A46-C50 PolarHBondContact O-N 2.99Å; A46-C50 PolarHBondContact O-SG 2.95Å; L47-C50 PolarHBondContact O-N 3.35Å; C50-F492 WeakPolarHBondContact SG-CZ 3.29Å
51T87.9Confident90.5Very high59 Ų5933.5 Ų33.536%0.36219%0.19SC..Hα-helixtrans-90.1-11.4-177.658.20000113I16 L47 C53I16-T51 HydrophobicContact CD1-CG2 4.15Å; L47-T51 WeakPolarHBondContact O-CB 3.32Å; L47-T51 WeakPolarHBondContact O-CG2 3.36Å; L47-T51 PolarHBondContact O-N 3.45Å; L47-T51 PolarHBondContact O-OG1 2.99Å; T51-C53 PolarHBondContact O-N 3.29Å
52E86.8Confident90.6Very high107 Ų10735.1 Ų35.150%0.520%0.199SC..THydrogen-bonded Turntrans44.736.4-171.8-60.1-170.1-168.600112.6Y48 W49 M54 L56Y48-E52 VanDerWaalsContact O-CA 3.29Å; Y48-E52 WeakPolarHBondContact O-CA 3.18Å; Y48-E52 PolarHBondContact O-N 3.47Å; W49-E52 WeakPolarHBondContact O-CG 3.41Å; E52-M54 PolarHBondContact O-N 3Å; E52-L56 HydrophobicContact CG-CD2 4.31Å
53C88.6Confident90.9Very high10 Ų1034 Ų347%0.06819%0.193CC..  trans-66.7-25.1-177.3660000112.1N13 I16 I17 Y48 T51N13-C53 HydrophobicContact CB-CB 4.27Å; I16-C53 HydrophobicContact CB-CB 4.24Å; I16-C53 HydrophobicContact CG2-CB 4.01Å; I17-C53 HydrophobicContact CG1-CB 4.19Å; Y48-C53 WeakPolarHBondContact CD1-SG 3.48Å; T51-C53 PolarHBondContact O-N 3.29Å
54M90Very high91.1Very high32 Ų3233.7 Ų33.716%0.15819%0.193CC..SBendtrans-125.9156.5170.1-61.9-169-49.200110I17 Y48 E52 L56 V58 L62I17-M54 HydrophobicContact CD1-CG 3.58Å; I17-M54 HydrophobicContact CD1-SD 4.29Å; I17-M54 HydrophobicContact CG1-CG 3.83Å; I17-M54 HydrophobicContact CG1-SD 4.3Å; Y48-M54 HydrophobicContact CD2-CE 3.39Å; Y48-M54 HydrophobicContact CE2-CE 3.6Å; Y48-M54 HydrophobicContact CE2-SD 4.46Å; Y48-M54 HydrophobicContact CG-CE 4.35Å; E52-M54 PolarHBondContact O-N 3Å; M54-L56 PolarHBondContact O-N 3.36Å; M54-V58 HydrophobicContact CE-CG1 4.36Å; M54-V58 HydrophobicContact SD-CG1 4.33Å; M54-L62 HydrophobicContact CE-CD1 4.32Å
55P90.5Very high91.2Very high90 Ų9037.2 Ų37.258%0.58422%0.215SC*.  trans-54.9136.9172.9-2332.9000111.3A57 V58 T59P55-A57 PolarHBondContact O-N 3.4Å; P55-V58 HydrophobicContact CB-CG2 4.13Å; P55-V58 HydrophobicContact CG-CG2 4.23Å; P55-V58 WeakPolarHBondContact O-CB 3.24Å; P55-V58 PolarHBondContact O-N 3.06Å; P55-T59 PolarHBondContact O-N 3.3Å; P55-T59 VanDerWaalsContact O-N 3.16Å
56L87.9Confident91.3Very high31 Ų3138.7 Ų38.716%0.16222%0.223CC..Hα-helixtrans-52-36.2-173.5-61175.9000113.6W49 E52 M54 A60 L446W49-L56 HydrophobicContact CG-CD2 4.32Å; W49-L56 PolarHBondContact NE1-O 3.47Å; E52-L56 HydrophobicContact CG-CD2 4.31Å; M54-L56 PolarHBondContact O-N 3.36Å; L56-A60 WeakPolarHBondContact O-CB 3.27Å; L56-A60 PolarHBondContact O-N 3.36Å; L56-L446 HydrophobicContact CB-CD1 3.8Å; L56-L446 HydrophobicContact CD1-CD1 4.08Å; L56-L446 HydrophobicContact CG-CD1 4.48Å
57A90.4Very high91.6Very high14 Ų1438 Ų3812%0.11622%0.217CC..Hα-helixtrans-68.5-35.2177.900000113.5P55 A60 L61 N442 L445P55-A57 PolarHBondContact O-N 3.4Å; A57-A60 WeakPolarHBondContact O-CB 3.27Å; A57-A60 PolarHBondContact O-N 3.46Å; A57-L61 WeakPolarHBondContact O-CG 3.46Å; A57-L61 PolarHBondContact O-N 3.07Å; A57-N442 HydrophobicContact CB-CB 3.86Å; A57-L445 HydrophobicContact CB-CB 4.22Å; A57-L445 HydrophobicContact CB-CD1 4.1Å
58V94.1Very high91.9Very high75 Ų7537.1 Ų37.146%0.45522%0.215SC..Hα-helixtrans-71.2-44177.61790000109.6M54 P55 A60 L61M54-V58 HydrophobicContact CE-CG1 4.36Å; M54-V58 HydrophobicContact SD-CG1 4.33Å; P55-V58 HydrophobicContact CB-CG2 4.13Å; P55-V58 HydrophobicContact CG-CG2 4.23Å; P55-V58 WeakPolarHBondContact O-CB 3.24Å; P55-V58 PolarHBondContact O-N 3.06Å; V58-A60 VanDerWaalsContact C-N 3.25Å; V58-A60 PolarHBondContact O-N 3.21Å; V58-L61 PolarHBondContact O-N 2.57Å; V58-L61 VanDerWaalsContact O-N 3.14Å
59T93.2Very high91.9Very high0 Ų044 Ų440%025%0.249CC..Hα-helixtrans-58.2-41.3171.5-55.70000111M45 Y48 W49 P55 L61 L62M45-T59 HydrophobicContact CB-CG2 4.3Å; M45-T59 HydrophobicContact CG-CG2 4.26Å; Y48-T59 HydrophobicContact CD2-CG2 4.24Å; Y48-T59 HydrophobicContact CG-CG2 4.46Å; W49-T59 HydrophobicContact CD2-CG2 4.33Å; W49-T59 HydrophobicContact CG-CG2 4.1Å; P55-T59 PolarHBondContact O-N 3.3Å; P55-T59 VanDerWaalsContact O-N 3.16Å; T59-L61 PolarHBondContact O-N 2.84Å; T59-L62 HydrophobicContact CG2-CD1 4.01Å; T59-L62 VanDerWaalsContact O-CB 3.28Å; T59-L62 WeakPolarHBondContact O-CB 2.98Å; T59-L62 WeakPolarHBondContact O-CD1 3.28Å; T59-L62 VanDerWaalsContact O-CG 3.26Å; T59-L62 WeakPolarHBondContact O-CG 3.31Å; T59-L62 PolarHBondContact O-N 3.11Å; T59-L62 VanDerWaalsContact O-N 3.12Å
60A92.4Very high92.1Very high0 Ų045.6 Ų45.60%026%0.257CS..Hα-helixtrans-62.3-25.6178.700000113.6W49 L56 A57 V58 L62 P63 Y82 L446 G449W49-A60 HydrophobicContact CZ2-CB 4.3Å; L56-A60 WeakPolarHBondContact O-CB 3.27Å; L56-A60 PolarHBondContact O-N 3.36Å; A57-A60 WeakPolarHBondContact O-CB 3.27Å; A57-A60 PolarHBondContact O-N 3.46Å; V58-A60 VanDerWaalsContact C-N 3.25Å; V58-A60 PolarHBondContact O-N 3.21Å; A60-L62 VanDerWaalsContact C-N 3.33Å; A60-P63 WeakPolarHBondContact O-CD 3.42Å; A60-Y82 PolarHBondContact O-OH 3.35Å; A60-L446 HydrophobicContact CB-CB 4.36Å; A60-L446 HydrophobicContact CB-CG 4.47Å; A60-G449 VanDerWaalsContact O-CA 3.25Å; A60-G449 WeakPolarHBondContact O-CA 3.44Å
61L95.4Very high92.3Very high68 Ų6845.9 Ų45.936%0.35627%0.268SS..THydrogen-bonded Turntrans-80.5-8.8177.7-71.6170000114A57 V58 T59 P63 V64 Y82 L445A57-L61 WeakPolarHBondContact O-CG 3.46Å; A57-L61 PolarHBondContact O-N 3.07Å; V58-L61 PolarHBondContact O-N 2.57Å; V58-L61 VanDerWaalsContact O-N 3.14Å; T59-L61 PolarHBondContact O-N 2.84Å; L61-P63 VanDerWaalsContact C-N 3.34Å; L61-V64 HydrophobicContact CD2-CG2 4.2Å; L61-V64 VanDerWaalsContact O-CB 3.29Å; L61-V64 WeakPolarHBondContact O-CB 3.36Å; L61-V64 PolarHBondContact O-N 2.88Å; L61-Y82 HydrophobicContact CD2-CE1 3.94Å; L61-L445 HydrophobicContact CD2-CD2 4.29Å
62L94.9Very high92.5Very high34 Ų3443.5 Ų43.518%0.17825%0.253CS..Hα-helixtrans-54.4-39.5179.8-71.9170.3000114.4L44 M45 Y48 M54 T59 A60 V64 V65 L66L44-L62 HydrophobicContact CD2-CD1 3.32Å; L44-L62 HydrophobicContact CD2-CG 4.47Å; M45-L62 HydrophobicContact CG-CB 4.17Å; M45-L62 HydrophobicContact CG-CD1 3.84Å; M45-L62 HydrophobicContact SD-CB 4.26Å; Y48-L62 HydrophobicContact CD2-CD1 3.79Å; Y48-L62 HydrophobicContact CE2-CD1 4.08Å; M54-L62 HydrophobicContact CE-CD1 4.32Å; T59-L62 HydrophobicContact CG2-CD1 4.01Å; T59-L62 VanDerWaalsContact O-CB 3.28Å; T59-L62 WeakPolarHBondContact O-CB 2.98Å; T59-L62 WeakPolarHBondContact O-CD1 3.28Å; T59-L62 VanDerWaalsContact O-CG 3.26Å; T59-L62 WeakPolarHBondContact O-CG 3.31Å; T59-L62 PolarHBondContact O-N 3.11Å; T59-L62 VanDerWaalsContact O-N 3.12Å; A60-L62 VanDerWaalsContact C-N 3.33Å; L62-V64 PolarHBondContact O-N 3.44Å; L62-V65 PolarHBondContact O-N 2.75Å; L62-V65 VanDerWaalsContact O-N 3.1Å; L62-L66 HydrophobicContact CB-CD1 4.23Å; L62-L66 HydrophobicContact CD2-CD1 4.39Å; L62-L66 WeakPolarHBondContact O-CB 3.34Å; L62-L66 WeakPolarHBondContact O-CG 3.3Å; L62-L66 PolarHBondContact O-N 3.39Å
63P95Very high92.8Very high0 Ų039.4 Ų39.40%023%0.234CC..Hα-helixtrans-57.7-34.2175.3-26.837.9000113.5M45 A60 L61 V65 F67 P68 V78 A452 L453M45-P63 HydrophobicContact CE-CG 3.88Å; M45-P63 VanDerWaalsContact SD-CD 3.57Å; M45-P63 HydrophobicContact SD-CG 3.46Å; M45-P63 WeakPolarHBondContact SD-CG 3.17Å; A60-P63 WeakPolarHBondContact O-CD 3.42Å; L61-P63 VanDerWaalsContact C-N 3.34Å; P63-V65 PolarHBondContact O-N 2.98Å; P63-F67 HydrophobicContact CB-CD1 4.44Å; P63-F67 HydrophobicContact CB-CD2 3.83Å; P63-F67 HydrophobicContact CB-CE1 4.41Å; P63-F67 HydrophobicContact CB-CE2 3.76Å; P63-F67 HydrophobicContact CB-CG 4.19Å; P63-F67 HydrophobicContact CB-CZ 4.08Å; P63-F67 VanDerWaalsContact O-CB 3.26Å; P63-F67 WeakPolarHBondContact O-CB 3.41Å; P63-F67 PolarHBondContact O-N 3.22Å; P63-P68 WeakPolarHBondContact O-CD 3.24Å; P63-V78 HydrophobicContact CB-CG1 4.37Å; P63-A452 HydrophobicContact CB-CB 3.75Å; P63-A452 HydrophobicContact CG-CB 4.2Å; P63-L453 HydrophobicContact CG-CD2 4.23Å; P63-L453 HydrophobicContact CG-CG 4.42Å
64V95.6Very high93.2Very high48 Ų4846.5 Ų46.529%0.29126%0.263SS..Hα-helixtrans-60-32.6178.9-176.30000111.3L61 L62 P68 V78 Y82L61-V64 HydrophobicContact CD2-CG2 4.2Å; L61-V64 VanDerWaalsContact O-CB 3.29Å; L61-V64 WeakPolarHBondContact O-CB 3.36Å; L61-V64 PolarHBondContact O-N 2.88Å; L62-V64 PolarHBondContact O-N 3.44Å; V64-P68 WeakPolarHBondContact O-CD 3.29Å; V64-P68 WeakPolarHBondContact O-CG 3.36Å; V64-V78 HydrophobicContact CG2-CG1 4.29Å; V64-Y82 HydrophobicContact CG2-CD2 4.31Å; V64-Y82 HydrophobicContact CG2-CE1 4.42Å; V64-Y82 HydrophobicContact CG2-CE2 3.45Å; V64-Y82 VanDerWaalsContact CG2-CE2 3.45Å; V64-Y82 WeakPolarHBondContact CG2-OH 3.26Å
65V95.8Very high93.4Very high81 Ų8147.6 Ų47.649%0.49128%0.277SS..Hα-helixtrans-93.3-52.2-179.7-179.60000110.8L62 P63 M69L62-V65 PolarHBondContact O-N 2.75Å; L62-V65 VanDerWaalsContact O-N 3.1Å; P63-V65 PolarHBondContact O-N 2.98Å; V65-M69 HydrophobicContact CG1-SD 3.63Å; V65-M69 WeakPolarHBondContact O-CB 3.48Å; V65-M69 WeakPolarHBondContact O-CG 3.39Å; V65-M69 PolarHBondContact O-N 2.94Å
66L94.9Very high93.6Very high31 Ų3145.4 Ų45.416%0.16227%0.272CS..Hα-helixtrans-75.5-36.1-168.5-63179.8000112.8V41 L62 M69 M70V41-L66 HydrophobicContact CG1-CB 4.41Å; V41-L66 HydrophobicContact CG1-CD1 4.16Å; V41-L66 HydrophobicContact CG2-CB 3.72Å; V41-L66 HydrophobicContact CG2-CD1 3.98Å; V41-L66 HydrophobicContact CG2-CG 4.5Å; L62-L66 HydrophobicContact CB-CD1 4.23Å; L62-L66 HydrophobicContact CD2-CD1 4.39Å; L62-L66 WeakPolarHBondContact O-CB 3.34Å; L62-L66 WeakPolarHBondContact O-CG 3.3Å; L62-L66 PolarHBondContact O-N 3.39Å; L66-M69 PolarHBondContact O-N 3.33Å; L66-M70 VanDerWaalsContact O-CB 3.24Å; L66-M70 WeakPolarHBondContact O-CB 3.48Å; L66-M70 VanDerWaalsContact O-CG 3.23Å; L66-M70 WeakPolarHBondContact O-CG 3.45Å; L66-M70 PolarHBondContact O-N 3.33Å
67F95.1Very high93.8Very high0 Ų047.7 Ų47.70%028%0.284CS..Hα-helixtrans-66.6-46.1-178.4-68.7-6.7000113.2V41 P63 M70 G71 I72 M73 V78 A452 L453V41-F67 HydrophobicContact CB-CD1 4.34Å; V41-F67 HydrophobicContact CB-CE1 3.73Å; V41-F67 HydrophobicContact CG1-CD1 4.14Å; V41-F67 HydrophobicContact CG1-CE1 3.54Å; V41-F67 HydrophobicContact CG1-CZ 4.34Å; V41-F67 HydrophobicContact CG2-CD1 4.04Å; V41-F67 HydrophobicContact CG2-CE1 3.91Å; P63-F67 HydrophobicContact CB-CD1 4.44Å; P63-F67 HydrophobicContact CB-CD2 3.83Å; P63-F67 HydrophobicContact CB-CE1 4.41Å; P63-F67 HydrophobicContact CB-CE2 3.76Å; P63-F67 HydrophobicContact CB-CG 4.19Å; P63-F67 HydrophobicContact CB-CZ 4.08Å; P63-F67 VanDerWaalsContact O-CB 3.26Å; P63-F67 WeakPolarHBondContact O-CB 3.41Å; P63-F67 PolarHBondContact O-N 3.22Å; F67-M70 PolarHBondContact O-N 2.65Å; F67-G71 PolarHBondContact O-N 3.06Å; F67-G71 VanDerWaalsContact O-N 3.12Å; F67-I72 HydrophobicContact CB-CB 4.27Å; F67-I72 HydrophobicContact CD1-CD1 3.77Å; F67-I72 HydrophobicContact CE1-CD1 4.17Å; F67-I72 HydrophobicContact CG-CB 4.47Å; F67-I72 HydrophobicContact CG-CD1 4.48Å; F67-I72 PolarHBondContact O-N 3.08Å; F67-M73 HydrophobicContact CB-CB 4.31Å; F67-M73 HydrophobicContact CD2-SD 3.94Å; F67-M73 HydrophobicContact CE2-SD 4.29Å; F67-V78 HydrophobicContact CB-CG2 3.99Å; F67-V78 HydrophobicContact CD2-CG2 4.15Å; F67-A452 HydrophobicContact CE2-CB 4.37Å; F67-A452 VanDerWaalsContact CE2-O 3.31Å; F67-A452 WeakPolarHBondContact CE2-O 3.38Å; F67-L453 HydrophobicContact CE1-CD2 4.44Å; F67-L453 HydrophobicContact CZ-CD2 3.83Å
68P95.2Very high94Very high43 Ų4347 Ų4728%0.27928%0.278SS..Hα-helixtrans-65.5-40.6174.4-23.136.4000112.5P63 V64 M70 G71 M73 A75 V78P63-P68 WeakPolarHBondContact O-CD 3.24Å; V64-P68 WeakPolarHBondContact O-CD 3.29Å; V64-P68 WeakPolarHBondContact O-CG 3.36Å; P68-M70 VanDerWaalsContact C-N 3.3Å; P68-M70 PolarHBondContact O-N 3.29Å; P68-G71 PolarHBondContact O-N 3Å; P68-M73 VanDerWaalsContact CA-O 3.25Å; P68-M73 WeakPolarHBondContact CA-O 3.23Å; P68-A75 HydrophobicContact CB-CB 4.3Å; P68-A75 HydrophobicContact CG-CB 3.92Å; P68-V78 HydrophobicContact CG-CG2 4.4Å
69M93.6Very high94Very high152 Ų15246.3 Ų46.375%0.74928%0.277SS*.Hα-helixtrans-64.8-33.5179.4-74.7-177.768.800113.1V65 L66V65-M69 HydrophobicContact CG1-SD 3.63Å; V65-M69 WeakPolarHBondContact O-CB 3.48Å; V65-M69 WeakPolarHBondContact O-CG 3.39Å; V65-M69 PolarHBondContact O-N 2.94Å; L66-M69 PolarHBondContact O-N 3.33Å
70M91.6Very high93.9Very high37 Ų3751.1 Ų51.118%0.18230%0.301CS..Hα-helixtrans-87.6-7.3178.8-67.3-171.1173.300113.4K37 Y40 V41 L66 F67 P68 I72K37-M70 HydrophobicContact CB-CB 4.29Å; K37-M70 HydrophobicContact CB-SD 4.21Å; K37-M70 HydrophobicContact CD-CB 4.29Å; K37-M70 WeakPolarHBondContact CD-O 3.43Å; K37-M70 PolarHBondContact NZ-O 3.48Å; Y40-M70 HydrophobicContact CD1-CE 3.4Å; Y40-M70 HydrophobicContact CD1-SD 4.12Å; Y40-M70 HydrophobicContact CE1-CE 3.5Å; Y40-M70 VanDerWaalsContact CE1-CE 3.5Å; Y40-M70 HydrophobicContact CG-CE 4.42Å; V41-M70 HydrophobicContact CG2-SD 3.91Å; L66-M70 VanDerWaalsContact O-CB 3.24Å; L66-M70 WeakPolarHBondContact O-CB 3.48Å; L66-M70 VanDerWaalsContact O-CG 3.23Å; L66-M70 WeakPolarHBondContact O-CG 3.45Å; L66-M70 PolarHBondContact O-N 3.33Å; F67-M70 PolarHBondContact O-N 2.65Å; P68-M70 VanDerWaalsContact C-N 3.3Å; P68-M70 PolarHBondContact O-N 3.29Å; M70-I72 HydrophobicContact CB-CD1 4.07Å; M70-I72 HydrophobicContact CB-CG1 4.1Å
71G90.3Very high93.9Very high51 Ų5151.4 Ų51.453%0.52630%0.303SS..THydrogen-bonded Turntrans78.623-179.800000114.5F67 P68F67-G71 PolarHBondContact O-N 3.06Å; F67-G71 VanDerWaalsContact O-N 3.12Å; P68-G71 PolarHBondContact O-N 3Å
72I91.3Very high93.8Very high9 Ų949.2 Ų49.25%0.04629%0.29CS..SBendtrans-83-45.5-178.6-56168.5000110.9K37 C38 F67 M70 V459K37-I72 HydrophobicContact CB-CD1 3.96Å; K37-I72 HydrophobicContact CB-CG1 4.2Å; C38-I72 HydrophobicContact CB-CD1 4.1Å; F67-I72 HydrophobicContact CB-CB 4.27Å; F67-I72 HydrophobicContact CD1-CD1 3.77Å; F67-I72 HydrophobicContact CE1-CD1 4.17Å; F67-I72 HydrophobicContact CG-CB 4.47Å; F67-I72 HydrophobicContact CG-CD1 4.48Å; F67-I72 PolarHBondContact O-N 3.08Å; M70-I72 HydrophobicContact CB-CD1 4.07Å; M70-I72 HydrophobicContact CB-CG1 4.1Å; I72-V459 WeakPolarHBondContact O-CG1 3.18Å
73M93.9Very high93.6Very high21 Ų2153.3 Ų53.310%0.10331%0.312CS..SBendtrans-144.7149.7-179-70.2177.171.200110.4F67 P68 D77 V78 E81 A455F67-M73 HydrophobicContact CB-CB 4.31Å; F67-M73 HydrophobicContact CD2-SD 3.94Å; F67-M73 HydrophobicContact CE2-SD 4.29Å; P68-M73 VanDerWaalsContact CA-O 3.25Å; P68-M73 WeakPolarHBondContact CA-O 3.23Å; M73-D77 HydrophobicContact CE-CB 4.09Å; M73-V78 HydrophobicContact CB-CG2 3.47Å; M73-V78 VanDerWaalsContact CB-CG2 3.47Å; M73-V78 HydrophobicContact CE-CG2 4.2Å; M73-V78 HydrophobicContact CG-CG2 4.42Å; M73-V78 HydrophobicContact SD-CG2 4.19Å; M73-E81 HydrophobicContact CE-CG 4.48Å; M73-A455 HydrophobicContact CE-CB 3.77Å; M73-A455 HydrophobicContact SD-CB 3.89Å
74K95.5Very high93.2Very high159 Ų15956 Ų5669%0.69132%0.323SS*.  trans-70.7148.1174-59.4173.5-178.3168.50110.2G76 D77 V78K74-G76 VanDerWaalsContact C-N 3.26Å; K74-G76 PolarHBondContact O-N 2.98Å; K74-D77 WeakPolarHBondContact CB-OD2 3.43Å; K74-D77 PolarHBondContact O-N 3.49Å; K74-V78 WeakPolarHBondContact O-CG2 3.27Å; K74-V78 PolarHBondContact O-N 3.35Å
75A94.7Very high92.8Very high55 Ų5556.1 Ų56.146%0.45532%0.322SS..Hα-helixtrans-56.3-36.9-177.600000114P68 S79P68-A75 HydrophobicContact CB-CB 4.3Å; P68-A75 HydrophobicContact CG-CB 3.92Å; A75-S79 WeakPolarHBondContact O-CB 3.38Å; A75-S79 PolarHBondContact O-N 3.47Å; A75-S79 PolarHBondContact O-OG 3.36Å
76G93.8Very high92.4Very high45 Ų4552.3 Ų52.346%0.46430%0.299SS..Hα-helixtrans-63.9-45175.400000112.6K74 V78 S79 I80K74-G76 VanDerWaalsContact C-N 3.26Å; K74-G76 PolarHBondContact O-N 2.98Å; G76-V78 PolarHBondContact O-N 3.17Å; G76-S79 PolarHBondContact O-N 3.03Å; G76-I80 WeakPolarHBondContact O-CG1 3.31Å; G76-I80 PolarHBondContact O-N 2.78Å; G76-I80 VanDerWaalsContact O-N 3.14Å
77D93Very high92.1Very high78 Ų7850.9 Ų50.942%0.41729%0.291SS..Hα-helixtrans-65.3-41.2-179.5-56.1-26.8000110.8M73 K74 S79 I80M73-D77 HydrophobicContact CE-CB 4.09Å; K74-D77 WeakPolarHBondContact CB-OD2 3.43Å; K74-D77 PolarHBondContact O-N 3.49Å; D77-S79 VanDerWaalsContact C-N 3.32Å; D77-S79 PolarHBondContact O-N 2.7Å; D77-I80 PolarHBondContact O-N 3.06Å
78V94.1Very high92Very high0 Ų053.7 Ų53.70%031%0.306CS..Hα-helixtrans-63.2-39.4174.9-177.10000111.3P63 V64 F67 P68 M73 K74 G76 I80 E81 Y82 A452P63-V78 HydrophobicContact CB-CG1 4.37Å; V64-V78 HydrophobicContact CG2-CG1 4.29Å; F67-V78 HydrophobicContact CB-CG2 3.99Å; F67-V78 HydrophobicContact CD2-CG2 4.15Å; P68-V78 HydrophobicContact CG-CG2 4.4Å; M73-V78 HydrophobicContact CB-CG2 3.47Å; M73-V78 VanDerWaalsContact CB-CG2 3.47Å; M73-V78 HydrophobicContact CE-CG2 4.2Å; M73-V78 HydrophobicContact CG-CG2 4.42Å; M73-V78 HydrophobicContact SD-CG2 4.19Å; K74-V78 WeakPolarHBondContact O-CG2 3.27Å; K74-V78 PolarHBondContact O-N 3.35Å; G76-V78 PolarHBondContact O-N 3.17Å; V78-I80 PolarHBondContact O-N 2.94Å; V78-E81 WeakPolarHBondContact O-CB 3.46Å; V78-E81 PolarHBondContact O-N 3.08Å; V78-Y82 HydrophobicContact CG1-CE2 4.27Å; V78-Y82 WeakPolarHBondContact O-CD2 3.45Å; V78-A452 HydrophobicContact CG1-CB 4.23Å
79S93.8Very high91.8Very high60 Ų6051.7 Ų51.742%0.4229%0.292SS..Hα-helixtrans-67.2-35-178.4-59.10000112.6A75 G76 D77 E81 Y82A75-S79 WeakPolarHBondContact O-CB 3.38Å; A75-S79 PolarHBondContact O-N 3.47Å; A75-S79 PolarHBondContact O-OG 3.36Å; G76-S79 PolarHBondContact O-N 3.03Å; D77-S79 VanDerWaalsContact C-N 3.32Å; D77-S79 PolarHBondContact O-N 2.7Å; S79-E81 PolarHBondContact O-N 3.09Å; S79-Y82 PolarHBondContact O-N 3.07Å; S79-Y82 VanDerWaalsContact O-N 3.11Å
80I92.7Very high91.6Very high101 Ų10144.9 Ų44.952%0.51826%0.258SS..Hα-helixtrans-62.5-29.8176.6-70.5168.3000111.4G76 D77 V78 Y82 L83G76-I80 WeakPolarHBondContact O-CG1 3.31Å; G76-I80 PolarHBondContact O-N 2.78Å; G76-I80 VanDerWaalsContact O-N 3.14Å; D77-I80 PolarHBondContact O-N 3.06Å; V78-I80 PolarHBondContact O-N 2.94Å; I80-Y82 PolarHBondContact O-N 3.31Å; I80-L83 PolarHBondContact O-N 3.34Å
81E91.3Very high91.6Very high7 Ų744.7 Ų44.73%0.03326%0.258CS..G310 helixtrans-64.4-18.5176.9-58.8-56.613300113.1M73 V78 S79 K84 K261 F451 A452 A455M73-E81 HydrophobicContact CE-CG 4.48Å; V78-E81 WeakPolarHBondContact O-CB 3.46Å; V78-E81 PolarHBondContact O-N 3.08Å; S79-E81 PolarHBondContact O-N 3.09Å; E81-K84 WeakPolarHBondContact OE1-CE 3.28Å; E81-K84 IonicContact OE1-NZ 2.95Å; E81-K84 PolarHBondContact OE1-NZ 3.41Å; E81-K84 WeakPolarHBondContact OE2-CE 3.48Å; E81-K84 IonicContact OE2-NZ 3.59Å; E81-K261 VanDerWaalsContact CD-NZ 3.33Å; E81-K261 WeakPolarHBondContact OE1-CE 3.46Å; E81-K261 IonicContact OE1-NZ 3.5Å; E81-K261 PolarHBondContact OE1-NZ 3.05Å; E81-K261 VanDerWaalsContact OE2-CD 3.31Å; E81-K261 WeakPolarHBondContact OE2-CD 3.15Å; E81-K261 WeakPolarHBondContact OE2-CE 3.27Å; E81-K261 IonicContact OE2-NZ 2.87Å; E81-K261 PolarHBondContact OE2-NZ 3.22Å; E81-F451 HydrophobicContact CB-CB 4.17Å; E81-F451 WeakPolarHBondContact O-CD2 3.32Å; E81-A452 HydrophobicContact CB-CB 4.16Å; E81-A455 HydrophobicContact CG-CB 4.12Å
82Y92.6Very high91.7Very high21 Ų2142.2 Ų42.28%0.08223%0.232CC..G310 helixtrans-86.1-10177.2-70.8-102.9000114.6A60 L61 V64 V78 S79 I80 N87 L445 G449 A452A60-Y82 PolarHBondContact O-OH 3.35Å; L61-Y82 HydrophobicContact CD2-CE1 3.94Å; V64-Y82 HydrophobicContact CG2-CD2 4.31Å; V64-Y82 HydrophobicContact CG2-CE1 4.42Å; V64-Y82 HydrophobicContact CG2-CE2 3.45Å; V64-Y82 VanDerWaalsContact CG2-CE2 3.45Å; V64-Y82 WeakPolarHBondContact CG2-OH 3.26Å; V78-Y82 HydrophobicContact CG1-CE2 4.27Å; V78-Y82 WeakPolarHBondContact O-CD2 3.45Å; S79-Y82 PolarHBondContact O-N 3.07Å; S79-Y82 VanDerWaalsContact O-N 3.11Å; I80-Y82 PolarHBondContact O-N 3.31Å; Y82-N87 PolarHBondContact O-ND2 2.7Å; Y82-L445 HydrophobicContact CD1-CD2 4.35Å; Y82-L445 WeakPolarHBondContact CE1-O 3.25Å; Y82-G449 VanDerWaalsContact CE1-N 3.34Å; Y82-G449 WeakPolarHBondContact OH-CA 3.37Å; Y82-A452 HydrophobicContact CE2-CB 4.17Å
83L90.8Very high91.6Very high121 Ų12142.2 Ų42.263%0.63424%0.235SC*.G310 helixtrans-127.840-175.8-66.2176.2000112.2I80 M88I80-L83 PolarHBondContact O-N 3.34Å; L83-M88 HydrophobicContact CB-CE 4.41Å; L83-M88 HydrophobicContact CD2-CE 4.19Å
84K87.6Confident91.5Very high57 Ų5742.4 Ų42.425%0.24824%0.236CC..  trans-71163.5175.4-65.9-69.3-179.71770112.7E81 S86 N87 M88 F451E81-K84 WeakPolarHBondContact OE1-CE 3.28Å; E81-K84 IonicContact OE1-NZ 2.95Å; E81-K84 PolarHBondContact OE1-NZ 3.41Å; E81-K84 WeakPolarHBondContact OE2-CE 3.48Å; E81-K84 IonicContact OE2-NZ 3.59Å; K84-S86 VanDerWaalsContact C-N 3.28Å; K84-S86 PolarHBondContact O-N 3.33Å; K84-N87 WeakPolarHBondContact O-CB 3.46Å; K84-N87 PolarHBondContact O-N 3.04Å; K84-M88 PolarHBondContact O-N 2.94Å; K84-F451 HydrophobicContact CB-CD2 4.29Å; K84-F451 HydrophobicContact CB-CE2 4.38Å; K84-F451 HydrophobicContact CG-CD2 4.14Å
85D87.2Confident91.4Very high50 Ų5035.7 Ų35.727%0.26721%0.207SC..Hα-helixtrans-57.1-39.7178.2-173.471.5000112.7N87 M88 L89 S375D85-N87 PolarHBondContact O-N 3.36Å; D85-M88 CarbonylContact O-C 3.55Å; D85-M88 WeakPolarHBondContact O-CA 3.17Å; D85-M88 VanDerWaalsContact O-CB 3.3Å; D85-M88 WeakPolarHBondContact O-CB 3.16Å; D85-M88 PolarHBondContact O-N 3.33Å; D85-L89 PolarHBondContact O-N 3.18Å; D85-S375 VanDerWaalsContact CG-CB 3.49Å; D85-S375 WeakPolarHBondContact OD1-CB 3.12Å; D85-S375 PolarHBondContact OD1-OG 3.4Å; D85-S375 WeakPolarHBondContact OD2-CB 3.47Å; D85-S375 PolarHBondContact OD2-OG 3Å; D85-S375 VanDerWaalsContact OD2-OG 3.07Å
86S86.4Confident91.3Very high1 Ų133.3 Ų33.31%0.00719%0.187CC..Hα-helixtrans-62.4-28.5177.2-10.20000112.4K84 F90 G257 E260K84-S86 VanDerWaalsContact C-N 3.28Å; K84-S86 PolarHBondContact O-N 3.33Å; S86-F90 PolarHBondContact O-N 3.31Å; S86-G257 WeakPolarHBondContact OG-CA 3.24Å; S86-E260 PolarHBondContact OG-OE2 2.89Å
87N89.9Confident91.2Very high0 Ų031.8 Ų31.80%017%0.17CC..Hα-helixtrans-71.4-36.9169.8-78.45.7000111.9Y82 K84 D85 F90 M91 I444 L447 F451Y82-N87 PolarHBondContact O-ND2 2.7Å; K84-N87 WeakPolarHBondContact O-CB 3.46Å; K84-N87 PolarHBondContact O-N 3.04Å; D85-N87 PolarHBondContact O-N 3.36Å; N87-F90 PolarHBondContact O-N 2.82Å; N87-M91 WeakPolarHBondContact O-CG 3.4Å; N87-M91 PolarHBondContact O-N 3.27Å; N87-I444 PolarHBondContact ND2-O 3.36Å; N87-L447 WeakPolarHBondContact OD1-CB 3.34Å; N87-L447 WeakPolarHBondContact OD1-CD1 3.39Å; N87-F451 WeakPolarHBondContact OD1-CE2 3.35Å
88M92.3Very high91.1Very high60 Ų6028.4 Ų28.430%0.29615%0.152SC..Hα-helixtrans-65.4-41.8174.4-61.2-66157.700111.4L83 K84 D85 F90 M91 G92 I381L83-M88 HydrophobicContact CB-CE 4.41Å; L83-M88 HydrophobicContact CD2-CE 4.19Å; K84-M88 PolarHBondContact O-N 2.94Å; D85-M88 CarbonylContact O-C 3.55Å; D85-M88 WeakPolarHBondContact O-CA 3.17Å; D85-M88 VanDerWaalsContact O-CB 3.3Å; D85-M88 WeakPolarHBondContact O-CB 3.16Å; D85-M88 PolarHBondContact O-N 3.33Å; M88-F90 PolarHBondContact O-N 2.82Å; M88-M91 HydrophobicContact CE-CE 3.7Å; M88-M91 HydrophobicContact CG-CE 4.31Å; M88-M91 PolarHBondContact O-N 2.65Å; M88-M91 HydrophobicContact SD-CE 3.24Å; M88-M91 WeakPolarHBondContact SD-CE 3.14Å; M88-G92 PolarHBondContact O-N 3.39Å; M88-I381 HydrophobicContact CB-CG1 4.1Å; M88-I381 WeakPolarHBondContact O-CD1 3.24Å
89L91.3Very high91.1Very high0 Ų028.4 Ų28.40%015%0.152CC..Hα-helixtrans-57.7-47.5171.7176.158.9000111.6D85 G92 G93 L246 T247 L253 W351 D376 A380D85-L89 PolarHBondContact O-N 3.18Å; L89-G92 PolarHBondContact O-N 3.34Å; L89-G93 PolarHBondContact O-N 3.03Å; L89-L246 HydrophobicContact CD2-CD2 3.93Å; L89-L246 HydrophobicContact CD2-CG 4.3Å; L89-T247 HydrophobicContact CD1-CG2 4.31Å; L89-T247 HydrophobicContact CG-CG2 4.44Å; L89-L253 HydrophobicContact CD2-CD2 3.74Å; L89-L253 HydrophobicContact CG-CD2 3.98Å; L89-W351 HydrophobicContact CD1-CH2 4.45Å; L89-W351 HydrophobicContact CD1-CZ2 3.48Å; L89-W351 VanDerWaalsContact CD1-CZ2 3.48Å; L89-D376 HydrophobicContact CD1-CB 3.86Å; L89-D376 HydrophobicContact CD2-CB 3.95Å; L89-D376 HydrophobicContact CG-CB 4.45Å; L89-A380 HydrophobicContact CD1-CB 3.83Å
90F88.8Confident91Very high9 Ų926.2 Ų26.24%0.03914%0.136CC..Hα-helixtrans-62-46178.6-175.4-131.8000112.4S86 N87 M88 G92 G93 L94 L253 I443 I444 L447S86-F90 PolarHBondContact O-N 3.31Å; N87-F90 PolarHBondContact O-N 2.82Å; M88-F90 PolarHBondContact O-N 2.82Å; F90-G92 PolarHBondContact O-N 3.23Å; F90-G93 PolarHBondContact O-N 2.83Å; F90-L94 HydrophobicContact CD1-CD1 3.84Å; F90-L94 HydrophobicContact CD2-CD1 4.07Å; F90-L94 HydrophobicContact CD2-CG 4.05Å; F90-L94 HydrophobicContact CE1-CD1 3.43Å; F90-L94 VanDerWaalsContact CE1-CD1 3.43Å; F90-L94 HydrophobicContact CE1-CG 4.37Å; F90-L94 HydrophobicContact CE2-CD1 3.75Å; F90-L94 HydrophobicContact CE2-CD2 4.05Å; F90-L94 HydrophobicContact CE2-CG 3.78Å; F90-L94 HydrophobicContact CG-CD1 4.17Å; F90-L94 HydrophobicContact CZ-CD1 3.41Å; F90-L94 VanDerWaalsContact CZ-CD1 3.41Å; F90-L94 HydrophobicContact CZ-CD2 4.19Å; F90-L94 HydrophobicContact CZ-CG 3.96Å; F90-L94 WeakPolarHBondContact O-CB 3.42Å; F90-L94 WeakPolarHBondContact O-CG 3.28Å; F90-L94 PolarHBondContact O-N 3.28Å; F90-L253 HydrophobicContact CB-CD1 3.76Å; F90-L253 HydrophobicContact CD2-CD1 3.09Å; F90-L253 HydrophobicContact CE2-CD1 3.81Å; F90-L253 HydrophobicContact CG-CD1 3.67Å; F90-I443 HydrophobicContact CD1-CG2 4.46Å; F90-I443 HydrophobicContact CE1-CB 3.78Å; F90-I443 HydrophobicContact CE1-CG2 3.4Å; F90-I443 HydrophobicContact CZ-CB 4.04Å; F90-I443 HydrophobicContact CZ-CD1 4.37Å; F90-I443 HydrophobicContact CZ-CG2 3.5Å; F90-I444 HydrophobicContact CD1-CG1 3.92Å; F90-I444 HydrophobicContact CE1-CG1 4.05Å; F90-L447 HydrophobicContact CB-CD1 4.24Å; F90-L447 HydrophobicContact CD1-CD1 3.52Å; F90-L447 HydrophobicContact CE1-CD1 4.06Å; F90-L447 HydrophobicContact CG-CD1 4.01Å
91M92.1Very high90.8Very high33 Ų3324.3 Ų24.316%0.16313%0.125CC..Hα-helixtrans-59.4-45176.8-75.9-172.2-67.200111.8N87 M88 L94 L95 I381 I444N87-M91 WeakPolarHBondContact O-CG 3.4Å; N87-M91 PolarHBondContact O-N 3.27Å; M88-M91 HydrophobicContact CE-CE 3.7Å; M88-M91 HydrophobicContact CG-CE 4.31Å; M88-M91 PolarHBondContact O-N 2.65Å; M88-M91 HydrophobicContact SD-CE 3.24Å; M88-M91 WeakPolarHBondContact SD-CE 3.14Å; M91-L94 PolarHBondContact O-N 2.79Å; M91-L95 VanDerWaalsContact O-CG 3.27Å; M91-L95 WeakPolarHBondContact O-CG 3.43Å; M91-L95 PolarHBondContact O-N 2.66Å; M91-I381 HydrophobicContact CB-CD1 4.3Å; M91-I444 HydrophobicContact CG-CD1 3.61Å; M91-I444 HydrophobicContact CG-CG1 4.22Å; M91-I444 HydrophobicContact SD-CD1 4.09Å
92G92Very high90.7Very high0 Ų027.1 Ų27.10%014%0.138CC..Hα-helixtrans-63.2-44.417600000112.8M88 L89 F90 L94 L95 V96 S384M88-G92 PolarHBondContact O-N 3.39Å; L89-G92 PolarHBondContact O-N 3.34Å; F90-G92 PolarHBondContact O-N 3.23Å; G92-L94 PolarHBondContact O-N 3.1Å; G92-L95 PolarHBondContact O-N 3.27Å; G92-V96 VanDerWaalsContact O-CG2 3.25Å; G92-V96 WeakPolarHBondContact O-CG2 3.48Å; G92-V96 PolarHBondContact O-N 3.03Å; G92-V96 VanDerWaalsContact O-N 3.11Å; G92-S384 WeakPolarHBondContact CA-OG 3.16Å; G92-S384 PolarHBondContact O-OG 3.47Å
93G90.3Very high90.6Very high9 Ų928.2 Ų28.29%0.09314%0.142CC..Hα-helixtrans-58.8-44.3175.100000112.8L89 F90 V96 A97L89-G93 PolarHBondContact O-N 3.03Å; F90-G93 PolarHBondContact O-N 2.83Å; G93-V96 PolarHBondContact O-N 3.31Å; G93-A97 PolarHBondContact O-N 3.36Å
94L90.9Very high90.6Very high25 Ų2526.4 Ų26.413%0.13113%0.133CC..Hα-helixtrans-66.2-39.1176.7-74.5172.4000112.8F90 M91 G92 V96 A97 I98 M439 P440F90-L94 HydrophobicContact CD1-CD1 3.84Å; F90-L94 HydrophobicContact CD2-CD1 4.07Å; F90-L94 HydrophobicContact CD2-CG 4.05Å; F90-L94 HydrophobicContact CE1-CD1 3.43Å; F90-L94 VanDerWaalsContact CE1-CD1 3.43Å; F90-L94 HydrophobicContact CE1-CG 4.37Å; F90-L94 HydrophobicContact CE2-CD1 3.75Å; F90-L94 HydrophobicContact CE2-CD2 4.05Å; F90-L94 HydrophobicContact CE2-CG 3.78Å; F90-L94 HydrophobicContact CG-CD1 4.17Å; F90-L94 HydrophobicContact CZ-CD1 3.41Å; F90-L94 VanDerWaalsContact CZ-CD1 3.41Å; F90-L94 HydrophobicContact CZ-CD2 4.19Å; F90-L94 HydrophobicContact CZ-CG 3.96Å; F90-L94 WeakPolarHBondContact O-CB 3.42Å; F90-L94 WeakPolarHBondContact O-CG 3.28Å; F90-L94 PolarHBondContact O-N 3.28Å; M91-L94 PolarHBondContact O-N 2.79Å; G92-L94 PolarHBondContact O-N 3.1Å; L94-V96 VanDerWaalsContact C-N 3.29Å; L94-V96 PolarHBondContact O-N 2.97Å; L94-A97 PolarHBondContact O-N 3.1Å; L94-I98 WeakPolarHBondContact O-CB 3.33Å; L94-I98 WeakPolarHBondContact O-CD1 3.24Å; L94-I98 WeakPolarHBondContact O-CG1 3.45Å; L94-I98 PolarHBondContact O-N 3.47Å; L94-M439 HydrophobicContact CB-CE 4.34Å; L94-P440 HydrophobicContact CD1-CG 3.71Å; L94-P440 HydrophobicContact CD2-CG 4.07Å
95L94.1Very high90.6Very high17 Ų1723.9 Ų23.99%0.08912%0.122CC..Hα-helixtrans-59.8-42.5175.4-76.1169.2000111.3M91 G92 I98 A99 F388 V435 M439M91-L95 VanDerWaalsContact O-CG 3.27Å; M91-L95 WeakPolarHBondContact O-CG 3.43Å; M91-L95 PolarHBondContact O-N 2.66Å; G92-L95 PolarHBondContact O-N 3.27Å; L95-I98 PolarHBondContact O-N 3.31Å; L95-A99 PolarHBondContact O-N 2.98Å; L95-F388 HydrophobicContact CD2-CE2 4.33Å; L95-F388 HydrophobicContact CD2-CZ 4.26Å; L95-V435 HydrophobicContact CD2-CB 4.2Å; L95-V435 HydrophobicContact CD2-CG1 3.56Å; L95-V435 HydrophobicContact CD2-CG2 3.48Å; L95-V435 VanDerWaalsContact CD2-CG2 3.48Å; L95-M439 HydrophobicContact CD2-CE 3.77Å; L95-M439 HydrophobicContact CG-CE 3.78Å
96V92.9Very high90.7Very high6 Ų622.3 Ų22.34%0.03611%0.113CC..Hα-helixtrans-64.7-45.3175.7177.30000110.9G92 G93 L94 I98 A99 V100 F344 L347 F387G92-V96 VanDerWaalsContact O-CG2 3.25Å; G92-V96 WeakPolarHBondContact O-CG2 3.48Å; G92-V96 PolarHBondContact O-N 3.03Å; G92-V96 VanDerWaalsContact O-N 3.11Å; G93-V96 PolarHBondContact O-N 3.31Å; L94-V96 VanDerWaalsContact C-N 3.29Å; L94-V96 PolarHBondContact O-N 2.97Å; V96-I98 VanDerWaalsContact C-N 3.35Å; V96-I98 PolarHBondContact O-N 2.77Å; V96-A99 WeakPolarHBondContact O-CB 3.28Å; V96-A99 PolarHBondContact O-N 3.38Å; V96-V100 WeakPolarHBondContact O-CG2 3.47Å; V96-V100 PolarHBondContact O-N 3.11Å; V96-F344 HydrophobicContact CG1-CD2 3.76Å; V96-L347 HydrophobicContact CB-CD2 4.23Å; V96-L347 HydrophobicContact CG1-CD2 4.02Å; V96-L347 HydrophobicContact CG2-CD2 3.52Å; V96-F387 HydrophobicContact CB-CE2 4.18Å; V96-F387 HydrophobicContact CG1-CZ 4.41Å; V96-F387 HydrophobicContact CG2-CE2 3.74Å; V96-F387 HydrophobicContact CG2-CZ 4.3Å
97A90.8Very high90.6Very high12 Ų1225 Ų2510%0.09913%0.125CC..Hα-helixtrans-58.8-45.517600000111.8G93 L94 A99 V100 E101 W138G93-A97 PolarHBondContact O-N 3.36Å; L94-A97 PolarHBondContact O-N 3.1Å; A97-A99 VanDerWaalsContact C-N 3.33Å; A97-A99 PolarHBondContact O-N 2.9Å; A97-V100 PolarHBondContact O-N 3.21Å; A97-E101 WeakPolarHBondContact O-CB 3.39Å; A97-E101 PolarHBondContact O-N 2.83Å; A97-W138 WeakPolarHBondContact CB-O 3.04Å
98I91.9Very high90.6Very high7 Ų725.8 Ų25.84%0.03613%0.128CC..Hα-helixtrans-61.8-39.7176.7-69.1164.8000110.8L94 L95 V96 E101 H102 L430 V434 R438 M439L94-I98 WeakPolarHBondContact O-CB 3.33Å; L94-I98 WeakPolarHBondContact O-CD1 3.24Å; L94-I98 WeakPolarHBondContact O-CG1 3.45Å; L94-I98 PolarHBondContact O-N 3.47Å; L95-I98 PolarHBondContact O-N 3.31Å; V96-I98 VanDerWaalsContact C-N 3.35Å; V96-I98 PolarHBondContact O-N 2.77Å; I98-E101 PolarHBondContact O-N 3.2Å; I98-H102 WeakPolarHBondContact O-CB 3.33Å; I98-H102 PolarHBondContact O-N 3.48Å; I98-L430 HydrophobicContact CG2-CD2 4.04Å; I98-V434 HydrophobicContact CG2-CG1 3.94Å; I98-R438 HydrophobicContact CD1-CB 3.98Å; I98-R438 HydrophobicContact CG1-CB 3.99Å; I98-R438 HydrophobicContact CG2-CB 4.26Å; I98-M439 HydrophobicContact CD1-CB 4.28Å; I98-M439 HydrophobicContact CD1-CE 4.43Å
99A92.6Very high90.3Very high0 Ų025.4 Ų25.40%013%0.126CC..Hα-helixtrans-62.8-47.4175.300000111.9L95 V96 A97 E101 H102 W103 V340 F387 L430L95-A99 PolarHBondContact O-N 2.98Å; V96-A99 WeakPolarHBondContact O-CB 3.28Å; V96-A99 PolarHBondContact O-N 3.38Å; A97-A99 VanDerWaalsContact C-N 3.33Å; A97-A99 PolarHBondContact O-N 2.9Å; A99-E101 VanDerWaalsContact C-N 3.26Å; A99-E101 PolarHBondContact O-N 3.32Å; A99-H102 PolarHBondContact O-N 2.68Å; A99-W103 VanDerWaalsContact O-CD1 3.29Å; A99-W103 PolarHBondContact O-N 3.42Å; A99-V340 HydrophobicContact CB-CG1 4.26Å; A99-V340 HydrophobicContact CB-CG2 4.46Å; A99-F387 HydrophobicContact CB-CD1 3.89Å; A99-F387 HydrophobicContact CB-CD2 4.06Å; A99-F387 HydrophobicContact CB-CE1 3.68Å; A99-F387 HydrophobicContact CB-CE2 3.88Å; A99-F387 HydrophobicContact CB-CG 4.08Å; A99-F387 HydrophobicContact CB-CZ 3.68Å; A99-L430 HydrophobicContact CB-CD1 3.77Å; A99-L430 HydrophobicContact CB-CD2 4.39Å; A99-L430 HydrophobicContact CB-CG 4.02Å
100V91.8Very high89.9Confident14 Ų1425.4 Ų25.49%0.08513%0.126CC..Hα-helixtrans-61.5-36.9177.6170.80000111.3V96 A97 N104 L105 H106 I139 V340V96-V100 WeakPolarHBondContact O-CG2 3.47Å; V96-V100 PolarHBondContact O-N 3.11Å; A97-V100 PolarHBondContact O-N 3.21Å; V100-N104 PolarHBondContact O-N 3.11Å; V100-L105 HydrophobicContact CG1-CB 4.29Å; V100-L105 HydrophobicContact CG2-CD2 4.48Å; V100-L105 PolarHBondContact O-N 3.43Å; V100-H106 HydrophobicContact CG1-CB 3.86Å; V100-H106 PolarHBondContact O-ND1 3.4Å; V100-I139 HydrophobicContact CG1-CD1 4.05Å; V100-V340 HydrophobicContact CB-CG1 4.5Å; V100-V340 HydrophobicContact CG2-CG1 3.76Å
101E89.3Confident89.7Confident61 Ų6125.1 Ų25.129%0.28513%0.125SC..Hα-helixtrans-70.7-51.2177-157.1-162.6152.200112A97 I98 A99 W103 N104 H106 R438A97-E101 WeakPolarHBondContact O-CB 3.39Å; A97-E101 PolarHBondContact O-N 2.83Å; I98-E101 PolarHBondContact O-N 3.2Å; A99-E101 VanDerWaalsContact C-N 3.26Å; A99-E101 PolarHBondContact O-N 3.32Å; E101-W103 PolarHBondContact O-N 3.3Å; E101-W103 VanDerWaalsContact O-N 3.16Å; E101-N104 PolarHBondContact O-N 3.28Å; E101-H106 VanDerWaalsContact CA-CE1 3.47Å; E101-H106 WeakPolarHBondContact CA-CE1 3.37Å; E101-H106 WeakPolarHBondContact CA-ND1 3.42Å; E101-H106 PolarHBondContact O-CE1 3.02Å; E101-R438 IonicContact OE1-CZ 2.75Å; E101-R438 IonicContact OE1-NH1 3.87Å; E101-R438 PolarHBondContact OE1-NH1 2.85Å; E101-R438 IonicContact OE2-NH1 2.98Å; E101-R438 PolarHBondContact OE2-NH1 2.92Å
102H89.9Confident89.4Confident66 Ų6631.3 Ų31.331%0.30615%0.147SC..Hα-helixtrans-56-35.9-178176.9-99.3000112.7I98 A99 L430I98-H102 WeakPolarHBondContact O-CB 3.33Å; I98-H102 PolarHBondContact O-N 3.48Å; A99-H102 PolarHBondContact O-N 2.68Å; H102-L430 HydrophobicContact CB-CD2 4.34Å
103W90.9Very high88.8Confident44 Ų4433.5 Ų33.517%0.16716%0.16CC..THydrogen-bonded Turntrans-92.24.7178.8-69.1100.6000114.5A99 E101 L105 A336 E337 V340 S392 L429A99-W103 VanDerWaalsContact O-CD1 3.29Å; A99-W103 PolarHBondContact O-N 3.42Å; E101-W103 PolarHBondContact O-N 3.3Å; E101-W103 VanDerWaalsContact O-N 3.16Å; W103-L105 PolarHBondContact O-N 2.88Å; W103-L105 VanDerWaalsContact O-N 3.11Å; W103-A336 HydrophobicContact CD2-CB 3.45Å; W103-A336 VanDerWaalsContact CD2-CB 3.45Å; W103-A336 HydrophobicContact CE3-CB 3.3Å; W103-A336 HydrophobicContact CG-CB 4.29Å; W103-A336 HydrophobicContact CH2-CB 3.51Å; W103-A336 HydrophobicContact CZ2-CB 3.63Å; W103-A336 HydrophobicContact CZ3-CB 3.33Å; W103-E337 HydrophobicContact CB-CG 4.37Å; W103-V340 HydrophobicContact CG-CG2 4.21Å; W103-S392 VanDerWaalsContact CZ2-CB 3.47Å; W103-L429 HydrophobicContact CZ2-CD2 4.23Å; W103-L429 PolarHBondContact NE1-O 3.29Å
104N88.9Confident88.3Confident83 Ų8333.3 Ų33.344%0.44416%0.157SC..THydrogen-bonded Turntrans55.522.8-178.6-63.4-74.1000114.5V100 E101 H106 K107 R108V100-N104 PolarHBondContact O-N 3.11Å; E101-N104 PolarHBondContact O-N 3.28Å; N104-H106 VanDerWaalsContact C-N 3.3Å; N104-H106 PolarHBondContact O-N 2.94Å; N104-K107 PolarHBondContact O-N 3.41Å; N104-R108 PolarHBondContact O-N 3.49Å
105L89.1Confident87.8Confident4 Ų433.3 Ų33.32%0.02116%0.157CC..Hα-helixtrans-62.6-41.4-179.5175.964000110.8V100 W103 K107 R108 I109 M333 E337 V340 L341V100-L105 HydrophobicContact CG1-CB 4.29Å; V100-L105 HydrophobicContact CG2-CD2 4.48Å; V100-L105 PolarHBondContact O-N 3.43Å; W103-L105 PolarHBondContact O-N 2.88Å; W103-L105 VanDerWaalsContact O-N 3.11Å; L105-K107 PolarHBondContact O-N 3.38Å; L105-R108 WeakPolarHBondContact O-CB 3.31Å; L105-R108 PolarHBondContact O-N 3.35Å; L105-R108 VanDerWaalsContact O-N 3.17Å; L105-I109 HydrophobicContact CD1-CD1 4.28Å; L105-I109 HydrophobicContact CD1-CG1 4.48Å; L105-I109 HydrophobicContact CG-CD1 3.97Å; L105-I109 WeakPolarHBondContact O-CG1 3.23Å; L105-I109 PolarHBondContact O-N 3.36Å; L105-M333 HydrophobicContact CD1-CE 4.14Å; L105-E337 HydrophobicContact CD1-CB 4.36Å; L105-V340 HydrophobicContact CD2-CB 4.43Å; L105-V340 HydrophobicContact CD2-CG1 4Å; L105-L341 HydrophobicContact CD1-CB 4.45Å; L105-L341 HydrophobicContact CD2-CB 3.86Å; L105-L341 HydrophobicContact CD2-CD1 4.25Å
106H88Confident87.2Confident17 Ų1739.3 Ų39.38%0.07919%0.188CC..Hα-helixtrans-55-45174.861-65.1000113.1V100 E101 N104 R108 I109 A110 L135 I139 M147V100-H106 HydrophobicContact CG1-CB 3.86Å; V100-H106 PolarHBondContact O-ND1 3.4Å; E101-H106 VanDerWaalsContact CA-CE1 3.47Å; E101-H106 WeakPolarHBondContact CA-CE1 3.37Å; E101-H106 WeakPolarHBondContact CA-ND1 3.42Å; E101-H106 PolarHBondContact O-CE1 3.02Å; N104-H106 VanDerWaalsContact C-N 3.3Å; N104-H106 PolarHBondContact O-N 2.94Å; H106-R108 VanDerWaalsContact C-N 3.33Å; H106-R108 PolarHBondContact O-N 3.05Å; H106-I109 PolarHBondContact O-N 3.21Å; H106-A110 WeakPolarHBondContact O-CB 3.04Å; H106-A110 PolarHBondContact O-N 2.92Å; H106-L135 HydrophobicContact CB-CD2 3.97Å; H106-I139 HydrophobicContact CB-CD1 3.49Å; H106-I139 VanDerWaalsContact CB-CD1 3.49Å; H106-M147 PolarHBondContact CD2-SD 3.45Å; H106-M147 PolarHBondContact NE2-SD 2.96Å
107K84.9Confident86.4Confident58 Ų5841 Ų4125%0.25220%0.198SC..Hα-helixtrans-62.2-38.8176.9-172.8172.3175.7178.40112N104 L105 L111 M147 E326 L330N104-K107 PolarHBondContact O-N 3.41Å; L105-K107 PolarHBondContact O-N 3.38Å; K107-L111 HydrophobicContact CG-CD1 4.16Å; K107-L111 WeakPolarHBondContact O-CG 3.43Å; K107-L111 PolarHBondContact O-N 2.93Å; K107-L111 VanDerWaalsContact O-N 3.09Å; K107-M147 HydrophobicContact CB-SD 3.98Å; K107-M147 HydrophobicContact CG-SD 4.4Å; K107-E326 IonicContact NZ-OE2 2.74Å; K107-L330 HydrophobicContact CD-CD2 4.15Å; K107-L330 HydrophobicContact CG-CD1 4.41Å; K107-L330 HydrophobicContact CG-CD2 4.36Å
108R89.3Confident85.3Confident17 Ų1741.5 Ų41.56%0.06421%0.205CC..Hα-helixtrans-64.2-45.8175.7-175.3-177.2-63.3-74.81.4111.7N104 L105 H106 R112 Y327 L330 G331 G332 E337N104-R108 PolarHBondContact O-N 3.49Å; L105-R108 WeakPolarHBondContact O-CB 3.31Å; L105-R108 PolarHBondContact O-N 3.35Å; L105-R108 VanDerWaalsContact O-N 3.17Å; H106-R108 VanDerWaalsContact C-N 3.33Å; H106-R108 PolarHBondContact O-N 3.05Å; R108-R112 VanDerWaalsContact O-CB 3.31Å; R108-R112 WeakPolarHBondContact O-CB 3.45Å; R108-R112 PolarHBondContact O-N 2.85Å; R108-R112 VanDerWaalsContact O-N 3.09Å; R108-Y327 HydrophobicContact CG-CE2 3.86Å; R108-L330 HydrophobicContact CB-CD1 4.14Å; R108-G331 PolarHBondContact NH1-O 2.99Å; R108-G331 PolarHBondContact NH2-O 3.36Å; R108-G331 VanDerWaalsContact NH2-O 3.15Å; R108-G332 PolarHBondContact NH2-O 3.2Å; R108-E337 IonicContact CZ-OE2 2.78Å; R108-E337 IonicContact NE-OE2 2.81Å; R108-E337 PolarHBondContact NE-OE2 3.48Å; R108-E337 IonicContact NH2-OE1 3.18Å; R108-E337 PolarHBondContact NH2-OE1 2.94Å; R108-E337 IonicContact NH2-OE2 3.39Å; R108-E337 PolarHBondContact NH2-OE2 3.3Å
109I86.7Confident84.2Confident51 Ų5141.7 Ų41.726%0.26221%0.206SC..Hα-helixtrans-62.6-47178.4-65.3168.6000109.8L105 H106 L111 R112 V113 F134L105-I109 HydrophobicContact CD1-CD1 4.28Å; L105-I109 HydrophobicContact CD1-CG1 4.48Å; L105-I109 HydrophobicContact CG-CD1 3.97Å; L105-I109 WeakPolarHBondContact O-CG1 3.23Å; L105-I109 PolarHBondContact O-N 3.36Å; H106-I109 PolarHBondContact O-N 3.21Å; I109-L111 PolarHBondContact O-N 2.98Å; I109-R112 PolarHBondContact O-N 3.14Å; I109-V113 WeakPolarHBondContact O-CG2 3.46Å; I109-V113 PolarHBondContact O-N 3.13Å; I109-F134 HydrophobicContact CG2-CE1 4.08Å
110A83.2Confident83.3Confident0 Ų044.2 Ų44.20%022%0.216CC..Hα-helixtrans-55.6-55.2-179.900000112.7H106 R112 V113 L114 V131 L135 M147 M148H106-A110 WeakPolarHBondContact O-CB 3.04Å; H106-A110 PolarHBondContact O-N 2.92Å; A110-R112 VanDerWaalsContact C-N 3.32Å; A110-R112 PolarHBondContact O-N 3.44Å; A110-V113 PolarHBondContact O-N 3.28Å; A110-L114 WeakPolarHBondContact O-CG 3.46Å; A110-L114 PolarHBondContact O-N 3.35Å; A110-V131 HydrophobicContact CB-CG1 3.64Å; A110-L135 HydrophobicContact CB-CD1 4Å; A110-M147 HydrophobicContact CB-CE 4.3Å; A110-M148 HydrophobicContact CB-SD 4.09Å
111L83.9Confident82.4Confident3 Ų345.9 Ų45.92%0.01623%0.227CC..Hα-helixtrans-64.6-36.2-179.2-71.6173.4000112.1K107 I109 V113 L114 L115 I151 E326 Y327 L330K107-L111 HydrophobicContact CG-CD1 4.16Å; K107-L111 WeakPolarHBondContact O-CG 3.43Å; K107-L111 PolarHBondContact O-N 2.93Å; K107-L111 VanDerWaalsContact O-N 3.09Å; I109-L111 PolarHBondContact O-N 2.98Å; L111-V113 VanDerWaalsContact C-N 3.35Å; L111-V113 PolarHBondContact O-N 3.06Å; L111-L114 PolarHBondContact O-N 2.71Å; L111-L115 WeakPolarHBondContact O-CB 3.32Å; L111-L115 VanDerWaalsContact O-CG 3.23Å; L111-L115 WeakPolarHBondContact O-CG 3.43Å; L111-L115 PolarHBondContact O-N 2.91Å; L111-I151 HydrophobicContact CD2-CG2 4.18Å; L111-E326 HydrophobicContact CD1-CB 4.2Å; L111-E326 HydrophobicContact CD2-CB 4.36Å; L111-Y327 HydrophobicContact CB-CD2 3.92Å; L111-L330 HydrophobicContact CD1-CD1 3.82Å
112R85.8Confident81.8Confident164 Ų16443.3 Ų43.362%0.61922%0.216SC*.Hα-helixtrans-64.4-39.8177.1-170.3174.2-176.4174.20.6111.9R108 I109 A110 Y327R108-R112 VanDerWaalsContact O-CB 3.31Å; R108-R112 WeakPolarHBondContact O-CB 3.45Å; R108-R112 PolarHBondContact O-N 2.85Å; R108-R112 VanDerWaalsContact O-N 3.09Å; I109-R112 PolarHBondContact O-N 3.14Å; A110-R112 VanDerWaalsContact C-N 3.32Å; A110-R112 PolarHBondContact O-N 3.44Å; R112-Y327 HydrophobicContact CB-CE2 4.15Å
113V80.7Confident81.3Confident46 Ų4642.1 Ų42.128%0.27921%0.212SC..Hα-helixtrans-70.5-42.5176.81770000111I109 A110 L111 L115 L116 V117 V131I109-V113 WeakPolarHBondContact O-CG2 3.46Å; I109-V113 PolarHBondContact O-N 3.13Å; A110-V113 PolarHBondContact O-N 3.28Å; L111-V113 VanDerWaalsContact C-N 3.35Å; L111-V113 PolarHBondContact O-N 3.06Å; V113-L115 VanDerWaalsContact C-N 3.25Å; V113-L115 PolarHBondContact O-N 3.31Å; V113-L116 WeakPolarHBondContact O-CB 3.15Å; V113-L116 PolarHBondContact O-N 2.82Å; V113-V117 PolarHBondContact O-N 3.27Å; V113-V131 HydrophobicContact CB-CG2 3.57Å; V113-V131 HydrophobicContact CG1-CG2 3.32Å
114L78.2Confident80.9Confident4 Ų440.1 Ų40.12%0.02120%0.204CC..Hα-helixtrans-59.3-36.8175.5-70.6175.3000112.3A110 L111 L116 V117 F128 V131 M148 I151 M323A110-L114 WeakPolarHBondContact O-CG 3.46Å; A110-L114 PolarHBondContact O-N 3.35Å; L111-L114 PolarHBondContact O-N 2.71Å; L114-L116 PolarHBondContact O-N 2.68Å; L114-V117 PolarHBondContact O-N 3.44Å; L114-F128 HydrophobicContact CD1-CD1 4.48Å; L114-F128 HydrophobicContact CD1-CE1 3.92Å; L114-F128 HydrophobicContact CD1-CE2 4.17Å; L114-F128 HydrophobicContact CD1-CZ 3.76Å; L114-F128 HydrophobicContact CD2-CD1 4.47Å; L114-F128 HydrophobicContact CD2-CD2 3.79Å; L114-F128 HydrophobicContact CD2-CE2 3.99Å; L114-F128 HydrophobicContact CD2-CG 4.08Å; L114-F128 HydrophobicContact CD2-CZ 4.36Å; L114-V131 HydrophobicContact CD2-CG2 4.16Å; L114-V131 HydrophobicContact CG-CG2 4.21Å; L114-M148 HydrophobicContact CD1-CE 4.26Å; L114-I151 HydrophobicContact CD1-CG2 4.35Å; L114-M323 HydrophobicContact CB-CE 4.42Å; L114-M323 HydrophobicContact CB-SD 4.27Å; L114-M323 WeakPolarHBondContact O-CE 3.45Å
115L82.1Confident80.9Confident25 Ų2536.2 Ų36.213%0.13118%0.183CC..Hα-helixtrans-65.6-16.8173.7-73.3168.2000114.2L111 V113 Y320 M323 R324 Y327L111-L115 WeakPolarHBondContact O-CB 3.32Å; L111-L115 VanDerWaalsContact O-CG 3.23Å; L111-L115 WeakPolarHBondContact O-CG 3.43Å; L111-L115 PolarHBondContact O-N 2.91Å; V113-L115 VanDerWaalsContact C-N 3.25Å; V113-L115 PolarHBondContact O-N 3.31Å; L115-Y320 HydrophobicContact CB-CE2 4.37Å; L115-Y320 HydrophobicContact CD2-CD2 4.15Å; L115-Y320 HydrophobicContact CD2-CE1 4.35Å; L115-Y320 HydrophobicContact CD2-CE2 3.65Å; L115-Y320 WeakPolarHBondContact O-CE2 3.34Å; L115-M323 HydrophobicContact CD2-CB 3.82Å; L115-M323 HydrophobicContact CD2-CE 3.91Å; L115-M323 HydrophobicContact CG-CB 4.49Å; L115-M323 HydrophobicContact CG-CE 4.38Å; L115-R324 HydrophobicContact CD2-CB 4.11Å; L115-Y327 HydrophobicContact CD1-CD1 4.42Å; L115-Y327 HydrophobicContact CD1-CD2 4.32Å; L115-Y327 HydrophobicContact CD1-CG 3.95Å
116L80.4Confident80.9Confident144 Ų14438 Ų3875%0.75419%0.192SC*.Hα-helixtrans-89.7-34.2176.9-67.6170.8000112.7V113 L114V113-L116 WeakPolarHBondContact O-CB 3.15Å; V113-L116 PolarHBondContact O-N 2.82Å; L114-L116 PolarHBondContact O-N 2.68Å
117V75.9Confident80.9Confident41 Ų4137.2 Ų37.225%0.24819%0.189CC..Hα-helixtrans-76.1-28.7-172.6179.80000112.8V113 L114 L123V113-V117 PolarHBondContact O-N 3.27Å; L114-V117 PolarHBondContact O-N 3.44Å; V117-L123 HydrophobicContact CG1-CB 4.26Å; V117-L123 WeakPolarHBondContact CG1-O 3.47Å
118G67.6Low81.2Confident23 Ų2334.5 Ų34.524%0.23718%0.177CC..  trans97.1-175.1179.700000113.5
119V68.2Low81.5Confident11 Ų1133.8 Ų33.87%0.06717%0.174CC..SBendtrans-117.62.9-161.3-143.20000115L159 D316 A319 Y320V119-L159 HydrophobicContact CG1-CD2 4.37Å; V119-D316 WeakPolarHBondContact CG2-O 3.39Å; V119-A319 HydrophobicContact CB-CB 4.43Å; V119-A319 HydrophobicContact CG1-CB 3.34Å; V119-Y320 HydrophobicContact CG2-CD2 4.2Å
120R73.8Confident81.8Confident52 Ų5234.9 Ų34.920%0.19618%0.18CC..SBendtrans-71.9140.1177.7-67.3-177.4179.6169.3-6.2110.8A122 L123 L124 G308 G310R120-A122 VanDerWaalsContact C-N 3.34Å; R120-A122 PolarHBondContact O-N 3.47Å; R120-A122 VanDerWaalsContact O-N 3.09Å; R120-L123 HydrophobicContact CB-CB 4.36Å; R120-L123 HydrophobicContact CB-CD1 4.3Å; R120-L123 HydrophobicContact CB-CG 4.47Å; R120-L123 CarbonylContact O-C 3.55Å; R120-L123 PolarHBondContact O-N 3.42Å; R120-L124 VanDerWaalsContact O-CB 3.25Å; R120-L124 WeakPolarHBondContact O-CB 3.48Å; R120-L124 PolarHBondContact O-N 3.28Å; R120-G308 PolarHBondContact NH1-O 3.04Å; R120-G308 PolarHBondContact NH2-O 3.41Å; R120-G310 PolarHBondContact NH2-O 3.13Å
121P73.8Confident82.2Confident50 Ų5035.1 Ų35.133%0.32518%0.181SC..Hα-helixtrans-49.5-44.3-173.3-30.735000115.8L124 M125 L226 L299P121-L124 PolarHBondContact O-N 3.37Å; P121-M125 WeakPolarHBondContact O-CG 3.45Å; P121-M125 PolarHBondContact O-N 3.11Å; P121-L226 HydrophobicContact CB-CD1 4.26Å; P121-L226 HydrophobicContact CB-CD2 4.32Å; P121-L299 HydrophobicContact CB-CD2 4.29Å
122A75.9Confident82.7Confident6 Ų635 Ų355%0.0518%0.18CC..Hα-helixtrans-70-40178.900000113.6R120 L124 M126R120-A122 VanDerWaalsContact C-N 3.34Å; R120-A122 PolarHBondContact O-N 3.47Å; R120-A122 VanDerWaalsContact O-N 3.09Å; A122-L124 VanDerWaalsContact C-N 3.34Å; A122-M126 PolarHBondContact O-N 3.22Å; A122-M126 VanDerWaalsContact O-N 3.14Å
123L79.8Confident83.2Confident42 Ų4227.2 Ų27.222%0.2215%0.151CC..Hα-helixtrans-72.8-31.9175-66.8176000111.1V117 R120 M126 G127V117-L123 HydrophobicContact CG1-CB 4.26Å; V117-L123 WeakPolarHBondContact CG1-O 3.47Å; R120-L123 HydrophobicContact CB-CB 4.36Å; R120-L123 HydrophobicContact CB-CD1 4.3Å; R120-L123 HydrophobicContact CB-CG 4.47Å; R120-L123 CarbonylContact O-C 3.55Å; R120-L123 PolarHBondContact O-N 3.42Å; L123-M126 WeakPolarHBondContact O-CB 3.28Å; L123-M126 PolarHBondContact O-N 3.31Å; L123-G127 PolarHBondContact O-N 3.42Å
124L82.7Confident83.8Confident2 Ų229 Ų291%0.0116%0.156CC..Hα-helixtrans-65.8-48.8175.8-167.568.8000109.7R120 P121 A122 M126 G127 F128 V155 L156 L159 M230R120-L124 VanDerWaalsContact O-CB 3.25Å; R120-L124 WeakPolarHBondContact O-CB 3.48Å; R120-L124 PolarHBondContact O-N 3.28Å; P121-L124 PolarHBondContact O-N 3.37Å; A122-L124 VanDerWaalsContact C-N 3.34Å; L124-M126 VanDerWaalsContact C-N 3.32Å; L124-M126 PolarHBondContact O-N 3.07Å; L124-G127 PolarHBondContact O-N 3.41Å; L124-G127 VanDerWaalsContact O-N 3.15Å; L124-F128 HydrophobicContact CD1-CD2 4.05Å; L124-F128 HydrophobicContact CD1-CE2 3.73Å; L124-F128 HydrophobicContact CG-CD2 3.97Å; L124-F128 HydrophobicContact CG-CE2 3.92Å; L124-F128 WeakPolarHBondContact O-CD2 3.38Å; L124-F128 PolarHBondContact O-N 2.94Å; L124-V155 HydrophobicContact CD1-CG1 4.25Å; L124-V155 HydrophobicContact CD2-CG1 3.9Å; L124-L156 HydrophobicContact CD2-CD2 4.45Å; L124-L159 HydrophobicContact CD2-CD1 3.77Å; L124-M230 HydrophobicContact CD2-CE 4.27Å; L124-M230 HydrophobicContact CG-CE 4.04Å
125M88.3Confident84.5Confident0 Ų029.1 Ų29.10%016%0.156CC..Hα-helixtrans-52.6-50.3170.7-79.5-178.780.100111.6P121 G127 F128 M129 L226 M230 S233 L294 L299P121-M125 WeakPolarHBondContact O-CG 3.45Å; P121-M125 PolarHBondContact O-N 3.11Å; M125-G127 VanDerWaalsContact C-N 3.34Å; M125-G127 PolarHBondContact O-N 2.9Å; M125-F128 PolarHBondContact O-N 3.39Å; M125-M129 WeakPolarHBondContact O-CB 3.35Å; M125-M129 VanDerWaalsContact O-CG 3.27Å; M125-M129 WeakPolarHBondContact O-CG 3.3Å; M125-M129 PolarHBondContact O-N 3.31Å; M125-L226 HydrophobicContact SD-CD1 4.49Å; M125-M230 VanDerWaalsContact CA-SD 3.53Å; M125-M230 HydrophobicContact CB-SD 3.93Å; M125-M230 HydrophobicContact CG-CG 4.13Å; M125-M230 HydrophobicContact CG-SD 3.16Å; M125-M230 WeakPolarHBondContact CG-SD 3.21Å; M125-S233 WeakPolarHBondContact CE-OG 3.35Å; M125-L294 HydrophobicContact CE-CB 4.13Å; M125-L299 HydrophobicContact SD-CD1 3.32Å; M125-L299 WeakPolarHBondContact SD-CD1 3.3Å; M125-L299 HydrophobicContact SD-CG 4.43Å
126M89.3Confident85.1Confident43 Ų4328 Ų2821%0.21215%0.15CC..Hα-helixtrans-58.8-45.5177.5-172-168.9-6900111.8A122 L123 L124 M129 I130 W291 F307A122-M126 PolarHBondContact O-N 3.22Å; A122-M126 VanDerWaalsContact O-N 3.14Å; L123-M126 WeakPolarHBondContact O-CB 3.28Å; L123-M126 PolarHBondContact O-N 3.31Å; L124-M126 VanDerWaalsContact C-N 3.32Å; L124-M126 PolarHBondContact O-N 3.07Å; M126-M129 PolarHBondContact O-N 2.91Å; M126-I130 HydrophobicContact CG-CD1 3.71Å; M126-I130 HydrophobicContact CG-CG1 4.35Å; M126-I130 WeakPolarHBondContact O-CB 3.49Å; M126-I130 VanDerWaalsContact O-CG1 3.32Å; M126-I130 WeakPolarHBondContact O-CG1 3.48Å; M126-I130 PolarHBondContact O-N 2.91Å; M126-I130 HydrophobicContact SD-CD1 4.19Å; M126-W291 HydrophobicContact CE-CD2 3.97Å; M126-W291 HydrophobicContact CE-CE3 4.02Å; M126-W291 HydrophobicContact CE-CH2 3.29Å; M126-W291 HydrophobicContact CE-CZ2 3.16Å; M126-W291 HydrophobicContact CE-CZ3 3.7Å; M126-F307 HydrophobicContact CE-CZ 4.41Å
127G88.6Confident85.6Confident0 Ų021.5 Ų21.50%012%0.116CC..Hα-helixtrans-61.9-4618000000112.2L123 L124 M125 M129 I130 V131L123-G127 PolarHBondContact O-N 3.42Å; L124-G127 PolarHBondContact O-N 3.41Å; L124-G127 VanDerWaalsContact O-N 3.15Å; M125-G127 VanDerWaalsContact C-N 3.34Å; M125-G127 PolarHBondContact O-N 2.9Å; G127-M129 VanDerWaalsContact C-N 3.34Å; G127-M129 PolarHBondContact O-N 3.27Å; G127-I130 PolarHBondContact O-N 3.49Å; G127-V131 WeakPolarHBondContact O-CB 3.03Å; G127-V131 WeakPolarHBondContact O-CG2 3.4Å; G127-V131 PolarHBondContact O-N 3.4Å
128F91Very high86.2Confident0 Ų021.4 Ų21.40%011%0.111CC..Hα-helixtrans-64.1-38.5175-87.6-88.1000112.2L114 L124 M125 S132 M148 I151 S152 V155 M230 V234L114-F128 HydrophobicContact CD1-CD1 4.48Å; L114-F128 HydrophobicContact CD1-CE1 3.92Å; L114-F128 HydrophobicContact CD1-CE2 4.17Å; L114-F128 HydrophobicContact CD1-CZ 3.76Å; L114-F128 HydrophobicContact CD2-CD1 4.47Å; L114-F128 HydrophobicContact CD2-CD2 3.79Å; L114-F128 HydrophobicContact CD2-CE2 3.99Å; L114-F128 HydrophobicContact CD2-CG 4.08Å; L114-F128 HydrophobicContact CD2-CZ 4.36Å; L124-F128 HydrophobicContact CD1-CD2 4.05Å; L124-F128 HydrophobicContact CD1-CE2 3.73Å; L124-F128 HydrophobicContact CG-CD2 3.97Å; L124-F128 HydrophobicContact CG-CE2 3.92Å; L124-F128 WeakPolarHBondContact O-CD2 3.38Å; L124-F128 PolarHBondContact O-N 2.94Å; M125-F128 PolarHBondContact O-N 3.39Å; F128-S132 WeakPolarHBondContact O-CB 3.35Å; F128-S132 PolarHBondContact O-N 3Å; F128-S132 PolarHBondContact O-OG 3.21Å; F128-M148 HydrophobicContact CD1-CE 3.52Å; F128-M148 HydrophobicContact CE1-CE 3.85Å; F128-M148 HydrophobicContact CG-CE 4.45Å; F128-I151 HydrophobicContact CE1-CB 4.39Å; F128-I151 HydrophobicContact CE1-CG2 4.09Å; F128-I151 HydrophobicContact CZ-CG2 4.07Å; F128-S152 VanDerWaalsContact CE1-CA 3.49Å; F128-S152 VanDerWaalsContact CZ-CA 3.44Å; F128-V155 HydrophobicContact CZ-CG2 4.49Å; F128-M230 HydrophobicContact CB-CE 3.96Å; F128-M230 HydrophobicContact CD1-CE 4.43Å; F128-M230 HydrophobicContact CD2-CE 3.25Å; F128-M230 HydrophobicContact CE2-CE 3.76Å; F128-M230 HydrophobicContact CG-CE 3.62Å; F128-V234 HydrophobicContact CB-CG2 4.11Å; F128-V234 HydrophobicContact CD1-CG2 4.07Å; F128-V234 HydrophobicContact CG-CG2 4.48Å
129M94.6Very high87.2Confident2 Ų220.8 Ų20.81%0.0110%0.102CC..Hα-helixtrans-65.9-47176-73.1-177.671.500112.4M125 M126 G127 S132 A133 S233 S237 L287 W291 L294M125-M129 WeakPolarHBondContact O-CB 3.35Å; M125-M129 VanDerWaalsContact O-CG 3.27Å; M125-M129 WeakPolarHBondContact O-CG 3.3Å; M125-M129 PolarHBondContact O-N 3.31Å; M126-M129 PolarHBondContact O-N 2.91Å; G127-M129 VanDerWaalsContact C-N 3.34Å; G127-M129 PolarHBondContact O-N 3.27Å; M129-S132 PolarHBondContact O-N 3.42Å; M129-A133 VanDerWaalsContact O-CB 3.24Å; M129-A133 WeakPolarHBondContact O-CB 3.41Å; M129-A133 PolarHBondContact O-N 3.39Å; M129-S233 PolarHBondContact SD-OG 3.47Å; M129-S237 VanDerWaalsContact O-CB 3.31Å; M129-S237 WeakPolarHBondContact O-CB 3.4Å; M129-L287 HydrophobicContact CB-CD1 4.21Å; M129-L287 HydrophobicContact CE-CD1 3.86Å; M129-W291 HydrophobicContact CE-CB 3.88Å; M129-W291 HydrophobicContact SD-CB 3.81Å; M129-W291 HydrophobicContact SD-CG 4.24Å; M129-L294 HydrophobicContact CE-CD1 4.13Å; M129-L294 HydrophobicContact SD-CD1 4.24Å
130I93.4Very high88.1Confident75 Ų7523 Ų2339%0.38512%0.118SC..Hα-helixtrans-62.6-46179.1-70.4170.1000110.6M126 G127 A133 F134 L287M126-I130 HydrophobicContact CG-CD1 3.71Å; M126-I130 HydrophobicContact CG-CG1 4.35Å; M126-I130 WeakPolarHBondContact O-CB 3.49Å; M126-I130 VanDerWaalsContact O-CG1 3.32Å; M126-I130 WeakPolarHBondContact O-CG1 3.48Å; M126-I130 PolarHBondContact O-N 2.91Å; M126-I130 HydrophobicContact SD-CD1 4.19Å; G127-I130 PolarHBondContact O-N 3.49Å; I130-A133 PolarHBondContact O-N 2.9Å; I130-F134 VanDerWaalsContact O-CB 3.3Å; I130-F134 WeakPolarHBondContact O-CB 3.27Å; I130-F134 PolarHBondContact O-N 2.92Å; I130-L287 HydrophobicContact CG1-CD2 4.34Å
131V92.6Very high89Confident4 Ų421.2 Ų21.22%0.02411%0.113CC..Hα-helixtrans-66-45.3-179.61730000111.2A110 V113 L114 G127 F134 L135 M148A110-V131 HydrophobicContact CB-CG1 3.64Å; V113-V131 HydrophobicContact CB-CG2 3.57Å; V113-V131 HydrophobicContact CG1-CG2 3.32Å; L114-V131 HydrophobicContact CD2-CG2 4.16Å; L114-V131 HydrophobicContact CG-CG2 4.21Å; G127-V131 WeakPolarHBondContact O-CB 3.03Å; G127-V131 WeakPolarHBondContact O-CG2 3.4Å; G127-V131 PolarHBondContact O-N 3.4Å; V131-F134 PolarHBondContact O-N 3.35Å; V131-L135 HydrophobicContact CG1-CD1 3.89Å; V131-L135 HydrophobicContact CG1-CG 4.31Å; V131-L135 WeakPolarHBondContact O-CB 3.3Å; V131-L135 VanDerWaalsContact O-CG 3.25Å; V131-L135 WeakPolarHBondContact O-CG 3.35Å; V131-L135 PolarHBondContact O-N 3.13Å; V131-M148 HydrophobicContact CB-CE 3.93Å; V131-M148 HydrophobicContact CG1-CE 3.49Å; V131-M148 VanDerWaalsContact CG1-CE 3.49Å; V131-M148 HydrophobicContact CG1-SD 3.93Å
132S95.1Very high89.8Confident0 Ų021.4 Ų21.40%011%0.113CC..Hα-helixtrans-63.9-44.9178.4-56.60000110.6F128 M129 F134 L135 S136 T144 S237F128-S132 WeakPolarHBondContact O-CB 3.35Å; F128-S132 PolarHBondContact O-N 3Å; F128-S132 PolarHBondContact O-OG 3.21Å; M129-S132 PolarHBondContact O-N 3.42Å; S132-F134 PolarHBondContact O-N 2.84Å; S132-L135 PolarHBondContact O-N 3.44Å; S132-S136 VanDerWaalsContact O-CB 3.29Å; S132-S136 WeakPolarHBondContact O-CB 3.18Å; S132-S136 PolarHBondContact O-N 2.9Å; S132-T144 WeakPolarHBondContact O-CG2 3.33Å; S132-S237 VanDerWaalsContact CB-OG 3.23Å; S132-S237 WeakPolarHBondContact CB-OG 3.43Å
133A95.9Very high90.4Very high1 Ų122.3 Ų22.31%0.00812%0.121CC..Hα-helixtrans-59.7-47.1176.100000111.9M129 I130 S136 M137 S237 G241 M283 L287M129-A133 VanDerWaalsContact O-CB 3.24Å; M129-A133 WeakPolarHBondContact O-CB 3.41Å; M129-A133 PolarHBondContact O-N 3.39Å; I130-A133 PolarHBondContact O-N 2.9Å; A133-S136 PolarHBondContact O-N 3.07Å; A133-M137 WeakPolarHBondContact O-CG 3.19Å; A133-M137 PolarHBondContact O-N 3.29Å; A133-S237 VanDerWaalsContact CA-O 3.31Å; A133-S237 WeakPolarHBondContact CA-O 3.48Å; A133-S237 WeakPolarHBondContact CB-O 3.26Å; A133-G241 WeakPolarHBondContact O-CA 3.28Å; A133-M283 HydrophobicContact CB-SD 4.33Å; A133-L287 HydrophobicContact CB-CD1 4Å; A133-L287 HydrophobicContact CB-CD2 3.79Å
134F93.4Very high91Very high85 Ų8520.4 Ų20.437%0.37311%0.111SC..Hα-helixtrans-61.2-46.1179177.3-99.6000112.9I109 I130 V131 S132 S136 M137 W138I109-F134 HydrophobicContact CG2-CE1 4.08Å; I130-F134 VanDerWaalsContact O-CB 3.3Å; I130-F134 WeakPolarHBondContact O-CB 3.27Å; I130-F134 PolarHBondContact O-N 2.92Å; V131-F134 PolarHBondContact O-N 3.35Å; S132-F134 PolarHBondContact O-N 2.84Å; F134-S136 VanDerWaalsContact C-N 3.3Å; F134-S136 PolarHBondContact O-N 3.07Å; F134-M137 HydrophobicContact CD2-SD 4.48Å; F134-M137 WeakPolarHBondContact O-CB 3.49Å; F134-M137 PolarHBondContact O-N 3.34Å; F134-W138 AromaticContact CE2-NE1 3.7Å; F134-W138 AromaticContact CZ-NE1 3.78Å
135L91.6Very high91.5Very high6 Ų620.3 Ų20.33%0.03111%0.11CC..Hα-helixtrans-63.5-39.5177.5-70.5174.4000111.6H106 A110 V131 S132 M137 W138 I139 T144 M147 M148H106-L135 HydrophobicContact CB-CD2 3.97Å; A110-L135 HydrophobicContact CB-CD1 4Å; V131-L135 HydrophobicContact CG1-CD1 3.89Å; V131-L135 HydrophobicContact CG1-CG 4.31Å; V131-L135 WeakPolarHBondContact O-CB 3.3Å; V131-L135 VanDerWaalsContact O-CG 3.25Å; V131-L135 WeakPolarHBondContact O-CG 3.35Å; V131-L135 PolarHBondContact O-N 3.13Å; S132-L135 PolarHBondContact O-N 3.44Å; L135-M137 PolarHBondContact O-N 3.12Å; L135-W138 PolarHBondContact O-N 3.46Å; L135-I139 HydrophobicContact CD2-CD1 4.49Å; L135-I139 WeakPolarHBondContact O-CB 3.48Å; L135-I139 PolarHBondContact O-N 3.39Å; L135-T144 HydrophobicContact CB-CG2 3.78Å; L135-T144 HydrophobicContact CD1-CG2 4.35Å; L135-M147 HydrophobicContact CD1-CE 3.34Å; L135-M148 HydrophobicContact CD1-CG 4.33Å; L135-M148 HydrophobicContact CD1-SD 3.95Å
136S94.3Very high91.7Very high0 Ų022.5 Ų22.50%013%0.128CC..Hα-helixtrans-69.3-14.4-179.3-139.20000114.2S132 A133 F134 W138 I139 N141 A238 G242S132-S136 VanDerWaalsContact O-CB 3.29Å; S132-S136 WeakPolarHBondContact O-CB 3.18Å; S132-S136 PolarHBondContact O-N 2.9Å; A133-S136 PolarHBondContact O-N 3.07Å; F134-S136 VanDerWaalsContact C-N 3.3Å; F134-S136 PolarHBondContact O-N 3.07Å; S136-W138 PolarHBondContact O-N 3.44Å; S136-I139 CarbonylContact C-O 3.55Å; S136-I139 WeakPolarHBondContact CA-O 3.38Å; S136-I139 VanDerWaalsContact O-O 3.07Å; S136-N141 VanDerWaalsContact OG-CA 3.25Å; S136-N141 WeakPolarHBondContact OG-CA 3.49Å; S136-N141 PolarHBondContact OG-OD1 3.35Å; S136-A238 WeakPolarHBondContact CB-O 3.36Å; S136-A238 PolarHBondContact OG-O 3.48Å; S136-G242 WeakPolarHBondContact O-CA 3.4Å
137M92.9Very high91.7Very high9 Ų921.9 Ų21.94%0.04413%0.125CC..THydrogen-bonded Turntrans-67.1-25.2169.8-57.3-176.1-170.600112A133 F134 L135 G241 A244 T245 F280 M283A133-M137 WeakPolarHBondContact O-CG 3.19Å; A133-M137 PolarHBondContact O-N 3.29Å; F134-M137 HydrophobicContact CD2-SD 4.48Å; F134-M137 WeakPolarHBondContact O-CB 3.49Å; F134-M137 PolarHBondContact O-N 3.34Å; L135-M137 PolarHBondContact O-N 3.12Å; M137-G241 WeakPolarHBondContact CG-O 3.41Å; M137-A244 HydrophobicContact CE-CB 4.04Å; M137-A244 HydrophobicContact CG-CB 3.97Å; M137-A244 HydrophobicContact SD-CB 3.98Å; M137-T245 WeakPolarHBondContact CA-OG1 3.19Å; M137-T245 HydrophobicContact CB-CG2 3.88Å; M137-T245 PolarHBondContact O-OG1 3.07Å; M137-F280 HydrophobicContact CE-CD2 4.2Å; M137-F280 HydrophobicContact CE-CE2 3.98Å; M137-F280 HydrophobicContact SD-CD2 4.31Å; M137-F280 HydrophobicContact SD-CE2 4.26Å; M137-M283 HydrophobicContact CE-CE 3.16Å; M137-M283 HydrophobicContact CE-SD 3.77Å
138W87.7Confident91.8Very high39 Ų3921.9 Ų21.915%0.14813%0.125CC..THydrogen-bonded Turntrans-120.3-23.6-170-48.2109.5000112.6A97 F134 L135 S136 T245 F272 F344 V348 W351A97-W138 WeakPolarHBondContact CB-O 3.04Å; F134-W138 AromaticContact CE2-NE1 3.7Å; F134-W138 AromaticContact CZ-NE1 3.78Å; L135-W138 PolarHBondContact O-N 3.46Å; S136-W138 PolarHBondContact O-N 3.44Å; W138-T245 HydrophobicContact CE3-CG2 4.38Å; W138-T245 HydrophobicContact CH2-CG2 3.91Å; W138-T245 HydrophobicContact CZ2-CG2 4.28Å; W138-T245 HydrophobicContact CZ3-CG2 3.97Å; W138-F272 HydrophobicContact CH2-CZ 4.25Å; W138-F272 AromaticContact CZ3-CZ 3.92Å; W138-F272 HydrophobicContact CZ3-CZ 3.92Å; W138-F344 HydrophobicContact CB-CE2 4.14Å; W138-F344 HydrophobicContact CB-CZ 4.28Å; W138-F344 AromaticContact CD2-CE2 3.81Å; W138-F344 HydrophobicContact CD2-CE2 3.81Å; W138-F344 AromaticContact CD2-CZ 3.43Å; W138-F344 HydrophobicContact CD2-CZ 3.43Å; W138-F344 VanDerWaalsContact CD2-CZ 3.43Å; W138-F344 AromaticContact CE2-CZ 3.73Å; W138-F344 AromaticContact CE3-CE2 3.76Å; W138-F344 HydrophobicContact CE3-CE2 3.76Å; W138-F344 AromaticContact CE3-CZ 3.73Å; W138-F344 HydrophobicContact CE3-CZ 3.73Å; W138-F344 AromaticContact CG-CE2 3.97Å; W138-F344 HydrophobicContact CG-CE2 3.97Å; W138-F344 AromaticContact CG-CZ 3.66Å; W138-F344 HydrophobicContact CG-CZ 3.66Å; W138-F344 HydrophobicContact CH2-CZ 4.48Å; W138-F344 HydrophobicContact CZ2-CZ 4.26Å; W138-F344 HydrophobicContact CZ3-CE2 4.41Å; W138-F344 HydrophobicContact CZ3-CZ 4.23Å; W138-V348 HydrophobicContact CH2-CG1 4.35Å; W138-V348 HydrophobicContact CH2-CG2 3.79Å; W138-V348 HydrophobicContact CZ3-CG2 3.8Å; W138-W351 HydrophobicContact CZ3-CZ3 4.48Å
139I88.1Confident91.8Very high9 Ų921.9 Ų21.95%0.04613%0.125CC..SBendtrans-122.6155.4-176.6-55173000107.3V100 H106 L135 S136 A143V100-I139 HydrophobicContact CG1-CD1 4.05Å; H106-I139 HydrophobicContact CB-CD1 3.49Å; H106-I139 VanDerWaalsContact CB-CD1 3.49Å; L135-I139 HydrophobicContact CD2-CD1 4.49Å; L135-I139 WeakPolarHBondContact O-CB 3.48Å; L135-I139 PolarHBondContact O-N 3.39Å; S136-I139 CarbonylContact C-O 3.55Å; S136-I139 WeakPolarHBondContact CA-O 3.38Å; S136-I139 VanDerWaalsContact O-O 3.07Å; I139-A143 HydrophobicContact CG2-CB 3.88Å
140S88.3Confident91.5Very high57 Ų5724.3 Ų24.340%0.39914%0.141SC..  trans-58.5143.8178.269.80000113T142 A143 T144S140-T142 PolarHBondContact O-N 2.93Å; S140-A143 PolarHBondContact O-N 3.28Å; S140-A143 VanDerWaalsContact O-N 3.15Å; S140-A143 VanDerWaalsContact OG-CB 3.31Å; S140-A143 WeakPolarHBondContact OG-CB 3.25Å; S140-A143 PolarHBondContact OG-N 3.34Å; S140-T144 PolarHBondContact O-N 2.89Å; S140-T144 PolarHBondContact O-OG1 2.94Å
141N92.4Very high91.2Very high16 Ų1621.8 Ų21.89%0.08613%0.128CC..Hα-helixtrans-53.3-40177.9-53.8-10.9000112.4S136 T145 A238 P543S136-N141 VanDerWaalsContact OG-CA 3.25Å; S136-N141 WeakPolarHBondContact OG-CA 3.49Å; S136-N141 PolarHBondContact OG-OD1 3.35Å; N141-T145 WeakPolarHBondContact O-CB 3.41Å; N141-T145 PolarHBondContact O-N 3.24Å; N141-T145 PolarHBondContact O-OG1 3.34Å; N141-A238 HydrophobicContact CB-CB 4.46Å; N141-A238 PolarHBondContact OD1-O 3.06Å; N141-P543 HydrophobicContact CB-CG 3.66Å
142T90.2Very high90.9Very high53 Ų5321.7 Ų21.733%0.32513%0.127SC..Hα-helixtrans-63.4-48.9179.2-50.20000111.8S140 T145 A146 P542 I546S140-T142 PolarHBondContact O-N 2.93Å; T142-T145 PolarHBondContact O-N 2.97Å; T142-A146 VanDerWaalsContact O-CB 3.3Å; T142-A146 WeakPolarHBondContact O-CB 3.16Å; T142-A146 PolarHBondContact O-N 3.47Å; T142-P542 HydrophobicContact CG2-CB 3.67Å; T142-P542 WeakPolarHBondContact OG1-CB 3.43Å; T142-I546 HydrophobicContact CG2-CD1 3.75Å
143A88.6Confident90.6Very high26 Ų2624.4 Ų24.422%0.21514%0.14CC..Hα-helixtrans-66.8-40.9-179.200000111.4I139 S140 T145 A146 M147I139-A143 HydrophobicContact CG2-CB 3.88Å; S140-A143 PolarHBondContact O-N 3.28Å; S140-A143 VanDerWaalsContact O-N 3.15Å; S140-A143 VanDerWaalsContact OG-CB 3.31Å; S140-A143 WeakPolarHBondContact OG-CB 3.25Å; S140-A143 PolarHBondContact OG-N 3.34Å; A143-T145 PolarHBondContact O-N 2.82Å; A143-A146 PolarHBondContact O-N 2.87Å; A143-M147 WeakPolarHBondContact O-CB 3.35Å; A143-M147 PolarHBondContact O-N 3.45Å
144T92.6Very high90.1Very high2 Ų226.7 Ų26.71%0.01216%0.159CC..Hα-helixtrans-58-48.1174.9-61.20000111.4S132 L135 S140 M147 M148 A238S132-T144 WeakPolarHBondContact O-CG2 3.33Å; L135-T144 HydrophobicContact CB-CG2 3.78Å; L135-T144 HydrophobicContact CD1-CG2 4.35Å; S140-T144 PolarHBondContact O-N 2.89Å; S140-T144 PolarHBondContact O-OG1 2.94Å; T144-M147 PolarHBondContact O-N 3.03Å; T144-M148 HydrophobicContact CG2-CG 4.28Å; T144-M148 WeakPolarHBondContact O-CB 3.12Å; T144-M148 WeakPolarHBondContact O-CG 3.49Å; T144-M148 PolarHBondContact O-N 3.39Å; T144-A238 HydrophobicContact CG2-CB 4.25Å
145T93.8Very high89.5Confident0 Ų023.1 Ų23.10%014%0.144CC..Hα-helixtrans-65.8-45.3179.6-570000111.9N141 T142 A143 M147 M148 L149 V234 C235 A238 P543 I546N141-T145 WeakPolarHBondContact O-CB 3.41Å; N141-T145 PolarHBondContact O-N 3.24Å; N141-T145 PolarHBondContact O-OG1 3.34Å; T142-T145 PolarHBondContact O-N 2.97Å; A143-T145 PolarHBondContact O-N 2.82Å; T145-M147 PolarHBondContact O-N 2.84Å; T145-M148 PolarHBondContact O-N 2.96Å; T145-L149 HydrophobicContact CG2-CD1 3.41Å; T145-L149 VanDerWaalsContact CG2-CD1 3.41Å; T145-L149 HydrophobicContact CG2-CG 4.01Å; T145-L149 WeakPolarHBondContact O-CB 3.46Å; T145-L149 WeakPolarHBondContact O-CG 3.48Å; T145-L149 PolarHBondContact O-N 3.25Å; T145-L149 VanDerWaalsContact O-N 3.07Å; T145-V234 HydrophobicContact CG2-CG1 4.38Å; T145-C235 HydrophobicContact CG2-CB 4.07Å; T145-A238 WeakPolarHBondContact OG1-CB 3.48Å; T145-P543 HydrophobicContact CG2-CB 4.23Å; T145-P543 WeakPolarHBondContact OG1-CB 3.38Å; T145-I546 HydrophobicContact CG2-CB 4.25Å; T145-I546 HydrophobicContact CG2-CG2 4.37Å
146A91Very high89.1Confident45 Ų4523 Ų2337%0.37214%0.143SC..Hα-helixtrans-58.9-33.8177.500000112.9T142 A143 P150 I546T142-A146 VanDerWaalsContact O-CB 3.3Å; T142-A146 WeakPolarHBondContact O-CB 3.16Å; T142-A146 PolarHBondContact O-N 3.47Å; A143-A146 PolarHBondContact O-N 2.87Å; A146-P150 WeakPolarHBondContact O-CD 3.43Å; A146-P150 WeakPolarHBondContact O-CG 3.44Å; A146-I546 HydrophobicContact CB-CD1 4.11Å
147M88.8Confident88.6Confident30 Ų3028.3 Ų28.315%0.14817%0.169CC..Hα-helixtrans-79.4-45.5176.5-177.9-17460.700112.4H106 K107 A110 L135 A143 T144 T145 I151H106-M147 PolarHBondContact CD2-SD 3.45Å; H106-M147 PolarHBondContact NE2-SD 2.96Å; K107-M147 HydrophobicContact CB-SD 3.98Å; K107-M147 HydrophobicContact CG-SD 4.4Å; A110-M147 HydrophobicContact CB-CE 4.3Å; L135-M147 HydrophobicContact CD1-CE 3.34Å; A143-M147 WeakPolarHBondContact O-CB 3.35Å; A143-M147 PolarHBondContact O-N 3.45Å; T144-M147 PolarHBondContact O-N 3.03Å; T145-M147 PolarHBondContact O-N 2.84Å; M147-I151 HydrophobicContact CG-CD1 4.12Å; M147-I151 WeakPolarHBondContact O-CG1 3.39Å
148M91.1Very high88.1Confident0 Ų030.6 Ų30.60%018%0.179CC..Hα-helixtrans-76.1-30.2-169.1-69-62.1-65.600112.8A110 L114 F128 V131 L135 T144 T145 I151 S152 V234A110-M148 HydrophobicContact CB-SD 4.09Å; L114-M148 HydrophobicContact CD1-CE 4.26Å; F128-M148 HydrophobicContact CD1-CE 3.52Å; F128-M148 HydrophobicContact CE1-CE 3.85Å; F128-M148 HydrophobicContact CG-CE 4.45Å; V131-M148 HydrophobicContact CB-CE 3.93Å; V131-M148 HydrophobicContact CG1-CE 3.49Å; V131-M148 VanDerWaalsContact CG1-CE 3.49Å; V131-M148 HydrophobicContact CG1-SD 3.93Å; L135-M148 HydrophobicContact CD1-CG 4.33Å; L135-M148 HydrophobicContact CD1-SD 3.95Å; T144-M148 HydrophobicContact CG2-CG 4.28Å; T144-M148 WeakPolarHBondContact O-CB 3.12Å; T144-M148 WeakPolarHBondContact O-CG 3.49Å; T144-M148 PolarHBondContact O-N 3.39Å; T145-M148 PolarHBondContact O-N 2.96Å; M148-I151 PolarHBondContact O-N 2.94Å; M148-S152 WeakPolarHBondContact O-CB 3.25Å; M148-S152 PolarHBondContact O-N 2.91Å; M148-V234 HydrophobicContact CB-CG1 3.58Å; M148-V234 HydrophobicContact CB-CG2 4.46Å
149L91.8Very high87.6Confident0 Ų029.6 Ų29.60%018%0.176CC..Hα-helixtrans-65.5-49.5-179-74.3170.2000113.9T145 I151 S152 Q153 V234 I546 A547 F550T145-L149 HydrophobicContact CG2-CD1 3.41Å; T145-L149 VanDerWaalsContact CG2-CD1 3.41Å; T145-L149 HydrophobicContact CG2-CG 4.01Å; T145-L149 WeakPolarHBondContact O-CB 3.46Å; T145-L149 WeakPolarHBondContact O-CG 3.48Å; T145-L149 PolarHBondContact O-N 3.25Å; T145-L149 VanDerWaalsContact O-N 3.07Å; L149-I151 VanDerWaalsContact C-N 3.26Å; L149-I151 PolarHBondContact O-N 2.69Å; L149-S152 WeakPolarHBondContact O-CB 3.48Å; L149-S152 PolarHBondContact O-N 2.91Å; L149-S152 VanDerWaalsContact O-N 3.16Å; L149-Q153 PolarHBondContact O-N 3.12Å; L149-V234 HydrophobicContact CD2-CB 3.94Å; L149-V234 HydrophobicContact CD2-CG1 4.05Å; L149-V234 HydrophobicContact CD2-CG2 4.45Å; L149-V234 HydrophobicContact CG-CB 4.42Å; L149-V234 HydrophobicContact CG-CG1 3.98Å; L149-I546 HydrophobicContact CD1-CB 4.25Å; L149-I546 HydrophobicContact CD1-CG2 3.56Å; L149-A547 HydrophobicContact CD1-CB 4.08Å; L149-F550 HydrophobicContact CB-CB 4.37Å; L149-F550 HydrophobicContact CB-CD1 4.16Å; L149-F550 HydrophobicContact CB-CG 4.17Å; L149-F550 HydrophobicContact CD1-CB 4.25Å; L149-F550 HydrophobicContact CD1-CD2 4.45Å; L149-F550 HydrophobicContact CD1-CG 4.38Å
150P88.9Confident87.3Confident53 Ų5331.8 Ų31.834%0.34419%0.186SC..Hα-helixtrans-57.4-38.9173.9-24.631.6000113A146 Q153 A154 F550A146-P150 WeakPolarHBondContact O-CD 3.43Å; A146-P150 WeakPolarHBondContact O-CG 3.44Å; P150-Q153 PolarHBondContact O-N 3.41Å; P150-A154 WeakPolarHBondContact O-CB 3.38Å; P150-A154 PolarHBondContact O-N 3.31Å; P150-F550 HydrophobicContact CB-CE1 4.4Å; P150-F550 HydrophobicContact CG-CE1 3.74Å; P150-F550 HydrophobicContact CG-CZ 4.05Å
151I85.9Confident87.1Confident23 Ų2332.7 Ų32.712%0.11819%0.185CC..Hα-helixtrans-65.2-45.3177.2-61.4172.4000110L111 L114 F128 M147 M148 L149 Q153 A154 V155L111-I151 HydrophobicContact CD2-CG2 4.18Å; L114-I151 HydrophobicContact CD1-CG2 4.35Å; F128-I151 HydrophobicContact CE1-CB 4.39Å; F128-I151 HydrophobicContact CE1-CG2 4.09Å; F128-I151 HydrophobicContact CZ-CG2 4.07Å; M147-I151 HydrophobicContact CG-CD1 4.12Å; M147-I151 WeakPolarHBondContact O-CG1 3.39Å; M148-I151 PolarHBondContact O-N 2.94Å; L149-I151 VanDerWaalsContact C-N 3.26Å; L149-I151 PolarHBondContact O-N 2.69Å; I151-Q153 PolarHBondContact O-N 3.08Å; I151-A154 PolarHBondContact O-N 3.31Å; I151-V155 WeakPolarHBondContact O-CG2 3.45Å; I151-V155 PolarHBondContact O-N 3.44Å; I151-V155 VanDerWaalsContact O-N 3.13Å
152S87.8Confident86.4Confident1 Ų132.8 Ų32.81%0.00719%0.185CC..Hα-helixtrans-59.2-46.6176.8-177.70000111.7F128 M148 L149 V155 L156 M230F128-S152 VanDerWaalsContact CE1-CA 3.49Å; F128-S152 VanDerWaalsContact CZ-CA 3.44Å; M148-S152 WeakPolarHBondContact O-CB 3.25Å; M148-S152 PolarHBondContact O-N 2.91Å; L149-S152 WeakPolarHBondContact O-CB 3.48Å; L149-S152 PolarHBondContact O-N 2.91Å; L149-S152 VanDerWaalsContact O-N 3.16Å; S152-V155 PolarHBondContact O-N 2.99Å; S152-L156 VanDerWaalsContact O-CG 3.28Å; S152-L156 WeakPolarHBondContact O-CG 3.25Å; S152-L156 PolarHBondContact O-N 3.49Å; S152-M230 VanDerWaalsContact OG-CE 3.28Å; S152-M230 WeakPolarHBondContact OG-CE 3.44Å
153Q87.9Confident85.8Confident57 Ų5731.6 Ų31.627%0.26618%0.176SC..Hα-helixtrans-63.7-44.4178.7-75.2-175.3-24.100112.5L149 P150 I151 V155 L156 Q157 F550L149-Q153 PolarHBondContact O-N 3.12Å; P150-Q153 PolarHBondContact O-N 3.41Å; I151-Q153 PolarHBondContact O-N 3.08Å; Q153-V155 VanDerWaalsContact C-N 3.27Å; Q153-V155 PolarHBondContact O-N 3.39Å; Q153-L156 PolarHBondContact O-N 3Å; Q153-Q157 WeakPolarHBondContact O-CB 3.33Å; Q153-Q157 PolarHBondContact O-N 2.87Å; Q153-F550 VanDerWaalsContact CD-CD1 3.5Å; Q153-F550 PolarHBondContact NE2-O 2.98Å; Q153-F550 VanDerWaalsContact OE1-CD1 3.23Å
154A84.5Confident85.4Confident50 Ų5031.8 Ų31.841%0.41318%0.175SC..Hα-helixtrans-58.4-41.4178.500000111.7P150 I151 Q158P150-A154 WeakPolarHBondContact O-CB 3.38Å; P150-A154 PolarHBondContact O-N 3.31Å; I151-A154 PolarHBondContact O-N 3.31Å; A154-Q158 PolarHBondContact O-N 3.28Å
155V81.6Confident84.8Confident9 Ų938.4 Ų38.46%0.05520%0.199CC..Hα-helixtrans-67.9-42.8176.4175.50000111.7L124 F128 I151 S152 Q153 Q158 L159 M323L124-V155 HydrophobicContact CD1-CG1 4.25Å; L124-V155 HydrophobicContact CD2-CG1 3.9Å; F128-V155 HydrophobicContact CZ-CG2 4.49Å; I151-V155 WeakPolarHBondContact O-CG2 3.45Å; I151-V155 PolarHBondContact O-N 3.44Å; I151-V155 VanDerWaalsContact O-N 3.13Å; S152-V155 PolarHBondContact O-N 2.99Å; Q153-V155 VanDerWaalsContact C-N 3.27Å; Q153-V155 PolarHBondContact O-N 3.39Å; V155-Q158 PolarHBondContact O-N 2.74Å; V155-L159 HydrophobicContact CG1-CD1 4.17Å; V155-L159 WeakPolarHBondContact O-CG 3.3Å; V155-L159 PolarHBondContact O-N 3.3Å; V155-L159 VanDerWaalsContact O-N 3.09Å; V155-M323 HydrophobicContact CG2-CG 3.88Å; V155-M323 HydrophobicContact CG2-SD 4.33Å
156L83.2Confident83.9Confident3 Ų339.3 Ų39.32%0.01621%0.207CC..Hα-helixtrans-65.8-42.3179.1-73176.1000113L124 S152 Q153 Q158 L159 Q160 L226 M230L124-L156 HydrophobicContact CD2-CD2 4.45Å; S152-L156 VanDerWaalsContact O-CG 3.28Å; S152-L156 WeakPolarHBondContact O-CG 3.25Å; S152-L156 PolarHBondContact O-N 3.49Å; Q153-L156 PolarHBondContact O-N 3Å; L156-Q158 VanDerWaalsContact C-N 3.27Å; L156-Q158 PolarHBondContact O-N 2.87Å; L156-L159 PolarHBondContact O-N 3.33Å; L156-Q160 PolarHBondContact O-N 3.04Å; L156-L226 HydrophobicContact CD2-CD2 3.45Å; L156-L226 VanDerWaalsContact CD2-CD2 3.45Å; L156-L226 HydrophobicContact CD2-CG 3.65Å; L156-M230 HydrophobicContact CD1-CB 3.85Å; L156-M230 HydrophobicContact CD1-CG 3.82Å; L156-M230 HydrophobicContact CD2-CG 4.17Å; L156-M230 HydrophobicContact CG-CG 4.4Å
157Q84.4Confident83.1Confident113 Ų11339.4 Ų39.453%0.52820%0.2SC..Hα-helixtrans-60.4-40.9179.3-176.9-179.2-13.600110.9Q153 Q160 E161Q153-Q157 WeakPolarHBondContact O-CB 3.33Å; Q153-Q157 PolarHBondContact O-N 2.87Å; Q157-Q160 WeakPolarHBondContact O-CB 3.46Å; Q157-Q160 PolarHBondContact O-N 2.93Å; Q157-E161 PolarHBondContact NE2-OE1 3.23Å; Q157-E161 VanDerWaalsContact NE2-OE1 3.15Å; Q157-E161 WeakPolarHBondContact O-CG 3.38Å; Q157-E161 PolarHBondContact O-N 3.23Å
158Q80.7Confident82.5Confident57 Ų5742 Ų4227%0.26621%0.212SC..Hα-helixtrans-72.5-36177.6-74.1-178.1-25.800113.7A154 V155 L156 Q160 E161 T162 V322A154-Q158 PolarHBondContact O-N 3.28Å; V155-Q158 PolarHBondContact O-N 2.74Å; L156-Q158 VanDerWaalsContact C-N 3.27Å; L156-Q158 PolarHBondContact O-N 2.87Å; Q158-Q160 PolarHBondContact O-N 3.08Å; Q158-E161 PolarHBondContact O-N 2.92Å; Q158-T162 WeakPolarHBondContact O-CB 3.28Å; Q158-T162 PolarHBondContact O-N 3.36Å; Q158-T162 PolarHBondContact O-OG1 3.01Å; Q158-V322 VanDerWaalsContact CD-CG1 3.47Å; Q158-V322 VanDerWaalsContact NE2-CG2 3.27Å
159L77.8Confident81.8Confident17 Ų1749.3 Ų49.39%0.08924%0.239CC..Hα-helixtrans-57.9-42171.3-77.9168.4000110.7V119 L124 V155 L156 E163 Y223 A319V119-L159 HydrophobicContact CG1-CD2 4.37Å; L124-L159 HydrophobicContact CD2-CD1 3.77Å; V155-L159 HydrophobicContact CG1-CD1 4.17Å; V155-L159 WeakPolarHBondContact O-CG 3.3Å; V155-L159 PolarHBondContact O-N 3.3Å; V155-L159 VanDerWaalsContact O-N 3.09Å; L156-L159 PolarHBondContact O-N 3.33Å; L159-E163 WeakPolarHBondContact O-CB 3.26Å; L159-E163 PolarHBondContact O-N 3.26Å; L159-Y223 HydrophobicContact CB-CE1 3.81Å; L159-Y223 PolarHBondContact O-OH 3.24Å; L159-Y223 VanDerWaalsContact O-OH 3.13Å; L159-A319 HydrophobicContact CD2-CB 3.33Å; L159-A319 HydrophobicContact CG-CB 3.84Å
160Q83.2Confident81Confident55 Ų5553.3 Ų53.326%0.25726%0.26SS..Hα-helixtrans-61.1-51.8174.3-175176.6-4.100111.8L156 Q157 Q158 T162 E163 T164 Y223L156-Q160 PolarHBondContact O-N 3.04Å; Q157-Q160 WeakPolarHBondContact O-CB 3.46Å; Q157-Q160 PolarHBondContact O-N 2.93Å; Q158-Q160 PolarHBondContact O-N 3.08Å; Q160-T162 VanDerWaalsContact C-N 3.34Å; Q160-T162 PolarHBondContact O-N 2.97Å; Q160-E163 PolarHBondContact O-N 3.39Å; Q160-T164 PolarHBondContact O-N 3.41Å; Q160-T164 PolarHBondContact O-OG1 2.83Å; Q160-Y223 VanDerWaalsContact CA-CZ 3.43Å; Q160-Y223 HydrophobicContact CB-CD1 3.71Å; Q160-Y223 HydrophobicContact CB-CD2 3.74Å; Q160-Y223 HydrophobicContact CB-CE1 3.87Å; Q160-Y223 HydrophobicContact CB-CE2 3.9Å; Q160-Y223 HydrophobicContact CB-CG 3.66Å; Q160-Y223 HydrophobicContact CG-CD1 4.37Å; Q160-Y223 HydrophobicContact CG-CD2 3.59Å; Q160-Y223 HydrophobicContact CG-CE2 4.04Å; Q160-Y223 HydrophobicContact CG-CG 3.79Å
161E82.8Confident80.2Confident77 Ų7752.7 Ų52.736%0.3625%0.254SS..Hα-helixtrans-59.3-42.2179.8-72.4173.9-162.400112.5Q157 Q158 R165Q157-E161 PolarHBondContact NE2-OE1 3.23Å; Q157-E161 VanDerWaalsContact NE2-OE1 3.15Å; Q157-E161 WeakPolarHBondContact O-CG 3.38Å; Q157-E161 PolarHBondContact O-N 3.23Å; Q158-E161 PolarHBondContact O-N 2.92Å; E161-R165 WeakPolarHBondContact O-CB 3.09Å; E161-R165 VanDerWaalsContact O-CG 3.25Å; E161-R165 WeakPolarHBondContact O-CG 3.27Å; E161-R165 PolarHBondContact O-N 3.1Å
162T77.4Confident79.6Confident17 Ų1756.5 Ų56.510%0.10427%0.272CS..Hα-helixtrans-65.7-41176-70.50000111.8Q158 Q160 A166 R315 E318Q158-T162 WeakPolarHBondContact O-CB 3.28Å; Q158-T162 PolarHBondContact O-N 3.36Å; Q158-T162 PolarHBondContact O-OG1 3.01Å; Q160-T162 VanDerWaalsContact C-N 3.34Å; Q160-T162 PolarHBondContact O-N 2.97Å; T162-A166 WeakPolarHBondContact O-CB 3.47Å; T162-A166 PolarHBondContact O-N 3.12Å; T162-R315 HydrophobicContact CG2-CB 4.12Å; T162-R315 HydrophobicContact CG2-CG 4.18Å; T162-E318 WeakPolarHBondContact CB-OE2 3.27Å; T162-E318 HydrophobicContact CG2-CB 4.36Å; T162-E318 WeakPolarHBondContact CG2-OE2 3.39Å; T162-E318 PolarHBondContact OG1-OE2 3.42Å
163E77.3Confident78.8Confident29 Ų2960.4 Ų60.414%0.13629%0.292CS..Hα-helixtrans-67-44.4177.9-170.4164.7-153.500111.3L159 Q160 R165 A166 E167 K222 Y223L159-E163 WeakPolarHBondContact O-CB 3.26Å; L159-E163 PolarHBondContact O-N 3.26Å; Q160-E163 PolarHBondContact O-N 3.39Å; E163-R165 PolarHBondContact O-N 3.22Å; E163-A166 PolarHBondContact O-N 3.37Å; E163-E167 WeakPolarHBondContact O-CG 3.49Å; E163-E167 PolarHBondContact O-N 3.12Å; E163-K222 IonicContact OE1-NZ 2.73Å; E163-K222 PolarHBondContact OE1-NZ 3.37Å; E163-K222 IonicContact OE2-NZ 2.77Å; E163-K222 PolarHBondContact OE2-NZ 3.31Å; E163-Y223 HydrophobicContact CB-CE2 4.28Å; E163-Y223 WeakPolarHBondContact OE2-CE2 3.35Å; E163-Y223 PolarHBondContact OE2-OH 3.15Å
164T80.5Confident77.6Confident29 Ų2961.8 Ų61.818%0.17830%0.304CS..Hα-helixtrans-61-44.2176.2-54.70000111.8Q160 A166 E167 E168Q160-T164 PolarHBondContact O-N 3.41Å; Q160-T164 PolarHBondContact O-OG1 2.83Å; T164-A166 VanDerWaalsContact C-N 3.31Å; T164-A166 PolarHBondContact O-N 3.18Å; T164-E167 PolarHBondContact O-N 3.14Å; T164-E168 WeakPolarHBondContact O-CG 3.49Å; T164-E168 PolarHBondContact O-N 3.25Å
165R80Confident76.5Confident141 Ų14162.6 Ų62.653%0.53231%0.312SS..Hα-helixtrans-63.6-35.9176.3-74.8175.7-174.21767.3112.9E161 E163 R169E161-R165 WeakPolarHBondContact O-CB 3.09Å; E161-R165 VanDerWaalsContact O-CG 3.25Å; E161-R165 WeakPolarHBondContact O-CG 3.27Å; E161-R165 PolarHBondContact O-N 3.1Å; E163-R165 PolarHBondContact O-N 3.22Å; R165-R169 WeakPolarHBondContact O-CG 3.49Å; R165-R169 PolarHBondContact O-N 3.39Å
166A74.8Confident75.5Confident19 Ų1969.8 Ų69.816%0.15734%0.344CS..Hα-helixtrans-69.4-44.3177.100000111.1T162 E163 T164 E168 R169 D170T162-A166 WeakPolarHBondContact O-CB 3.47Å; T162-A166 PolarHBondContact O-N 3.12Å; E163-A166 PolarHBondContact O-N 3.37Å; T164-A166 VanDerWaalsContact C-N 3.31Å; T164-A166 PolarHBondContact O-N 3.18Å; A166-E168 VanDerWaalsContact C-N 3.32Å; A166-E168 PolarHBondContact O-N 2.91Å; A166-R169 PolarHBondContact O-N 3.15Å; A166-D170 VanDerWaalsContact O-CG 3.31Å; A166-D170 PolarHBondContact O-N 2.96Å
167E74.8Confident73.9Confident48 Ų4876.2 Ų76.222%0.22438%0.379CS..Hα-helixtrans-60.6-40.8175.7-72.7173.5177.200111.9E163 T164 R169 D170 L171 T219E163-E167 WeakPolarHBondContact O-CG 3.49Å; E163-E167 PolarHBondContact O-N 3.12Å; T164-E167 PolarHBondContact O-N 3.14Å; E167-R169 PolarHBondContact O-N 3.4Å; E167-D170 PolarHBondContact O-N 3.42Å; E167-L171 WeakPolarHBondContact O-CB 3.47Å; E167-L171 PolarHBondContact O-N 2.95Å; E167-T219 PolarHBondContact OE1-OG1 3.28Å; E167-T219 PolarHBondContact OE2-OG1 2.88Å; E167-T219 VanDerWaalsContact OE2-OG1 3.04Å
168E76.8Confident72.2Confident84 Ų8474.7 Ų74.739%0.39337%0.374SS..Hα-helixtrans-61.2-41.4174.9-76.5175.317700112.6T164 A166 Q172T164-E168 WeakPolarHBondContact O-CG 3.49Å; T164-E168 PolarHBondContact O-N 3.25Å; A166-E168 VanDerWaalsContact C-N 3.32Å; A166-E168 PolarHBondContact O-N 2.91Å; E168-Q172 WeakPolarHBondContact O-CG 3.47Å; E168-Q172 PolarHBondContact O-N 3.23Å
169R76.6Confident70.8Confident154 Ų15476.5 Ų76.558%0.58139%0.391SS*.Hα-helixtrans-66.4-43.4175.2-72.2176.9-172.41784.6111.9R165 A166 E167 L171 Q172 N173R165-R169 WeakPolarHBondContact O-CG 3.49Å; R165-R169 PolarHBondContact O-N 3.39Å; A166-R169 PolarHBondContact O-N 3.15Å; E167-R169 PolarHBondContact O-N 3.4Å; R169-L171 VanDerWaalsContact C-N 3.31Å; R169-L171 PolarHBondContact O-N 2.84Å; R169-Q172 PolarHBondContact O-N 3.21Å; R169-N173 PolarHBondContact O-N 3.43Å; R169-N173 PolarHBondContact O-ND2 3.39Å
170D74.7Confident69.2Low83 Ų8377.4 Ų77.444%0.44440%0.404SS..Hα-helixtrans-63.6-39.6179.2-67.6-21.3000110.9A166 E167 T174 R315A166-D170 VanDerWaalsContact O-CG 3.31Å; A166-D170 PolarHBondContact O-N 2.96Å; E167-D170 PolarHBondContact O-N 3.42Å; D170-T174 WeakPolarHBondContact O-CB 3.28Å; D170-T174 PolarHBondContact O-N 3.19Å; D170-T174 PolarHBondContact O-OG1 2.83Å; D170-R315 IonicContact OD2-NH2 3.03Å
171L72.3Confident67.4Low41 Ų4180 Ų8022%0.21542%0.415CS..Hα-helixtrans-64.7-41.3173.5-84.8156.3000112.6E167 R169 A175 I211E167-L171 WeakPolarHBondContact O-CB 3.47Å; E167-L171 PolarHBondContact O-N 2.95Å; R169-L171 VanDerWaalsContact C-N 3.31Å; R169-L171 PolarHBondContact O-N 2.84Å; L171-A175 WeakPolarHBondContact O-CB 3.31Å; L171-A175 PolarHBondContact O-N 3.38Å; L171-A175 VanDerWaalsContact O-N 3.07Å; L171-I211 HydrophobicContact CD2-CG2 4.12Å
172Q72.1Confident65.6Low103 Ų10381.6 Ų81.648%0.48142%0.422SS..Hα-helixtrans-63.6-48.9175.6-77.7173.2-6.700111.4E168 R169 T174 A175 E176E168-Q172 WeakPolarHBondContact O-CG 3.47Å; E168-Q172 PolarHBondContact O-N 3.23Å; R169-Q172 PolarHBondContact O-N 3.21Å; Q172-T174 VanDerWaalsContact C-N 3.3Å; Q172-T174 PolarHBondContact O-N 3.42Å; Q172-A175 WeakPolarHBondContact O-CB 3.27Å; Q172-A175 PolarHBondContact O-N 2.84Å; Q172-A175 VanDerWaalsContact O-N 3.12Å; Q172-E176 PolarHBondContact O-N 3.45Å; Q172-E176 VanDerWaalsContact O-N 3.1Å
173N70.8Confident63.8Low82 Ų8286.4 Ų86.444%0.43945%0.445SS..Hα-helixtrans-61.1-39.8178.3-65.1-16.6000111.7R169 A175 E176 D177R169-N173 PolarHBondContact O-N 3.43Å; R169-N173 PolarHBondContact O-ND2 3.39Å; N173-A175 VanDerWaalsContact C-N 3.31Å; N173-A175 PolarHBondContact O-N 3.43Å; N173-E176 PolarHBondContact O-N 3.01Å; N173-E176 VanDerWaalsContact O-N 3.15Å; N173-D177 WeakPolarHBondContact O-CB 3.3Å; N173-D177 PolarHBondContact O-N 3.26Å
174T63.8Low62Low86 Ų8691.9 Ų91.953%0.52847%0.471SS..Hα-helixtrans-67.9-31.1177.9-51.10000112.5D170 Q172 E176D170-T174 WeakPolarHBondContact O-CB 3.28Å; D170-T174 PolarHBondContact O-N 3.19Å; D170-T174 PolarHBondContact O-OG1 2.83Å; Q172-T174 VanDerWaalsContact C-N 3.3Å; Q172-T174 PolarHBondContact O-N 3.42Å; T174-E176 VanDerWaalsContact C-N 3.31Å
175A61.6Low60Low68 Ų6893 Ų9356%0.56248%0.48SS*.Hα-helixtrans-71.8-26.5173.300000112.5L171 Q172 N173L171-A175 WeakPolarHBondContact O-CB 3.31Å; L171-A175 PolarHBondContact O-N 3.38Å; L171-A175 VanDerWaalsContact O-N 3.07Å; Q172-A175 WeakPolarHBondContact O-CB 3.27Å; Q172-A175 PolarHBondContact O-N 2.84Å; Q172-A175 VanDerWaalsContact O-N 3.12Å; N173-A175 VanDerWaalsContact C-N 3.31Å; N173-A175 PolarHBondContact O-N 3.43Å
176E59.1Low57.9Low159 Ų15993.1 Ų93.174%0.74348%0.48SS*.Hα-helixtrans-86.2-33.4177.9-69.3-179.3178.100113.3Q172 N173 T174Q172-E176 PolarHBondContact O-N 3.45Å; Q172-E176 VanDerWaalsContact O-N 3.1Å; N173-E176 PolarHBondContact O-N 3.01Å; N173-E176 VanDerWaalsContact O-N 3.15Å; T174-E176 VanDerWaalsContact C-N 3.31Å
177D50.4Low55.9Low138 Ų138101 Ų10174%0.73851%0.511SS*.Hα-helixtrans-96-0.7-168.3-93-19.7000116.8N173 P179N173-D177 WeakPolarHBondContact O-CB 3.3Å; N173-D177 PolarHBondContact O-N 3.26Å; D177-P179 WeakPolarHBondContact O-CD 3.32Å
178N49.8Very low54.3Low82 Ų82106 Ų10644%0.43954%0.537SS..  trans-112.389.2-167.6-149-2.6000115.1G180 F181N178-G180 PolarHBondContact O-N 2.98Å; N178-G180 PolarHBondContact OD1-N 3.1Å; N178-F181 PolarHBondContact O-N 3.17Å
179P49.7Very low52.7Low94 Ų94108 Ų10861%0.6155%0.547SS*.THydrogen-bonded Turntrans-70.3-8.3170.327.5-32000113.3D177 F181D177-P179 WeakPolarHBondContact O-CD 3.32Å; P179-F181 VanDerWaalsContact C-N 3.32Å
180G45.6Very low50.8Low36 Ų36110 Ų11037%0.37156%0.563SS.*THydrogen-bonded Turntrans-73.1-20.7174.900000114.2N178 E182 M183 E184N178-G180 PolarHBondContact O-N 2.98Å; N178-G180 PolarHBondContact OD1-N 3.1Å; G180-E182 VanDerWaalsContact C-N 3.33Å; G180-M183 WeakPolarHBondContact O-CB 3.31Å; G180-M183 PolarHBondContact O-N 2.96Å; G180-M183 VanDerWaalsContact O-N 3.15Å; G180-E184 PolarHBondContact O-N 3.36Å
181F45.8Very low49.2Very low110 Ų110109.1 Ų109.148%0.48257%0.573SS.*Hα-helixtrans-71.7-29.1175.9-125.3-91.1000112N178 P179 M183 S185N178-F181 PolarHBondContact O-N 3.17Å; P179-F181 VanDerWaalsContact C-N 3.32Å; F181-M183 PolarHBondContact O-N 2.99Å; F181-S185 PolarHBondContact O-OG 2.89Å
182E44.3Very low47.5Very low110 Ų110114.4 Ų114.451%0.51460%0.6SS.*Hα-helixtrans-67.6-25.5169.8-68.5-168.6165.100112.3G180 S185 R186G180-E182 VanDerWaalsContact C-N 3.33Å; E182-S185 VanDerWaalsContact CA-OG 3.3Å; E182-S185 WeakPolarHBondContact CA-OG 3.42Å; E182-S185 PolarHBondContact O-OG 3.38Å; E182-R186 WeakPolarHBondContact O-CG 3.39Å; E182-R186 PolarHBondContact O-N 3.41Å; E182-R186 IonicContact OE2-CZ 3.99Å; E182-R186 IonicContact OE2-NH2 3.16Å; E182-R186 PolarHBondContact OE2-NH2 3.46Å; E182-R186 VanDerWaalsContact OE2-NH2 3.16Å
183M38.3Very low46Very low119 Ų119115.2 Ų115.259%0.58661%0.614SS**Hα-helixtrans-83.8-28.3-171.8-138178.6-74.700112.7G180 F181 R186 K187G180-M183 WeakPolarHBondContact O-CB 3.31Å; G180-M183 PolarHBondContact O-N 2.96Å; G180-M183 VanDerWaalsContact O-N 3.15Å; F181-M183 PolarHBondContact O-N 2.99Å; M183-R186 PolarHBondContact O-N 3.48Å; M183-K187 PolarHBondContact O-N 3.02Å; M183-K187 VanDerWaalsContact O-N 3.17Å
184E39.5Very low44.9Very low143 Ų143119 Ų11967%0.66864%0.635SS**Hα-helixtrans-73.9-31.7171.8-149.6166.1-15100111.4G180G180-E184 PolarHBondContact O-N 3.36Å
185S38.7Very low43.9Very low52 Ų52123.7 Ų123.736%0.36465%0.651SS.*Hα-helixtrans-69.4-32.9166.839.80000113.5F181 E182 I188F181-S185 PolarHBondContact O-OG 2.89Å; E182-S185 VanDerWaalsContact CA-OG 3.3Å; E182-S185 WeakPolarHBondContact CA-OG 3.42Å; E182-S185 PolarHBondContact O-OG 3.38Å; S185-I188 PolarHBondContact O-N 3.46Å
186R36.9Very low43.1Very low145 Ų145127.7 Ų127.755%0.54766%0.655SS.*Hα-helixtrans-72.7-28.8176.9-79.3-179.1-169.4157.715.6113.6E182 M183 I188 Q189E182-R186 WeakPolarHBondContact O-CG 3.39Å; E182-R186 PolarHBondContact O-N 3.41Å; E182-R186 IonicContact OE2-CZ 3.99Å; E182-R186 IonicContact OE2-NH2 3.16Å; E182-R186 PolarHBondContact OE2-NH2 3.46Å; E182-R186 VanDerWaalsContact OE2-NH2 3.16Å; M183-R186 PolarHBondContact O-N 3.48Å; R186-I188 VanDerWaalsContact C-N 3.27Å; R186-I188 PolarHBondContact O-N 2.91Å; R186-Q189 WeakPolarHBondContact O-CA 3.39Å; R186-Q189 VanDerWaalsContact O-CB 3.3Å; R186-Q189 WeakPolarHBondContact O-CB 3.31Å; R186-Q189 PolarHBondContact O-N 3.06Å
187K33.1Very low42.5Very low183 Ų183126.4 Ų126.480%0.79665%0.654SS**Hα-helixtrans-72.1-18.1176.3-82-174.1177.7178.80114.2M183M183-K187 PolarHBondContact O-N 3.02Å; M183-K187 VanDerWaalsContact O-N 3.17Å
188I40.9Very low42.2Very low153 Ų153125 Ų12579%0.78565%0.65SS**THydrogen-bonded Turntrans-81.7-10.8169.6-58.7174.6000110.6S185 R186S185-I188 PolarHBondContact O-N 3.46Å; R186-I188 VanDerWaalsContact C-N 3.27Å; R186-I188 PolarHBondContact O-N 2.91Å
189Q41.9Very low42Very low127 Ų127124.2 Ų124.259%0.59365%0.646SS**  trans-107.222-164-130.9174.111.900114.4R186 G191R186-Q189 WeakPolarHBondContact O-CA 3.39Å; R186-Q189 VanDerWaalsContact O-CB 3.3Å; R186-Q189 WeakPolarHBondContact O-CB 3.31Å; R186-Q189 PolarHBondContact O-N 3.06Å; Q189-G191 VanDerWaalsContact C-N 3.32Å
190E38.5Very low41.9Very low196 Ų196122.8 Ų122.892%0.91664%0.635SS**SBendtrans-90.218.2172.7-82.4-167.7165.900113.9
191G39.8Very low42Very low64 Ų64128.1 Ų128.166%0.6665%0.648SS**SBendtrans-145.2-4.8-17200000121.1Q189Q189-G191 VanDerWaalsContact C-N 3.32Å
192I36.9Very low42.1Very low153 Ų153127 Ų12779%0.78565%0.647SS**  trans-145.2133.8-175-51.6179.5000111.5
193P41.3Very low42.4Very low120 Ų120128.4 Ų128.478%0.77965%0.654SS**  trans-77.5154.5-176.9-0.618.3000113.8E195P193-E195 PolarHBondContact O-N 3.3Å
194D46.5Very low43Very low161 Ų161127 Ų12786%0.86165%0.645SS**SBendtrans-27.1107.3175.6-72.2-53.1000117.7
195E43.7Very low43.8Very low185 Ų185126.1 Ų126.186%0.86464%0.641SS**  trans-174.8101.3139.6-111.1-179.1176.400109.2P193P193-E195 PolarHBondContact O-N 3.3Å
196K44.8Very low44.9Very low151 Ų151128.2 Ų128.266%0.65765%0.648SS**  trans151.181.9157.6-86.6162.4174.9-128.40111.1D199 T200K196-D199 HydrophobicContact CB-CB 4.46Å; K196-D199 VanDerWaalsContact CD-OD2 3.23Å; K196-D199 WeakPolarHBondContact CD-OD2 3.35Å; K196-D199 VanDerWaalsContact CE-OD2 3.27Å; K196-D199 WeakPolarHBondContact CE-OD2 3.49Å; K196-D199 IonicContact NZ-OD2 2.71Å; K196-D199 PolarHBondContact NZ-OD2 2.85Å; K196-T200 PolarHBondContact O-OG1 2.82Å
197N45.7Very low46.3Very low133 Ų133122.8 Ų122.871%0.71164%0.638SS**SBendtrans-90.7-7.4168.8-97.5-20.8000113.4
198T44.4Very low48Very low107 Ų107116.9 Ų116.966%0.65661%0.614SS**Hα-helixtrans-88.6-36.6-179.5-21.40000112.5T200 L202T198-T200 PolarHBondContact O-N 3.4Å; T198-L202 PolarHBondContact O-N 3.43Å
199D45.7Very low49.6Very low67 Ų67115.3 Ų115.336%0.35860%0.603SS.*Hα-helixtrans-69.6-32.2-178.3-76.5-17.9000112.5K196 Q203K196-D199 HydrophobicContact CB-CB 4.46Å; K196-D199 VanDerWaalsContact CD-OD2 3.23Å; K196-D199 WeakPolarHBondContact CD-OD2 3.35Å; K196-D199 VanDerWaalsContact CE-OD2 3.27Å; K196-D199 WeakPolarHBondContact CE-OD2 3.49Å; K196-D199 IonicContact NZ-OD2 2.71Å; K196-D199 PolarHBondContact NZ-OD2 2.85Å; D199-Q203 WeakPolarHBondContact O-CB 3.33Å; D199-Q203 VanDerWaalsContact O-CG 3.32Å; D199-Q203 WeakPolarHBondContact O-CG 3.49Å; D199-Q203 PolarHBondContact O-N 3.27Å
200T46.9Very low51.2Low63 Ų63117.1 Ų117.139%0.38761%0.606SS.*Hα-helixtrans-72.7-37.1-177.2-27.40000112.6K196 T198 Q203 Q204K196-T200 PolarHBondContact O-OG1 2.82Å; T198-T200 PolarHBondContact O-N 3.4Å; T200-Q203 PolarHBondContact O-N 2.94Å; T200-Q204 WeakPolarHBondContact O-CB 3.23Å; T200-Q204 PolarHBondContact O-N 3.1Å
201K48.6Very low53Low149 Ų149111.9 Ų111.965%0.64858%0.584SS**Hα-helixtrans-68.2-42.9174.7-78.9-173.5174.4-174.50112.1Q203 Q204 E205K201-Q203 VanDerWaalsContact C-N 3.35Å; K201-Q203 PolarHBondContact O-N 3.5Å; K201-Q204 PolarHBondContact O-N 3.04Å; K201-E205 WeakPolarHBondContact O-CB 3.22Å; K201-E205 WeakPolarHBondContact O-CG 3.4Å; K201-E205 PolarHBondContact O-N 2.98Å
202L48.6Very low54.9Low87 Ų87114.1 Ų114.146%0.45557%0.572SS.*Hα-helixtrans-62.2-40.2174.7-80.9157.9000111.8T198 N206T198-L202 PolarHBondContact O-N 3.43Å; L202-N206 VanDerWaalsContact O-CB 3.28Å; L202-N206 WeakPolarHBondContact O-CB 3.41Å; L202-N206 PolarHBondContact O-N 2.96Å; L202-N206 PolarHBondContact O-ND2 3.09Å; L202-N206 VanDerWaalsContact O-ND2 3.14Å; L202-N206 PolarHBondContact O-OD1 3.06Å
203Q49.5Very low56.9Low139 Ų139111.6 Ų111.665%0.6556%0.557SS**Hα-helixtrans-67.6-34.9175.7-77.5176.7-12.700113.2D199 T200 K201 G207D199-Q203 WeakPolarHBondContact O-CB 3.33Å; D199-Q203 VanDerWaalsContact O-CG 3.32Å; D199-Q203 WeakPolarHBondContact O-CG 3.49Å; D199-Q203 PolarHBondContact O-N 3.27Å; T200-Q203 PolarHBondContact O-N 2.94Å; K201-Q203 VanDerWaalsContact C-N 3.35Å; K201-Q203 PolarHBondContact O-N 3.5Å; Q203-G207 PolarHBondContact O-N 3.46Å
204Q51.1Low58.9Low89 Ų89109.4 Ų109.442%0.41654%0.539SS..Hα-helixtrans-74.9-40.6178.4-162.4171.66.700112.1T200 K201 G207 I208T200-Q204 WeakPolarHBondContact O-CB 3.23Å; T200-Q204 PolarHBondContact O-N 3.1Å; K201-Q204 PolarHBondContact O-N 3.04Å; Q204-G207 PolarHBondContact O-N 3.42Å; Q204-I208 WeakPolarHBondContact O-CG1 3.18Å; Q204-I208 PolarHBondContact O-N 3.35Å
205E57.3Low60.4Low125 Ų125103.6 Ų103.658%0.58451%0.511SS*.Hα-helixtrans-61.1-44.8171.1-77178.3169.400111.3K201 G207 I208 E209K201-E205 WeakPolarHBondContact O-CB 3.22Å; K201-E205 WeakPolarHBondContact O-CG 3.4Å; K201-E205 PolarHBondContact O-N 2.98Å; E205-G207 VanDerWaalsContact C-N 3.31Å; E205-G207 PolarHBondContact O-N 3.27Å; E205-I208 PolarHBondContact O-N 2.91Å; E205-E209 WeakPolarHBondContact O-CB 3.44Å; E205-E209 PolarHBondContact O-N 2.85Å
206N61.2Low62.2Low95 Ų95101.3 Ų101.351%0.50849%0.494SS..Hα-helixtrans-62.7-35.2176-69.9-14.9000112.7L202 Y210L202-N206 VanDerWaalsContact O-CB 3.28Å; L202-N206 WeakPolarHBondContact O-CB 3.41Å; L202-N206 PolarHBondContact O-N 2.96Å; L202-N206 PolarHBondContact O-ND2 3.09Å; L202-N206 VanDerWaalsContact O-ND2 3.14Å; L202-N206 PolarHBondContact O-OD1 3.06Å; N206-Y210 WeakPolarHBondContact O-CB 3.02Å; N206-Y210 PolarHBondContact O-N 3.26Å
207G66.4Low64.1Low31 Ų3198.9 Ų98.932%0.3248%0.483SS..Hα-helixtrans-70.1-41.3176.500000113.2Q203 Q204 E205 Y210 I211Q203-G207 PolarHBondContact O-N 3.46Å; Q204-G207 PolarHBondContact O-N 3.42Å; E205-G207 VanDerWaalsContact C-N 3.31Å; E205-G207 PolarHBondContact O-N 3.27Å; G207-Y210 PolarHBondContact O-N 2.91Å; G207-I211 VanDerWaalsContact O-CG1 3.29Å; G207-I211 WeakPolarHBondContact O-CG1 3.1Å; G207-I211 PolarHBondContact O-N 3.34Å
208I69.4Low65.9Low60 Ų6097.1 Ų97.131%0.30847%0.473SS..Hα-helixtrans-67.4-39.8175.3-66.7168000110.5Q204 E205 I211 R212Q204-I208 WeakPolarHBondContact O-CG1 3.18Å; Q204-I208 PolarHBondContact O-N 3.35Å; E205-I208 PolarHBondContact O-N 2.91Å; I208-I211 PolarHBondContact O-N 2.97Å; I208-R212 VanDerWaalsContact O-CB 3.29Å; I208-R212 WeakPolarHBondContact O-CB 3.11Å; I208-R212 PolarHBondContact O-N 3.04Å
209E73Confident67.6Low119 Ų11992.3 Ų92.356%0.55644%0.444SS*.Hα-helixtrans-64.9-41.1175.7-168.6167-15700111.6E205 R212 E213E205-E209 WeakPolarHBondContact O-CB 3.44Å; E205-E209 PolarHBondContact O-N 2.85Å; E209-R212 PolarHBondContact O-N 3.41Å; E209-E213 WeakPolarHBondContact O-CB 3.48Å; E209-E213 PolarHBondContact O-N 3.5Å
210Y75.9Confident69.4Low165 Ų16592.7 Ų92.765%0.64744%0.443SS*.Hα-helixtrans-61.6-45.4172.8178.8-96.4000112.7N206 G207 R212 E213 N214N206-Y210 WeakPolarHBondContact O-CB 3.02Å; N206-Y210 PolarHBondContact O-N 3.26Å; G207-Y210 PolarHBondContact O-N 2.91Å; Y210-R212 VanDerWaalsContact C-N 3.34Å; Y210-E213 PolarHBondContact O-N 2.98Å; Y210-N214 WeakPolarHBondContact O-CB 3.48Å; Y210-N214 PolarHBondContact O-N 3.39Å
211I77.1Confident71.2Confident87 Ų8796.4 Ų96.445%0.44646%0.456SS..Hα-helixtrans-62.7-43.4176.3-68.9165.5000110.4L171 G207 I208 N214 S215L171-I211 HydrophobicContact CD2-CG2 4.12Å; G207-I211 VanDerWaalsContact O-CG1 3.29Å; G207-I211 WeakPolarHBondContact O-CG1 3.1Å; G207-I211 PolarHBondContact O-N 3.34Å; I208-I211 PolarHBondContact O-N 2.97Å; I211-N214 PolarHBondContact O-N 3.43Å; I211-S215 WeakPolarHBondContact O-CB 3.36Å; I211-S215 PolarHBondContact O-N 3.27Å; I211-S215 PolarHBondContact O-OG 3.39Å; I211-S215 VanDerWaalsContact O-OG 3.05Å
212R78.1Confident73Confident110 Ų11094 Ų9442%0.41545%0.446SS..Hα-helixtrans-60.4-47.4176.7-176.6-175.3-70.8173.8-1.5111.3I208 E209 Y210 S215 R216I208-R212 VanDerWaalsContact O-CB 3.29Å; I208-R212 WeakPolarHBondContact O-CB 3.11Å; I208-R212 PolarHBondContact O-N 3.04Å; E209-R212 PolarHBondContact O-N 3.41Å; Y210-R212 VanDerWaalsContact C-N 3.34Å; R212-S215 PolarHBondContact O-N 3.46Å; R212-R216 WeakPolarHBondContact O-CB 3.15Å; R212-R216 PolarHBondContact O-N 3.12Å
213E80Confident74.7Confident100 Ų10090.5 Ų90.547%0.46743%0.427SS..Hα-helixtrans-67.6-39.2-178.9-166.3175.8154.700112E209 Y210 R216 K217E209-E213 WeakPolarHBondContact O-CB 3.48Å; E209-E213 PolarHBondContact O-N 3.5Å; Y210-E213 PolarHBondContact O-N 2.98Å; E213-R216 PolarHBondContact O-N 3.41Å; E213-K217 WeakPolarHBondContact O-CG 3.28Å; E213-K217 PolarHBondContact O-N 3.42Å; E213-K217 WeakPolarHBondContact OE1-CE 3.49Å; E213-K217 IonicContact OE1-NZ 3.21Å; E213-K217 PolarHBondContact OE1-NZ 3.49Å
214N82.4Confident76.5Confident74 Ų7486.6 Ų86.640%0.39642%0.415SS..Hα-helixtrans-66.2-44175.4-167.652.6000112Y210 I211 R216 K217 I218Y210-N214 WeakPolarHBondContact O-CB 3.48Å; Y210-N214 PolarHBondContact O-N 3.39Å; I211-N214 PolarHBondContact O-N 3.43Å; N214-R216 VanDerWaalsContact C-N 3.32Å; N214-R216 PolarHBondContact O-N 2.9Å; N214-K217 PolarHBondContact O-N 3.12Å; N214-I218 VanDerWaalsContact O-CG1 3.31Å; N214-I218 WeakPolarHBondContact O-CG1 3.34Å; N214-I218 PolarHBondContact O-N 3.1Å
215S79.2Confident78.3Confident39 Ų3986 Ų8627%0.27341%0.414SS..Hα-helixtrans-60.3-42.1173.7-66.30000111.6I211 R212 K217 I218 T219I211-S215 WeakPolarHBondContact O-CB 3.36Å; I211-S215 PolarHBondContact O-N 3.27Å; I211-S215 PolarHBondContact O-OG 3.39Å; I211-S215 VanDerWaalsContact O-OG 3.05Å; R212-S215 PolarHBondContact O-N 3.46Å; S215-K217 PolarHBondContact O-N 3.36Å; S215-I218 PolarHBondContact O-N 2.99Å; S215-T219 WeakPolarHBondContact O-CB 3.41Å; S215-T219 PolarHBondContact O-N 3.09Å; S215-T219 PolarHBondContact O-OG1 3.42Å
216R81Confident79.7Confident137 Ų13780.7 Ų80.752%0.51739%0.39SS..Hα-helixtrans-61.9-43.5176.9-152.8-175.693.2-178.12.8111.9R212 E213 N214 T219 E220R212-R216 WeakPolarHBondContact O-CB 3.15Å; R212-R216 PolarHBondContact O-N 3.12Å; E213-R216 PolarHBondContact O-N 3.41Å; N214-R216 VanDerWaalsContact C-N 3.32Å; N214-R216 PolarHBondContact O-N 2.9Å; R216-T219 PolarHBondContact O-N 3.28Å; R216-E220 IonicContact CZ-OE1 3.72Å; R216-E220 IonicContact NE-OE1 2.78Å; R216-E220 PolarHBondContact NE-OE1 3.15Å; R216-E220 IonicContact NH2-OE1 2.72Å; R216-E220 PolarHBondContact NH2-OE1 3.35Å; R216-E220 WeakPolarHBondContact O-CB 3.5Å; R216-E220 VanDerWaalsContact O-CG 3.29Å; R216-E220 WeakPolarHBondContact O-CG 3.46Å; R216-E220 PolarHBondContact O-N 3.4Å
217K84.6Confident81.1Confident100 Ų10077.6 Ų77.644%0.43537%0.374SS..Hα-helixtrans-60.9-44.3175.7-76.1172.1-175.9160.60111.9E213 N214 S215 T219 E220 E221E213-K217 WeakPolarHBondContact O-CG 3.28Å; E213-K217 PolarHBondContact O-N 3.42Å; E213-K217 WeakPolarHBondContact OE1-CE 3.49Å; E213-K217 IonicContact OE1-NZ 3.21Å; E213-K217 PolarHBondContact OE1-NZ 3.49Å; N214-K217 PolarHBondContact O-N 3.12Å; S215-K217 PolarHBondContact O-N 3.36Å; K217-T219 PolarHBondContact O-N 2.91Å; K217-E220 PolarHBondContact O-N 3.15Å; K217-E221 WeakPolarHBondContact O-CB 2.96Å; K217-E221 WeakPolarHBondContact O-CG 3.48Å; K217-E221 PolarHBondContact O-N 3.44Å
218I83Confident82.4Confident96 Ų9677.7 Ų77.749%0.49237%0.366SS..Hα-helixtrans-62.3-44.2177.1-66.9164.7000110.9N214 S215 E221 K222N214-I218 VanDerWaalsContact O-CG1 3.31Å; N214-I218 WeakPolarHBondContact O-CG1 3.34Å; N214-I218 PolarHBondContact O-N 3.1Å; S215-I218 PolarHBondContact O-N 2.99Å; I218-E221 PolarHBondContact O-N 2.92Å; I218-K222 WeakPolarHBondContact O-CB 3.34Å; I218-K222 PolarHBondContact O-N 3.4Å
219T79.9Confident83.4Confident6 Ų674.9 Ų74.94%0.03735%0.351CS..Hα-helixtrans-65.2-44.9177.7-64.10000111.1E167 S215 R216 K217 E221 K222 Y223E167-T219 PolarHBondContact OE1-OG1 3.28Å; E167-T219 PolarHBondContact OE2-OG1 2.88Å; E167-T219 VanDerWaalsContact OE2-OG1 3.04Å; S215-T219 WeakPolarHBondContact O-CB 3.41Å; S215-T219 PolarHBondContact O-N 3.09Å; S215-T219 PolarHBondContact O-OG1 3.42Å; R216-T219 PolarHBondContact O-N 3.28Å; K217-T219 PolarHBondContact O-N 2.91Å; T219-E221 PolarHBondContact O-N 3.08Å; T219-K222 WeakPolarHBondContact O-CB 3.4Å; T219-K222 PolarHBondContact O-N 2.87Å; T219-Y223 HydrophobicContact CG2-CD2 3.78Å; T219-Y223 HydrophobicContact CG2-CE2 3.78Å; T219-Y223 VanDerWaalsContact O-CD2 3.26Å; T219-Y223 WeakPolarHBondContact O-CD2 3.27Å; T219-Y223 PolarHBondContact O-N 3.49Å
220E84.3Confident84.3Confident75 Ų7569.2 Ų69.235%0.3533%0.325SS..Hα-helixtrans-59-44.6174.6-75.8172.9-165.600112.3R216 K217 Y223 S224R216-E220 IonicContact CZ-OE1 3.72Å; R216-E220 IonicContact NE-OE1 2.78Å; R216-E220 PolarHBondContact NE-OE1 3.15Å; R216-E220 IonicContact NH2-OE1 2.72Å; R216-E220 PolarHBondContact NH2-OE1 3.35Å; R216-E220 WeakPolarHBondContact O-CB 3.5Å; R216-E220 VanDerWaalsContact O-CG 3.29Å; R216-E220 WeakPolarHBondContact O-CG 3.46Å; R216-E220 PolarHBondContact O-N 3.4Å; K217-E220 PolarHBondContact O-N 3.15Å; E220-Y223 PolarHBondContact O-N 3.03Å; E220-S224 VanDerWaalsContact O-CB 3.28Å; E220-S224 WeakPolarHBondContact O-CB 3.39Å; E220-S224 PolarHBondContact O-N 3.4Å
221E85Confident85.2Confident142 Ų14261.4 Ų61.466%0.66430%0.295SS*.Hα-helixtrans-63-42.5176.6-76.6-177.4178.900112.2K217 I218 T219 S224 L225K217-E221 WeakPolarHBondContact O-CB 2.96Å; K217-E221 WeakPolarHBondContact O-CG 3.48Å; K217-E221 PolarHBondContact O-N 3.44Å; I218-E221 PolarHBondContact O-N 2.92Å; T219-E221 PolarHBondContact O-N 3.08Å; E221-S224 WeakPolarHBondContact O-CB 3.21Å; E221-S224 PolarHBondContact O-N 3.22Å; E221-L225 PolarHBondContact O-N 3.15Å
222K85.6Confident86Confident99 Ų9957.3 Ų57.343%0.4327%0.273SS..Hα-helixtrans-59.8-47.1175.5177-167.9171.8-159.30111.6E163 I218 T219 L225 L226E163-K222 IonicContact OE1-NZ 2.73Å; E163-K222 PolarHBondContact OE1-NZ 3.37Å; E163-K222 IonicContact OE2-NZ 2.77Å; E163-K222 PolarHBondContact OE2-NZ 3.31Å; I218-K222 WeakPolarHBondContact O-CB 3.34Å; I218-K222 PolarHBondContact O-N 3.4Å; T219-K222 WeakPolarHBondContact O-CB 3.4Å; T219-K222 PolarHBondContact O-N 2.87Å; K222-L225 PolarHBondContact O-N 3.49Å; K222-L226 WeakPolarHBondContact O-CB 3.43Å; K222-L226 PolarHBondContact O-N 3.02Å
223Y85.6Confident86.8Confident12 Ų1252 Ų525%0.04725%0.254CS..Hα-helixtrans-73.1-29.4179-82-80.4000113.2L159 Q160 E163 T219 E220 L226 T227L159-Y223 HydrophobicContact CB-CE1 3.81Å; L159-Y223 PolarHBondContact O-OH 3.24Å; L159-Y223 VanDerWaalsContact O-OH 3.13Å; Q160-Y223 VanDerWaalsContact CA-CZ 3.43Å; Q160-Y223 HydrophobicContact CB-CD1 3.71Å; Q160-Y223 HydrophobicContact CB-CD2 3.74Å; Q160-Y223 HydrophobicContact CB-CE1 3.87Å; Q160-Y223 HydrophobicContact CB-CE2 3.9Å; Q160-Y223 HydrophobicContact CB-CG 3.66Å; Q160-Y223 HydrophobicContact CG-CD1 4.37Å; Q160-Y223 HydrophobicContact CG-CD2 3.59Å; Q160-Y223 HydrophobicContact CG-CE2 4.04Å; Q160-Y223 HydrophobicContact CG-CG 3.79Å; E163-Y223 HydrophobicContact CB-CE2 4.28Å; E163-Y223 WeakPolarHBondContact OE2-CE2 3.35Å; E163-Y223 PolarHBondContact OE2-OH 3.15Å; T219-Y223 HydrophobicContact CG2-CD2 3.78Å; T219-Y223 HydrophobicContact CG2-CE2 3.78Å; T219-Y223 VanDerWaalsContact O-CD2 3.26Å; T219-Y223 WeakPolarHBondContact O-CD2 3.27Å; T219-Y223 PolarHBondContact O-N 3.49Å; E220-Y223 PolarHBondContact O-N 3.03Å; Y223-L226 HydrophobicContact CD1-CD2 4.21Å; Y223-L226 HydrophobicContact CE1-CD2 4.23Å; Y223-L226 PolarHBondContact O-N 2.81Å; Y223-T227 VanDerWaalsContact O-CB 3.32Å; Y223-T227 WeakPolarHBondContact O-CB 3.47Å; Y223-T227 PolarHBondContact O-N 2.64Å; Y223-T227 PolarHBondContact O-OG1 3.17Å
224S87.4Confident87.5Confident58 Ų5847.3 Ų47.341%0.40623%0.231SC..Hα-helixtrans-61.8-47.4169.8-178.80000111.1E220 E221 L226 T227 K228E220-S224 VanDerWaalsContact O-CB 3.28Å; E220-S224 WeakPolarHBondContact O-CB 3.39Å; E220-S224 PolarHBondContact O-N 3.4Å; E221-S224 WeakPolarHBondContact O-CB 3.21Å; E221-S224 PolarHBondContact O-N 3.22Å; S224-L226 PolarHBondContact O-N 3.22Å; S224-T227 PolarHBondContact O-N 2.98Å; S224-K228 WeakPolarHBondContact O-CG 3.49Å; S224-K228 PolarHBondContact O-N 3.18Å; S224-K228 VanDerWaalsContact O-N 3.1Å
225L88.3Confident88.1Confident77 Ų7743.8 Ų43.840%0.40321%0.213SC..Hα-helixtrans-63.2-42176-172.767.6000112E221 K222 T227 K228 G229 F298E221-L225 PolarHBondContact O-N 3.15Å; K222-L225 PolarHBondContact O-N 3.49Å; L225-T227 VanDerWaalsContact C-N 3.35Å; L225-K228 PolarHBondContact O-N 3.16Å; L225-G229 PolarHBondContact O-N 3.18Å; L225-F298 HydrophobicContact CD1-CD1 3.6Å; L225-F298 HydrophobicContact CD1-CE1 4.07Å; L225-F298 VanDerWaalsContact CD2-O 3.26Å; L225-F298 WeakPolarHBondContact CD2-O 3.13Å; L225-F298 HydrophobicContact CG-CD1 3.95Å; L225-F298 WeakPolarHBondContact O-CD1 3.31Å
226L87.1Confident88.9Confident13 Ų1341.9 Ų41.97%0.06820%0.2CC..Hα-helixtrans-64.8-38.4177.1-174.360.8000112P121 M125 L156 K222 Y223 S224 G229 M230P121-L226 HydrophobicContact CB-CD1 4.26Å; P121-L226 HydrophobicContact CB-CD2 4.32Å; M125-L226 HydrophobicContact SD-CD1 4.49Å; L156-L226 HydrophobicContact CD2-CD2 3.45Å; L156-L226 VanDerWaalsContact CD2-CD2 3.45Å; L156-L226 HydrophobicContact CD2-CG 3.65Å; K222-L226 WeakPolarHBondContact O-CB 3.43Å; K222-L226 PolarHBondContact O-N 3.02Å; Y223-L226 HydrophobicContact CD1-CD2 4.21Å; Y223-L226 HydrophobicContact CE1-CD2 4.23Å; Y223-L226 PolarHBondContact O-N 2.81Å; S224-L226 PolarHBondContact O-N 3.22Å; L226-G229 PolarHBondContact O-N 3.23Å; L226-M230 HydrophobicContact CD1-CG 4.24Å; L226-M230 HydrophobicContact CG-CG 4.36Å; L226-M230 WeakPolarHBondContact O-CB 3.37Å; L226-M230 VanDerWaalsContact O-CG 3.26Å; L226-M230 WeakPolarHBondContact O-CG 3.45Å; L226-M230 PolarHBondContact O-N 3.05Å
227T90.8Very high89.7Confident30 Ų3035.4 Ų35.418%0.18418%0.175CC..Hα-helixtrans-63.3-42.8176.4-61.40000111.5Y223 S224 L225 S231Y223-T227 VanDerWaalsContact O-CB 3.32Å; Y223-T227 WeakPolarHBondContact O-CB 3.47Å; Y223-T227 PolarHBondContact O-N 2.64Å; Y223-T227 PolarHBondContact O-OG1 3.17Å; S224-T227 PolarHBondContact O-N 2.98Å; L225-T227 VanDerWaalsContact C-N 3.35Å; T227-S231 WeakPolarHBondContact O-CB 3.49Å; T227-S231 PolarHBondContact O-N 3.4Å; T227-S231 PolarHBondContact O-OG 3.33Å
228K91.9Very high90.2Very high33 Ų3330.6 Ų30.614%0.14315%0.154CC..Hα-helixtrans-60.1-50.7172.9-69.3-179.2177.6-161.40111.5S224 L225 M230 S231 L232 F298 G551 N552 L553 D557S224-K228 WeakPolarHBondContact O-CG 3.49Å; S224-K228 PolarHBondContact O-N 3.18Å; S224-K228 VanDerWaalsContact O-N 3.1Å; L225-K228 PolarHBondContact O-N 3.16Å; K228-M230 PolarHBondContact O-N 3.22Å; K228-S231 PolarHBondContact O-N 2.88Å; K228-L232 WeakPolarHBondContact O-CG 3.27Å; K228-L232 PolarHBondContact O-N 3.09Å; K228-F298 HydrophobicContact CB-CD1 4.49Å; K228-F298 HydrophobicContact CB-CE1 3.86Å; K228-G551 WeakPolarHBondContact CG-O 3.26Å; K228-N552 WeakPolarHBondContact CE-O 3.42Å; K228-L553 HydrophobicContact CB-CD2 3.64Å; K228-L553 HydrophobicContact CD-CD2 4.31Å; K228-L553 HydrophobicContact CG-CD2 3.77Å; K228-D557 IonicContact NZ-OD2 2.72Å; K228-D557 PolarHBondContact NZ-OD2 2.92Å
229G92.2Very high90.8Very high0 Ų026.1 Ų26.10%013%0.131CC..Hα-helixtrans-59.7-46.2-179.900000112.6L225 L226 L232 S233 F298L225-G229 PolarHBondContact O-N 3.18Å; L226-G229 PolarHBondContact O-N 3.23Å; G229-L232 PolarHBondContact O-N 3.37Å; G229-S233 WeakPolarHBondContact O-CB 3.49Å; G229-S233 PolarHBondContact O-N 2.96Å; G229-S233 PolarHBondContact O-OG 3.19Å; G229-F298 VanDerWaalsContact CA-CD2 3.49Å
230M91.4Very high91.6Very high0 Ų025.8 Ų25.80%013%0.129CC..Hα-helixtrans-64.2-41.3177.4-74.9-69.4-73.800112.6L124 M125 F128 S152 L156 L226 K228 S233 V234L124-M230 HydrophobicContact CD2-CE 4.27Å; L124-M230 HydrophobicContact CG-CE 4.04Å; M125-M230 VanDerWaalsContact CA-SD 3.53Å; M125-M230 HydrophobicContact CB-SD 3.93Å; M125-M230 HydrophobicContact CG-CG 4.13Å; M125-M230 HydrophobicContact CG-SD 3.16Å; M125-M230 WeakPolarHBondContact CG-SD 3.21Å; F128-M230 HydrophobicContact CB-CE 3.96Å; F128-M230 HydrophobicContact CD1-CE 4.43Å; F128-M230 HydrophobicContact CD2-CE 3.25Å; F128-M230 HydrophobicContact CE2-CE 3.76Å; F128-M230 HydrophobicContact CG-CE 3.62Å; S152-M230 VanDerWaalsContact OG-CE 3.28Å; S152-M230 WeakPolarHBondContact OG-CE 3.44Å; L156-M230 HydrophobicContact CD1-CB 3.85Å; L156-M230 HydrophobicContact CD1-CG 3.82Å; L156-M230 HydrophobicContact CD2-CG 4.17Å; L156-M230 HydrophobicContact CG-CG 4.4Å; L226-M230 HydrophobicContact CD1-CG 4.24Å; L226-M230 HydrophobicContact CG-CG 4.36Å; L226-M230 WeakPolarHBondContact O-CB 3.37Å; L226-M230 VanDerWaalsContact O-CG 3.26Å; L226-M230 WeakPolarHBondContact O-CG 3.45Å; L226-M230 PolarHBondContact O-N 3.05Å; K228-M230 PolarHBondContact O-N 3.22Å; M230-S233 WeakPolarHBondContact O-CB 3.31Å; M230-S233 PolarHBondContact O-N 3.28Å; M230-V234 WeakPolarHBondContact O-CG2 3.24Å; M230-V234 PolarHBondContact O-N 2.92Å
231S93.8Very high92.2Very high2 Ų222.2 Ų22.21%0.01411%0.113CC..Hα-helixtrans-63.8-44.1179.4-57.50000111.5T227 K228 V234 C235 G551T227-S231 WeakPolarHBondContact O-CB 3.49Å; T227-S231 PolarHBondContact O-N 3.4Å; T227-S231 PolarHBondContact O-OG 3.33Å; K228-S231 PolarHBondContact O-N 2.88Å; S231-V234 PolarHBondContact O-N 3.07Å; S231-C235 PolarHBondContact O-N 3.38Å; S231-C235 VanDerWaalsContact O-N 3.15Å; S231-G551 WeakPolarHBondContact OG-CA 3.41Å
232L94.6Very high92.7Very high0 Ų015.5 Ų15.50%08%0.081CC..Hα-helixtrans-66-41.1174.4-69.9-178.9000112.3K228 G229 V234 C235 Y236 F298 L553 M558 A561K228-L232 WeakPolarHBondContact O-CG 3.27Å; K228-L232 PolarHBondContact O-N 3.09Å; G229-L232 PolarHBondContact O-N 3.37Å; L232-V234 VanDerWaalsContact C-N 3.32Å; L232-V234 PolarHBondContact O-N 3.04Å; L232-C235 PolarHBondContact O-N 3.48Å; L232-C235 PolarHBondContact O-SG 3.38Å; L232-Y236 HydrophobicContact CB-CD2 4.1Å; L232-Y236 HydrophobicContact CB-CE2 3.82Å; L232-Y236 HydrophobicContact CD1-CE2 4.37Å; L232-Y236 HydrophobicContact CD2-CE1 4.44Å; L232-Y236 HydrophobicContact CD2-CE2 4.01Å; L232-Y236 HydrophobicContact CG-CE2 4.29Å; L232-Y236 VanDerWaalsContact O-CB 3.31Å; L232-Y236 WeakPolarHBondContact O-CB 3.46Å; L232-Y236 WeakPolarHBondContact O-CD2 3.37Å; L232-Y236 PolarHBondContact O-N 3.09Å; L232-F298 HydrophobicContact CD1-CE2 3.94Å; L232-F298 HydrophobicContact CD1-CZ 3.63Å; L232-L553 HydrophobicContact CD1-CD2 4.03Å; L232-L553 HydrophobicContact CD2-CD1 3.52Å; L232-L553 HydrophobicContact CD2-CD2 4.26Å; L232-L553 HydrophobicContact CG-CD1 3.89Å; L232-L553 HydrophobicContact CG-CD2 3.92Å; L232-M558 HydrophobicContact CD2-CE 4.17Å; L232-M558 HydrophobicContact CD2-CG 4.14Å; L232-A561 HydrophobicContact CD1-CB 4Å
233S94.9Very high93.2Very high0 Ų010.8 Ų10.80%06%0.061CC..Hα-helixtrans-55.5-46.1174.1-82.40000112M125 M129 G229 M230 S237 L294M125-S233 WeakPolarHBondContact CE-OG 3.35Å; M129-S233 PolarHBondContact SD-OG 3.47Å; G229-S233 WeakPolarHBondContact O-CB 3.49Å; G229-S233 PolarHBondContact O-N 2.96Å; G229-S233 PolarHBondContact O-OG 3.19Å; M230-S233 WeakPolarHBondContact O-CB 3.31Å; M230-S233 PolarHBondContact O-N 3.28Å; S233-S237 WeakPolarHBondContact O-CB 3.23Å; S233-S237 PolarHBondContact O-N 2.88Å; S233-S237 PolarHBondContact O-OG 3.34Å; S233-L294 WeakPolarHBondContact OG-CD1 3.42Å
234V95.3Very high93.7Very high0 Ų010.2 Ų10.20%06%0.058CC..Hα-helixtrans-66.5-49.2179.7170.90000111.9F128 T145 M148 L149 M230 S231 L232 S237 A238F128-V234 HydrophobicContact CB-CG2 4.11Å; F128-V234 HydrophobicContact CD1-CG2 4.07Å; F128-V234 HydrophobicContact CG-CG2 4.48Å; T145-V234 HydrophobicContact CG2-CG1 4.38Å; M148-V234 HydrophobicContact CB-CG1 3.58Å; M148-V234 HydrophobicContact CB-CG2 4.46Å; L149-V234 HydrophobicContact CD2-CB 3.94Å; L149-V234 HydrophobicContact CD2-CG1 4.05Å; L149-V234 HydrophobicContact CD2-CG2 4.45Å; L149-V234 HydrophobicContact CG-CB 4.42Å; L149-V234 HydrophobicContact CG-CG1 3.98Å; M230-V234 WeakPolarHBondContact O-CG2 3.24Å; M230-V234 PolarHBondContact O-N 2.92Å; S231-V234 PolarHBondContact O-N 3.07Å; L232-V234 VanDerWaalsContact C-N 3.32Å; L232-V234 PolarHBondContact O-N 3.04Å; V234-S237 PolarHBondContact O-OG 2.88Å; V234-A238 WeakPolarHBondContact O-CB 3.43Å; V234-A238 PolarHBondContact O-N 3.43Å
235C95.4Very high94Very high0 Ų07.4 Ų7.40%04%0.039CC..Hα-helixtrans-68.1-41.5-177.764.90000112.8T145 S231 L232 A238 S239 P543 A547T145-C235 HydrophobicContact CG2-CB 4.07Å; S231-C235 PolarHBondContact O-N 3.38Å; S231-C235 VanDerWaalsContact O-N 3.15Å; L232-C235 PolarHBondContact O-N 3.48Å; L232-C235 PolarHBondContact O-SG 3.38Å; C235-A238 PolarHBondContact O-N 3.46Å; C235-S239 PolarHBondContact O-N 2.77Å; C235-S239 VanDerWaalsContact O-N 3.1Å; C235-S239 PolarHBondContact O-OG 3.2Å; C235-P543 HydrophobicContact CB-CB 4.12Å; C235-A547 HydrophobicContact CB-CB 3.61Å; C235-A547 VanDerWaalsContact SG-CB 3.57Å
236Y96Very high94.1Very high0 Ų03.8 Ų3.80%02%0.02CC..Hα-helixtrans-68.4-41.4179.1-61.9-28.4000111.4L232 A238 S239 I240 L294 F535 M558 A561 L565L232-Y236 HydrophobicContact CB-CD2 4.1Å; L232-Y236 HydrophobicContact CB-CE2 3.82Å; L232-Y236 HydrophobicContact CD1-CE2 4.37Å; L232-Y236 HydrophobicContact CD2-CE1 4.44Å; L232-Y236 HydrophobicContact CD2-CE2 4.01Å; L232-Y236 HydrophobicContact CG-CE2 4.29Å; L232-Y236 VanDerWaalsContact O-CB 3.31Å; L232-Y236 WeakPolarHBondContact O-CB 3.46Å; L232-Y236 WeakPolarHBondContact O-CD2 3.37Å; L232-Y236 PolarHBondContact O-N 3.09Å; Y236-A238 VanDerWaalsContact C-N 3.32Å; Y236-A238 PolarHBondContact O-N 3.39Å; Y236-S239 PolarHBondContact O-N 3.27Å; Y236-I240 WeakPolarHBondContact O-CB 3.34Å; Y236-I240 WeakPolarHBondContact O-CD1 3.14Å; Y236-I240 WeakPolarHBondContact O-CG1 3.32Å; Y236-I240 PolarHBondContact O-N 3.34Å; Y236-L294 HydrophobicContact CD2-CD1 4.13Å; Y236-L294 HydrophobicContact CD2-CD2 4.2Å; Y236-L294 HydrophobicContact CE2-CD2 4.2Å; Y236-F535 HydrophobicContact CD1-CB 4.15Å; Y236-F535 AromaticContact CD1-CD1 3.5Å; Y236-F535 HydrophobicContact CD1-CD1 3.5Å; Y236-F535 VanDerWaalsContact CD1-CD1 3.5Å; Y236-F535 HydrophobicContact CD1-CE1 4.21Å; Y236-F535 HydrophobicContact CD1-CG 4.08Å; Y236-F535 HydrophobicContact CE1-CB 3.74Å; Y236-F535 AromaticContact CE1-CD1 3.97Å; Y236-F535 HydrophobicContact CE1-CD1 3.97Å; Y236-F535 HydrophobicContact CE1-CG 4.2Å; Y236-F535 WeakPolarHBondContact CE1-O 3.5Å; Y236-F535 HydrophobicContact CG-CD1 4.21Å; Y236-F535 PolarHBondContact OH-O 2.86Å; Y236-M558 HydrophobicContact CE1-CE 3.78Å; Y236-M558 WeakPolarHBondContact OH-CG 3.39Å; Y236-M558 PolarHBondContact OH-O 3.45Å; Y236-A561 HydrophobicContact CE2-CB 4.06Å; Y236-L565 HydrophobicContact CD1-CD1 4.41Å; Y236-L565 HydrophobicContact CD2-CD1 3.11Å; Y236-L565 HydrophobicContact CE2-CD1 3.24Å; Y236-L565 HydrophobicContact CG-CD1 3.73Å
237S96.4Very high94.2Very high0 Ų04.1 Ų4.10%02%0.022CC..Hα-helixtrans-65.2-33.4175.558.10000113.2M129 S132 A133 S233 V234 G241M129-S237 VanDerWaalsContact O-CB 3.31Å; M129-S237 WeakPolarHBondContact O-CB 3.4Å; S132-S237 VanDerWaalsContact CB-OG 3.23Å; S132-S237 WeakPolarHBondContact CB-OG 3.43Å; A133-S237 VanDerWaalsContact CA-O 3.31Å; A133-S237 WeakPolarHBondContact CA-O 3.48Å; A133-S237 WeakPolarHBondContact CB-O 3.26Å; S233-S237 WeakPolarHBondContact O-CB 3.23Å; S233-S237 PolarHBondContact O-N 2.88Å; S233-S237 PolarHBondContact O-OG 3.34Å; V234-S237 PolarHBondContact O-OG 2.88Å; S237-G241 PolarHBondContact O-N 3.49Å
238A96.1Very high94.2Very high0 Ų02.9 Ų2.90%02%0.016CC..Hα-helixtrans-62.4-50.7171.900000111.1S136 N141 T144 T145 V234 C235 Y236 I240 G241 G242S136-A238 WeakPolarHBondContact CB-O 3.36Å; S136-A238 PolarHBondContact OG-O 3.48Å; N141-A238 HydrophobicContact CB-CB 4.46Å; N141-A238 PolarHBondContact OD1-O 3.06Å; T144-A238 HydrophobicContact CG2-CB 4.25Å; T145-A238 WeakPolarHBondContact OG1-CB 3.48Å; V234-A238 WeakPolarHBondContact O-CB 3.43Å; V234-A238 PolarHBondContact O-N 3.43Å; C235-A238 PolarHBondContact O-N 3.46Å; Y236-A238 VanDerWaalsContact C-N 3.32Å; Y236-A238 PolarHBondContact O-N 3.39Å; A238-I240 PolarHBondContact O-N 2.98Å; A238-G241 PolarHBondContact O-N 3.11Å; A238-G242 PolarHBondContact O-N 3.19Å
239S95.6Very high94.2Very high1 Ų12 Ų21%0.0071%0.014CC..Hα-helixtrans-60.9-42.6177-67.10000113C235 Y236C235-S239 PolarHBondContact O-N 2.77Å; C235-S239 VanDerWaalsContact O-N 3.1Å; C235-S239 PolarHBondContact O-OG 3.2Å; Y236-S239 PolarHBondContact O-N 3.27Å
240I96.8Very high94.1Very high0 Ų02.7 Ų2.70%02%0.017CC..Hα-helixtrans-61.4-47.2174.5-70.4169.1000110.7Y236 A238 G242 T243 M283 M286 L287 S290 F535Y236-I240 WeakPolarHBondContact O-CB 3.34Å; Y236-I240 WeakPolarHBondContact O-CD1 3.14Å; Y236-I240 WeakPolarHBondContact O-CG1 3.32Å; Y236-I240 PolarHBondContact O-N 3.34Å; A238-I240 PolarHBondContact O-N 2.98Å; I240-G242 VanDerWaalsContact C-N 3.34Å; I240-G242 PolarHBondContact O-N 2.72Å; I240-T243 WeakPolarHBondContact O-CB 3.36Å; I240-T243 PolarHBondContact O-N 3.34Å; I240-T243 VanDerWaalsContact O-N 3.16Å; I240-T243 PolarHBondContact O-OG1 3.37Å; I240-M283 HydrophobicContact CG2-CG 3.78Å; I240-M283 HydrophobicContact CG2-SD 4.41Å; I240-M283 VanDerWaalsContact O-CG 3.3Å; I240-M283 WeakPolarHBondContact O-CG 3.47Å; I240-M286 HydrophobicContact CB-CE 3.89Å; I240-M286 HydrophobicContact CD1-CG 4.07Å; I240-M286 HydrophobicContact CG1-CE 3.64Å; I240-M286 HydrophobicContact CG1-CG 4.17Å; I240-M286 HydrophobicContact CG1-SD 4.15Å; I240-M286 HydrophobicContact CG2-CB 4.45Å; I240-M286 HydrophobicContact CG2-CE 3.66Å; I240-M286 HydrophobicContact CG2-CG 4.43Å; I240-L287 HydrophobicContact CG2-CB 4.13Å; I240-L287 HydrophobicContact CG2-CD1 4.14Å; I240-S290 WeakPolarHBondContact CD1-OG 3.38Å; I240-F535 HydrophobicContact CD1-CZ 4.35Å; I240-F535 HydrophobicContact CG1-CE1 4.38Å; I240-F535 HydrophobicContact CG1-CZ 3.82Å
241G96.3Very high94.2Very high0 Ų02.7 Ų2.70%02%0.017CC..Hα-helixtrans-61.2-39.5-178.900000113.5A133 M137 S237 A238 T243 A244A133-G241 WeakPolarHBondContact O-CA 3.28Å; M137-G241 WeakPolarHBondContact CG-O 3.41Å; S237-G241 PolarHBondContact O-N 3.49Å; A238-G241 PolarHBondContact O-N 3.11Å; G241-T243 PolarHBondContact O-N 3.02Å; G241-T243 VanDerWaalsContact O-N 3.07Å; G241-A244 WeakPolarHBondContact O-CB 3.3Å; G241-A244 PolarHBondContact O-N 3.16Å; G241-A244 VanDerWaalsContact O-N 3.1Å
242G95Very high94.3Very high0 Ų02.6 Ų2.60%02%0.017CC..THydrogen-bonded Turntrans-60.1-18.417700000114.3S136 A238 I240 G248 T249 N252S136-G242 WeakPolarHBondContact O-CA 3.4Å; A238-G242 PolarHBondContact O-N 3.19Å; I240-G242 VanDerWaalsContact C-N 3.34Å; I240-G242 PolarHBondContact O-N 2.72Å; G242-G248 CarbonylContact O-C 3.5Å; G242-G248 WeakPolarHBondContact O-CA 3.44Å; G242-T249 WeakPolarHBondContact O-CG2 3.49Å; G242-T249 PolarHBondContact O-N 3.11Å; G242-N252 PolarHBondContact O-ND2 3.03Å
243T95.7Very high94.1Very high0 Ų02.6 Ų2.60%02%0.017CC..THydrogen-bonded Turntrans-76-21.7177.369.20000113.5I240 G241 T245 N252 W275 A279 I529I240-T243 WeakPolarHBondContact O-CB 3.36Å; I240-T243 PolarHBondContact O-N 3.34Å; I240-T243 VanDerWaalsContact O-N 3.16Å; I240-T243 PolarHBondContact O-OG1 3.37Å; G241-T243 PolarHBondContact O-N 3.02Å; G241-T243 VanDerWaalsContact O-N 3.07Å; T243-T245 PolarHBondContact O-N 2.86Å; T243-N252 PolarHBondContact O-ND2 3.34Å; T243-W275 PolarHBondContact O-NE1 3.42Å; T243-A279 VanDerWaalsContact O-CB 3.32Å; T243-A279 WeakPolarHBondContact O-CB 3.22Å; T243-I529 HydrophobicContact CG2-CG2 3.95Å
244A95.9Very high93.9Very high0 Ų02.6 Ų2.60%02%0.017CC..SBendtrans-71.1-33-168.700000114.7M137 G241 F280 M283M137-A244 HydrophobicContact CE-CB 4.04Å; M137-A244 HydrophobicContact CG-CB 3.97Å; M137-A244 HydrophobicContact SD-CB 3.98Å; G241-A244 WeakPolarHBondContact O-CB 3.3Å; G241-A244 PolarHBondContact O-N 3.16Å; G241-A244 VanDerWaalsContact O-N 3.1Å; A244-F280 HydrophobicContact CB-CB 4.48Å; A244-F280 HydrophobicContact CB-CD2 4.25Å; A244-M283 HydrophobicContact CB-CB 3.98Å; A244-M283 HydrophobicContact CB-CE 4.08Å; A244-M283 HydrophobicContact CB-CG 3.98Å
245T93.8Very high93.8Very high0 Ų02.6 Ų2.60%02%0.017CC..SBendtrans-119.9153.3-174.349.90000110.2M137 W138 T243 T247 G248 N252 F272 F276M137-T245 WeakPolarHBondContact CA-OG1 3.19Å; M137-T245 HydrophobicContact CB-CG2 3.88Å; M137-T245 PolarHBondContact O-OG1 3.07Å; W138-T245 HydrophobicContact CE3-CG2 4.38Å; W138-T245 HydrophobicContact CH2-CG2 3.91Å; W138-T245 HydrophobicContact CZ2-CG2 4.28Å; W138-T245 HydrophobicContact CZ3-CG2 3.97Å; T243-T245 PolarHBondContact O-N 2.86Å; T245-T247 VanDerWaalsContact C-N 3.28Å; T245-T247 PolarHBondContact O-N 2.98Å; T245-G248 PolarHBondContact O-N 3Å; T245-G248 VanDerWaalsContact O-N 3.12Å; T245-G248 WeakPolarHBondContact OG1-CA 3.46Å; T245-G248 PolarHBondContact OG1-N 3.16Å; T245-N252 PolarHBondContact O-ND2 3.34Å; T245-F272 HydrophobicContact CG2-CZ 4.12Å; T245-F276 HydrophobicContact CG2-CD2 3.95Å; T245-F276 HydrophobicContact CG2-CE2 4.14Å
246L91.1Very high93.6Very high0 Ų02.7 Ų2.70%02%0.017CC..THydrogen-bonded Turntrans-62.4-39.6-177.2-155.949.6000111.3L89 G248 N252 L253 Q256 F272 W275L89-L246 HydrophobicContact CD2-CD2 3.93Å; L89-L246 HydrophobicContact CD2-CG 4.3Å; L246-G248 VanDerWaalsContact C-N 3.34Å; L246-G248 PolarHBondContact O-N 3.41Å; L246-N252 HydrophobicContact CD1-CB 4.05Å; L246-N252 WeakPolarHBondContact CD1-O 3.47Å; L246-N252 WeakPolarHBondContact O-CB 3.27Å; L246-L253 HydrophobicContact CG-CD2 4.14Å; L246-L253 VanDerWaalsContact O-CG 3.3Å; L246-L253 WeakPolarHBondContact O-CG 3.37Å; L246-Q256 HydrophobicContact CD1-CB 4.18Å; L246-Q256 HydrophobicContact CD2-CG 4.36Å; L246-F272 HydrophobicContact CB-CD2 4.01Å; L246-F272 HydrophobicContact CB-CE2 4.41Å; L246-W275 HydrophobicContact CB-CG 4.37Å; L246-W275 HydrophobicContact CD1-CB 4.23Å; L246-W275 HydrophobicContact CD1-CD2 3.85Å; L246-W275 HydrophobicContact CD1-CE3 4.22Å; L246-W275 HydrophobicContact CD1-CG 3.83Å
247T90Very high93.3Very high20 Ų202.8 Ų2.812%0.1232%0.019CC..THydrogen-bonded Turntrans-82.6-3.5178.258.50000114.9L89 T245 W351L89-T247 HydrophobicContact CD1-CG2 4.31Å; L89-T247 HydrophobicContact CG-CG2 4.44Å; T245-T247 VanDerWaalsContact C-N 3.28Å; T245-T247 PolarHBondContact O-N 2.98Å; T247-W351 HydrophobicContact CG2-CH2 3.68Å; T247-W351 HydrophobicContact CG2-CZ2 4.22Å; T247-W351 HydrophobicContact CG2-CZ3 4.47Å
248G90Very high92.9Very high5 Ų52.8 Ų2.85%0.0522%0.019CC..THydrogen-bonded Turntrans-69.2-42.2-173.800000113.2G242 T245 L246G242-G248 CarbonylContact O-C 3.5Å; G242-G248 WeakPolarHBondContact O-CA 3.44Å; T245-G248 PolarHBondContact O-N 3Å; T245-G248 VanDerWaalsContact O-N 3.12Å; T245-G248 WeakPolarHBondContact OG1-CA 3.46Å; T245-G248 PolarHBondContact OG1-N 3.16Å; L246-G248 VanDerWaalsContact C-N 3.34Å; L246-G248 PolarHBondContact O-N 3.41Å
249T91.9Very high92.6Very high15 Ų152.9 Ų2.99%0.0922%0.019CC..SBendtrans-142.2147.9178.2-168.30000111.3G242 P251 N252G242-T249 WeakPolarHBondContact O-CG2 3.49Å; G242-T249 PolarHBondContact O-N 3.11Å; T249-P251 HydrophobicContact CG2-CB 4.45Å; T249-P251 HydrophobicContact CG2-CG 4.47Å; T249-P251 WeakPolarHBondContact OG1-CD 3.32Å; T249-N252 WeakPolarHBondContact CG2-OD1 3.49Å; T249-N252 WeakPolarHBondContact O-CB 3.41Å; T249-N252 PolarHBondContact O-N 2.92Å
250T90.4Very high92.1Very high13 Ų135.7 Ų5.78%0.083%0.032CC..Hα-helixtrans-58.3-41-174.6-39.50000114.7N252 L253 I254 I443 L447 T499T250-N252 PolarHBondContact O-N 3.47Å; T250-N252 VanDerWaalsContact O-N 3.12Å; T250-L253 PolarHBondContact O-N 3.37Å; T250-I254 HydrophobicContact CG2-CD1 4.27Å; T250-I254 HydrophobicContact CG2-CG1 4.32Å; T250-I254 PolarHBondContact O-N 3.3Å; T250-I443 HydrophobicContact CG2-CG2 3.28Å; T250-I443 WeakPolarHBondContact OG1-CG2 3.4Å; T250-L447 HydrophobicContact CG2-CD1 4.32Å; T250-L447 HydrophobicContact CG2-CD2 4.03Å; T250-L447 HydrophobicContact CG2-CG 4.13Å; T250-T499 WeakPolarHBondContact CB-OG1 3.25Å; T250-T499 HydrophobicContact CG2-CG2 3.5Å; T250-T499 VanDerWaalsContact CG2-CG2 3.5Å
251P93.8Very high91.5Very high0 Ų08.7 Ų8.70%05%0.045CC..Hα-helixtrans-45.3-41.4173.8-36.440000114.8T249 L253 I254 L255 N498 T502 T528T249-P251 HydrophobicContact CG2-CB 4.45Å; T249-P251 HydrophobicContact CG2-CG 4.47Å; T249-P251 WeakPolarHBondContact OG1-CD 3.32Å; P251-L253 VanDerWaalsContact C-N 3.33Å; P251-L253 PolarHBondContact O-N 2.79Å; P251-I254 PolarHBondContact O-N 3.48Å; P251-L255 PolarHBondContact O-N 3.49Å; P251-N498 HydrophobicContact CG-CB 3.92Å; P251-T502 HydrophobicContact CB-CG2 4.12Å; P251-T502 WeakPolarHBondContact CB-OG1 3.5Å; P251-T528 VanDerWaalsContact C-CG2 3.5Å; P251-T528 HydrophobicContact CB-CG2 4Å; P251-T528 VanDerWaalsContact O-CG2 3.22Å; P251-T528 WeakPolarHBondContact O-CG2 3.42Å
252N94.4Very high90.9Very high0 Ų09.4 Ų9.40%05%0.049CC..Hα-helixtrans-63.7-40.6-177.7-55.9-6.9000111.3G242 T243 T245 L246 T249 T250 L255 Q256 W275G242-N252 PolarHBondContact O-ND2 3.03Å; T243-N252 PolarHBondContact O-ND2 3.34Å; T245-N252 PolarHBondContact O-ND2 3.34Å; L246-N252 HydrophobicContact CD1-CB 4.05Å; L246-N252 WeakPolarHBondContact CD1-O 3.47Å; L246-N252 WeakPolarHBondContact O-CB 3.27Å; T249-N252 WeakPolarHBondContact CG2-OD1 3.49Å; T249-N252 WeakPolarHBondContact O-CB 3.41Å; T249-N252 PolarHBondContact O-N 2.92Å; T250-N252 PolarHBondContact O-N 3.47Å; T250-N252 VanDerWaalsContact O-N 3.12Å; N252-L255 PolarHBondContact O-N 3.02Å; N252-Q256 PolarHBondContact O-N 3.16Å; N252-Q256 VanDerWaalsContact O-N 3.12Å; N252-W275 HydrophobicContact CB-CH2 4.03Å; N252-W275 HydrophobicContact CB-CZ2 3.6Å; N252-W275 WeakPolarHBondContact ND2-CZ2 3.15Å; N252-W275 VanDerWaalsContact OD1-CZ2 3.25Å; N252-W275 WeakPolarHBondContact OD1-CZ2 3.24Å
253L90.6Very high90.6Very high0 Ų09.6 Ų9.60%05%0.05CC..Hα-helixtrans-73.8-35177.9-70156.8000112.3L89 F90 L246 T250 P251 L255 Q256 G257 L447L89-L253 HydrophobicContact CD2-CD2 3.74Å; L89-L253 HydrophobicContact CG-CD2 3.98Å; F90-L253 HydrophobicContact CB-CD1 3.76Å; F90-L253 HydrophobicContact CD2-CD1 3.09Å; F90-L253 HydrophobicContact CE2-CD1 3.81Å; F90-L253 HydrophobicContact CG-CD1 3.67Å; L246-L253 HydrophobicContact CG-CD2 4.14Å; L246-L253 VanDerWaalsContact O-CG 3.3Å; L246-L253 WeakPolarHBondContact O-CG 3.37Å; T250-L253 PolarHBondContact O-N 3.37Å; P251-L253 VanDerWaalsContact C-N 3.33Å; P251-L253 PolarHBondContact O-N 2.79Å; L253-L255 VanDerWaalsContact C-N 3.29Å; L253-L255 PolarHBondContact O-N 3.44Å; L253-Q256 PolarHBondContact O-N 2.83Å; L253-G257 PolarHBondContact O-N 2.9Å; L253-L447 HydrophobicContact CB-CD2 4.34Å
254I91.4Very high89.9Confident0 Ų014.6 Ų14.60%08%0.082CC..Hα-helixtrans-58-48.9171.2-63.7164.7000108.4T250 P251 Q256 G257 Q258 L447 T499 T502 T503 L506T250-I254 HydrophobicContact CG2-CD1 4.27Å; T250-I254 HydrophobicContact CG2-CG1 4.32Å; T250-I254 PolarHBondContact O-N 3.3Å; P251-I254 PolarHBondContact O-N 3.48Å; I254-Q256 PolarHBondContact O-N 3.36Å; I254-G257 PolarHBondContact O-N 3.44Å; I254-Q258 HydrophobicContact CG2-CG 3.82Å; I254-Q258 VanDerWaalsContact O-CB 3.27Å; I254-Q258 WeakPolarHBondContact O-CB 3.47Å; I254-Q258 WeakPolarHBondContact O-CG 3.28Å; I254-Q258 PolarHBondContact O-N 2.73Å; I254-L447 HydrophobicContact CB-CD2 4.25Å; I254-L447 HydrophobicContact CD1-CD2 4.47Å; I254-L447 HydrophobicContact CG1-CD2 3.35Å; I254-L447 HydrophobicContact CG1-CG 4.49Å; I254-T499 HydrophobicContact CD1-CG2 3.52Å; I254-T499 VanDerWaalsContact CD1-O 3.23Å; I254-T499 WeakPolarHBondContact CD1-O 3.15Å; I254-T502 HydrophobicContact CB-CG2 3.85Å; I254-T502 HydrophobicContact CD1-CG2 4.14Å; I254-T502 HydrophobicContact CG2-CG2 3.85Å; I254-T503 VanDerWaalsContact CD1-OG1 3.27Å; I254-T503 WeakPolarHBondContact CD1-OG1 3.41Å; I254-L506 HydrophobicContact CG2-CD1 4.16Å
255L93.9Very high89.2Confident0 Ų022.2 Ų22.20%012%0.118CC..Hα-helixtrans-57.1-50.7178.6176.971.8000112.3P251 N252 L253 G257 Q258 I259 W275 L506 M524 L525 T528P251-L255 PolarHBondContact O-N 3.49Å; N252-L255 PolarHBondContact O-N 3.02Å; L253-L255 VanDerWaalsContact C-N 3.29Å; L253-L255 PolarHBondContact O-N 3.44Å; L255-G257 VanDerWaalsContact C-N 3.34Å; L255-G257 PolarHBondContact O-N 3.29Å; L255-Q258 PolarHBondContact O-N 2.87Å; L255-I259 HydrophobicContact CD1-CD1 4.46Å; L255-I259 HydrophobicContact CD1-CG1 3.96Å; L255-I259 HydrophobicContact CG-CG1 4.25Å; L255-I259 WeakPolarHBondContact O-CG1 3.3Å; L255-I259 PolarHBondContact O-N 3.43Å; L255-W275 HydrophobicContact CD2-CE3 4.28Å; L255-W275 HydrophobicContact CD2-CH2 4.3Å; L255-W275 HydrophobicContact CD2-CZ3 3.48Å; L255-W275 VanDerWaalsContact CD2-CZ3 3.48Å; L255-L506 VanDerWaalsContact CA-CD1 3.47Å; L255-L506 HydrophobicContact CB-CD1 3.74Å; L255-L506 HydrophobicContact CD1-CD1 3.73Å; L255-L506 HydrophobicContact CD1-CD2 4.26Å; L255-L506 HydrophobicContact CG-CD1 4.35Å; L255-M524 HydrophobicContact CD1-CB 3.54Å; L255-M524 HydrophobicContact CD1-CE 3.74Å; L255-L525 HydrophobicContact CD2-CD2 3.54Å; L255-L525 HydrophobicContact CD2-CG 4.34Å; L255-T528 HydrophobicContact CB-CG2 3.8Å; L255-T528 HydrophobicContact CD2-CG2 4.29Å
256Q91.4Very high88.7Confident2 Ų222.9 Ų22.91%0.00912%0.121CC..Hα-helixtrans-55.2-51.7-179.8-178.7-170.411.600111L246 N252 L253 I254 Q258 I259 E260 I270L246-Q256 HydrophobicContact CD1-CB 4.18Å; L246-Q256 HydrophobicContact CD2-CG 4.36Å; N252-Q256 PolarHBondContact O-N 3.16Å; N252-Q256 VanDerWaalsContact O-N 3.12Å; L253-Q256 PolarHBondContact O-N 2.83Å; I254-Q256 PolarHBondContact O-N 3.36Å; Q256-Q258 VanDerWaalsContact C-N 3.3Å; Q256-Q258 PolarHBondContact O-N 3.5Å; Q256-I259 PolarHBondContact O-N 2.99Å; Q256-E260 WeakPolarHBondContact CG-OE1 3.34Å; Q256-E260 PolarHBondContact NE2-OE1 3.01Å; Q256-E260 VanDerWaalsContact NE2-OE1 3.08Å; Q256-E260 WeakPolarHBondContact O-CG 3.27Å; Q256-E260 PolarHBondContact O-N 2.94Å; Q256-I270 HydrophobicContact CB-CG2 4.43Å; Q256-I270 HydrophobicContact CG-CG2 4.5Å
257G88.1Confident87.9Confident3 Ų326.4 Ų26.43%0.03116%0.157CC..Hα-helixtrans-67-31.6-179.200000113.5S86 L253 I254 L255 K261 F451S86-G257 WeakPolarHBondContact OG-CA 3.24Å; L253-G257 PolarHBondContact O-N 2.9Å; I254-G257 PolarHBondContact O-N 3.44Å; L255-G257 VanDerWaalsContact C-N 3.34Å; L255-G257 PolarHBondContact O-N 3.29Å; G257-K261 WeakPolarHBondContact O-CB 3.34Å; G257-K261 PolarHBondContact O-N 3.26Å; G257-F451 VanDerWaalsContact C-CE1 3.47Å
258Q88.9Confident87.3Confident0 Ų026.5 Ų26.50%016%0.163CC..Hα-helixtrans-67.8-41.5173.8-71.9-66.1-2100111.7I254 L255 Q256 K261 L262 G450 F451 L506 M524I254-Q258 HydrophobicContact CG2-CG 3.82Å; I254-Q258 VanDerWaalsContact O-CB 3.27Å; I254-Q258 WeakPolarHBondContact O-CB 3.47Å; I254-Q258 WeakPolarHBondContact O-CG 3.28Å; I254-Q258 PolarHBondContact O-N 2.73Å; L255-Q258 PolarHBondContact O-N 2.87Å; Q256-Q258 VanDerWaalsContact C-N 3.3Å; Q256-Q258 PolarHBondContact O-N 3.5Å; Q258-K261 PolarHBondContact O-N 2.75Å; Q258-L262 HydrophobicContact CB-CD1 4.44Å; Q258-L262 VanDerWaalsContact O-CB 3.23Å; Q258-L262 WeakPolarHBondContact O-CB 3.43Å; Q258-L262 WeakPolarHBondContact O-CG 3.42Å; Q258-L262 PolarHBondContact O-N 2.96Å; Q258-G450 VanDerWaalsContact NE2-C 3.3Å; Q258-G450 PolarHBondContact NE2-O 3.15Å; Q258-F451 HydrophobicContact CG-CD1 4.32Å; Q258-F451 HydrophobicContact CG-CE1 4.22Å; Q258-L506 HydrophobicContact CG-CB 4.35Å; Q258-L506 HydrophobicContact CG-CD1 4.48Å; Q258-M524 HydrophobicContact CB-CE 4.27Å
259I90.3Very high87.1Confident2 Ų228 Ų281%0.0117%0.171CC..Hα-helixtrans-64.6-46.4175.3-70.1-67.5000110.7L255 Q256 K261 F263 N266 L521 M524L255-I259 HydrophobicContact CD1-CD1 4.46Å; L255-I259 HydrophobicContact CD1-CG1 3.96Å; L255-I259 HydrophobicContact CG-CG1 4.25Å; L255-I259 WeakPolarHBondContact O-CG1 3.3Å; L255-I259 PolarHBondContact O-N 3.43Å; Q256-I259 PolarHBondContact O-N 2.99Å; I259-K261 PolarHBondContact O-N 3.28Å; I259-F263 HydrophobicContact CD1-CD2 3.97Å; I259-F263 HydrophobicContact CD1-CE2 4.19Å; I259-F263 CarbonylContact O-C 3.46Å; I259-F263 WeakPolarHBondContact O-CA 3.39Å; I259-F263 WeakPolarHBondContact O-CB 3.39Å; I259-F263 PolarHBondContact O-N 2.96Å; I259-N266 PolarHBondContact O-ND2 3.18Å; I259-L521 HydrophobicContact CD1-CD2 3.66Å; I259-L521 HydrophobicContact CG1-CD2 4.02Å; I259-M524 HydrophobicContact CD1-CE 3.7Å; I259-M524 HydrophobicContact CD1-SD 3.49Å; I259-M524 WeakPolarHBondContact CD1-SD 3.43Å; I259-M524 HydrophobicContact CG1-CE 4.16Å
260E85.3Confident87Confident59 Ų5927.5 Ų27.528%0.27617%0.167SC..Hα-helixtrans-59.9-36175.8-72.5169.1-179.300112S86 Q256S86-E260 PolarHBondContact OG-OE2 2.89Å; Q256-E260 WeakPolarHBondContact CG-OE1 3.34Å; Q256-E260 PolarHBondContact NE2-OE1 3.01Å; Q256-E260 VanDerWaalsContact NE2-OE1 3.08Å; Q256-E260 WeakPolarHBondContact O-CG 3.27Å; Q256-E260 PolarHBondContact O-N 2.94Å
261K83.3Confident86.9Confident64 Ų6427.7 Ų27.728%0.27817%0.168SC..Hα-helixtrans-81.4-46.3-177.6179.957.5-175.8-178.80113.7E81 G257 Q258 I259 A455E81-K261 VanDerWaalsContact CD-NZ 3.33Å; E81-K261 WeakPolarHBondContact OE1-CE 3.46Å; E81-K261 IonicContact OE1-NZ 3.5Å; E81-K261 PolarHBondContact OE1-NZ 3.05Å; E81-K261 VanDerWaalsContact OE2-CD 3.31Å; E81-K261 WeakPolarHBondContact OE2-CD 3.15Å; E81-K261 WeakPolarHBondContact OE2-CE 3.27Å; E81-K261 IonicContact OE2-NZ 2.87Å; E81-K261 PolarHBondContact OE2-NZ 3.22Å; G257-K261 WeakPolarHBondContact O-CB 3.34Å; G257-K261 PolarHBondContact O-N 3.26Å; Q258-K261 PolarHBondContact O-N 2.75Å; I259-K261 PolarHBondContact O-N 3.28Å; K261-A455 VanDerWaalsContact CE-CB 3.43Å
262L84.3Confident86.7Confident15 Ų1527.7 Ų27.78%0.07917%0.168CC..Hα-helixtrans-81.2-24.7-175.6-66.4169.7000112.1Q258 A454 A510Q258-L262 HydrophobicContact CB-CD1 4.44Å; Q258-L262 VanDerWaalsContact O-CB 3.23Å; Q258-L262 WeakPolarHBondContact O-CB 3.43Å; Q258-L262 WeakPolarHBondContact O-CG 3.42Å; Q258-L262 PolarHBondContact O-N 2.96Å; L262-A454 HydrophobicContact CD1-CB 4.47Å; L262-A454 HydrophobicContact CD2-CB 4.04Å; L262-A454 HydrophobicContact CG-CB 4.33Å; L262-A510 HydrophobicContact CD1-CB 3.52Å
263F87.5Confident86.5Confident4 Ų428.4 Ų28.42%0.01817%0.174CC..  trans-132.369.3-178.5-55.9-70.8000110.9I259 E265 N266 A510 T514 P520 M524 W593 A594I259-F263 HydrophobicContact CD1-CD2 3.97Å; I259-F263 HydrophobicContact CD1-CE2 4.19Å; I259-F263 CarbonylContact O-C 3.46Å; I259-F263 WeakPolarHBondContact O-CA 3.39Å; I259-F263 WeakPolarHBondContact O-CB 3.39Å; I259-F263 PolarHBondContact O-N 2.96Å; F263-E265 PolarHBondContact O-N 3.36Å; F263-E265 VanDerWaalsContact O-N 3.13Å; F263-N266 HydrophobicContact CB-CB 4.21Å; F263-N266 VanDerWaalsContact O-CB 3.24Å; F263-N266 WeakPolarHBondContact O-CB 3.41Å; F263-N266 PolarHBondContact O-N 2.93Å; F263-N266 PolarHBondContact O-ND2 3.42Å; F263-A510 HydrophobicContact CE2-CB 3.98Å; F263-A510 HydrophobicContact CZ-CB 4.12Å; F263-T514 HydrophobicContact CE1-CG2 3.58Å; F263-T514 HydrophobicContact CZ-CG2 3.8Å; F263-P520 HydrophobicContact CE1-CG 4.02Å; F263-P520 HydrophobicContact CE2-CB 3.7Å; F263-P520 HydrophobicContact CE2-CG 3.93Å; F263-P520 HydrophobicContact CZ-CB 3.77Å; F263-P520 HydrophobicContact CZ-CG 3.54Å; F263-M524 HydrophobicContact CE2-SD 4.25Å; F263-W593 HydrophobicContact CB-CE3 3.68Å; F263-W593 HydrophobicContact CB-CZ3 3.71Å; F263-W593 AromaticContact CD1-CE3 3.99Å; F263-W593 HydrophobicContact CD1-CE3 3.99Å; F263-W593 AromaticContact CD1-CZ3 3.85Å; F263-W593 HydrophobicContact CD1-CZ3 3.85Å; F263-W593 AromaticContact CD2-CZ3 3.9Å; F263-W593 HydrophobicContact CD2-CZ3 3.9Å; F263-W593 HydrophobicContact CE1-CZ3 4.44Å; F263-W593 HydrophobicContact CE2-CZ3 4.49Å; F263-W593 AromaticContact CG-CE3 3.87Å; F263-W593 HydrophobicContact CG-CE3 3.87Å; F263-W593 AromaticContact CG-CZ3 3.54Å; F263-W593 HydrophobicContact CG-CZ3 3.54Å; F263-A594 HydrophobicContact CD1-CB 4.14Å; F263-A594 HydrophobicContact CE1-CB 3.96Å
264P80.8Confident86.6Confident104 Ų10429.4 Ų29.468%0.67518%0.181SC*.G310 helixtrans-60.7-27.8-173.223.8-34000113.8N266P264-N266 PolarHBondContact O-N 3.1Å
265E81.8Confident86.7Confident160 Ų16029.4 Ų29.475%0.74818%0.181SC*.G310 helixtrans-83.48.5179.5-61-173.4174.600113.8F263 G267 W593F263-E265 PolarHBondContact O-N 3.36Å; F263-E265 VanDerWaalsContact O-N 3.13Å; E265-G267 PolarHBondContact O-N 3.27Å; E265-G267 VanDerWaalsContact O-N 3.16Å; E265-W593 HydrophobicContact CB-CB 4.15Å; E265-W593 WeakPolarHBondContact O-CB 3.39Å
266N82.6Confident86.8Confident14 Ų1431.2 Ų31.28%0.07519%0.189CC..G310 helixtrans-65.1-19.3-1777968.3000113.3I259 F263 P264 G268 V269 W593I259-N266 PolarHBondContact O-ND2 3.18Å; F263-N266 HydrophobicContact CB-CB 4.21Å; F263-N266 VanDerWaalsContact O-CB 3.24Å; F263-N266 WeakPolarHBondContact O-CB 3.41Å; F263-N266 PolarHBondContact O-N 2.93Å; F263-N266 PolarHBondContact O-ND2 3.42Å; P264-N266 PolarHBondContact O-N 3.1Å; N266-G268 VanDerWaalsContact C-N 3.34Å; N266-G268 PolarHBondContact O-N 3.05Å; N266-G268 VanDerWaalsContact OD1-CA 3.27Å; N266-G268 WeakPolarHBondContact OD1-CA 3.42Å; N266-G268 PolarHBondContact OD1-N 2.53Å; N266-V269 HydrophobicContact CB-CG2 3.96Å; N266-V269 WeakPolarHBondContact O-CG2 3.49Å; N266-V269 PolarHBondContact OD1-N 3.33Å; N266-W593 HydrophobicContact CB-CD2 3.91Å; N266-W593 HydrophobicContact CB-CE3 3.89Å; N266-W593 HydrophobicContact CB-CG 4.3Å; N266-W593 HydrophobicContact CB-CZ3 4.32Å
267G75.5Confident86.9Confident74 Ų7432.6 Ų32.676%0.76320%0.204SC*.  trans72.823.717800000114.2E265E265-G267 PolarHBondContact O-N 3.27Å; E265-G267 VanDerWaalsContact O-N 3.16Å
268G77.5Confident87.2Confident23 Ų2332.5 Ų32.524%0.23720%0.202CC..SBendtrans75.336.3178.900000113.9N266 I270N266-G268 VanDerWaalsContact C-N 3.34Å; N266-G268 PolarHBondContact O-N 3.05Å; N266-G268 VanDerWaalsContact OD1-CA 3.27Å; N266-G268 WeakPolarHBondContact OD1-CA 3.42Å; N266-G268 PolarHBondContact OD1-N 2.53Å; G268-I270 PolarHBondContact O-N 3.25Å; G268-I270 VanDerWaalsContact O-N 3.17Å
269V85.1Confident87.5Confident36 Ų3632.5 Ų32.522%0.21820%0.202CC..SBendtrans-53.1-39.8-178.6-172.40000111.6N266 S274 L521 F585 W593N266-V269 HydrophobicContact CB-CG2 3.96Å; N266-V269 WeakPolarHBondContact O-CG2 3.49Å; N266-V269 PolarHBondContact OD1-N 3.33Å; V269-S274 WeakPolarHBondContact O-CB 3.38Å; V269-S274 PolarHBondContact O-OG 3.04Å; V269-L521 HydrophobicContact CB-CD1 4.43Å; V269-L521 HydrophobicContact CG1-CD1 3.63Å; V269-F585 HydrophobicContact CG1-CD1 3.57Å; V269-F585 HydrophobicContact CG1-CE1 3.88Å; V269-W593 HydrophobicContact CG2-CZ2 4.23Å
270I89.6Confident87.8Confident4 Ų435.8 Ų35.82%0.02122%0.217CC..SBendtrans-100.7100.2173.4-57-59.3000108.7Q256 G268 S274 W275 L521 L525 F585Q256-I270 HydrophobicContact CB-CG2 4.43Å; Q256-I270 HydrophobicContact CG-CG2 4.5Å; G268-I270 PolarHBondContact O-N 3.25Å; G268-I270 VanDerWaalsContact O-N 3.17Å; I270-S274 WeakPolarHBondContact CA-OG 3.15Å; I270-W275 HydrophobicContact CG2-CB 4.49Å; I270-W275 HydrophobicContact CG2-CE3 4.25Å; I270-L521 HydrophobicContact CD1-CD1 3.91Å; I270-L521 HydrophobicContact CD1-CD2 3.94Å; I270-L521 HydrophobicContact CG1-CD1 4.28Å; I270-L521 HydrophobicContact CG1-CD2 3.76Å; I270-L525 HydrophobicContact CD1-CD2 4.09Å; I270-F585 HydrophobicContact CD1-CE1 3.64Å; I270-F585 HydrophobicContact CD1-CZ 3.57Å
271N89.5Confident88.3Confident17 Ų1735.5 Ų35.59%0.09122%0.22CC..  trans-119.4176.5168.668.237.5000109.2A273 S274 W275 E355N271-A273 VanDerWaalsContact C-N 3.26Å; N271-A273 PolarHBondContact O-N 2.97Å; N271-A273 WeakPolarHBondContact OD1-CA 3.16Å; N271-A273 WeakPolarHBondContact OD1-CB 3.44Å; N271-A273 PolarHBondContact OD1-N 3.42Å; N271-S274 PolarHBondContact N-OG 2.82Å; N271-S274 PolarHBondContact O-N 3.03Å; N271-S274 PolarHBondContact O-OG 3.45Å; N271-S274 PolarHBondContact OD1-N 3.45Å; N271-S274 PolarHBondContact OD1-OG 3.19Å; N271-W275 VanDerWaalsContact O-CB 3.32Å; N271-W275 WeakPolarHBondContact O-CB 3.38Å; N271-W275 PolarHBondContact O-N 3.12Å; N271-E355 PolarHBondContact ND2-O 3.12Å; N271-E355 VanDerWaalsContact ND2-O 3.08Å
272F89.1Confident88.9Confident1 Ų132.4 Ų32.40%0.00421%0.206CC..Hα-helixtrans-54.4-42.6-179.1-170.2-84.1000113.1W138 T245 L246 F276 W351 F352 D376W138-F272 HydrophobicContact CH2-CZ 4.25Å; W138-F272 AromaticContact CZ3-CZ 3.92Å; W138-F272 HydrophobicContact CZ3-CZ 3.92Å; T245-F272 HydrophobicContact CG2-CZ 4.12Å; L246-F272 HydrophobicContact CB-CD2 4.01Å; L246-F272 HydrophobicContact CB-CE2 4.41Å; F272-F276 VanDerWaalsContact O-CB 3.3Å; F272-F276 WeakPolarHBondContact O-CB 3.4Å; F272-F276 PolarHBondContact O-N 2.67Å; F272-W351 HydrophobicContact CB-CB 4Å; F272-W351 HydrophobicContact CB-CG 4.11Å; F272-W351 HydrophobicContact CD1-CB 3.64Å; F272-W351 HydrophobicContact CD1-CD2 4.31Å; F272-W351 HydrophobicContact CD1-CE3 4.08Å; F272-W351 HydrophobicContact CD1-CG 4.2Å; F272-W351 HydrophobicContact CD2-CB 4.46Å; F272-W351 AromaticContact CD2-CD2 3.67Å; F272-W351 HydrophobicContact CD2-CD2 3.67Å; F272-W351 AromaticContact CD2-CE3 3.47Å; F272-W351 HydrophobicContact CD2-CE3 3.47Å; F272-W351 VanDerWaalsContact CD2-CE3 3.47Å; F272-W351 HydrophobicContact CD2-CG 4.15Å; F272-W351 HydrophobicContact CD2-CH2 4.39Å; F272-W351 AromaticContact CD2-CZ3 3.86Å; F272-W351 HydrophobicContact CD2-CZ3 3.86Å; F272-W351 HydrophobicContact CE1-CB 4.27Å; F272-W351 AromaticContact CE1-CE3 3.85Å; F272-W351 HydrophobicContact CE1-CE3 3.85Å; F272-W351 AromaticContact CE2-CD2 3.93Å; F272-W351 HydrophobicContact CE2-CD2 3.93Å; F272-W351 AromaticContact CE2-CE3 3.2Å; F272-W351 HydrophobicContact CE2-CE3 3.2Å; F272-W351 HydrophobicContact CE2-CH2 4.07Å; F272-W351 AromaticContact CE2-CZ3 3.28Å; F272-W351 HydrophobicContact CE2-CZ3 3.28Å; F272-W351 HydrophobicContact CG-CB 3.76Å; F272-W351 AromaticContact CG-CD2 3.89Å; F272-W351 HydrophobicContact CG-CD2 3.89Å; F272-W351 AromaticContact CG-CE3 3.91Å; F272-W351 HydrophobicContact CG-CE3 3.91Å; F272-W351 AromaticContact CG-CG 3.87Å; F272-W351 HydrophobicContact CG-CG 3.87Å; F272-W351 HydrophobicContact CZ-CD2 4.35Å; F272-W351 AromaticContact CZ-CE3 3.42Å; F272-W351 HydrophobicContact CZ-CE3 3.42Å; F272-W351 VanDerWaalsContact CZ-CE3 3.42Å; F272-W351 AromaticContact CZ-CZ3 3.73Å; F272-W351 HydrophobicContact CZ-CZ3 3.73Å; F272-F352 HydrophobicContact CD1-CE2 4.35Å; F272-F352 HydrophobicContact CE1-CD2 4.25Å; F272-F352 AromaticContact CE1-CE2 3.74Å; F272-F352 HydrophobicContact CE1-CE2 3.74Å; F272-F352 HydrophobicContact CE1-CZ 4.1Å; F272-D376 PolarHBondContact N-OD2 3Å
273A90.5Very high89.4Confident14 Ų1431.9 Ų31.912%0.11620%0.204CC..Hα-helixtrans-71.2-45.3-177.300000112.3N271 F276 G277 F352N271-A273 VanDerWaalsContact C-N 3.26Å; N271-A273 PolarHBondContact O-N 2.97Å; N271-A273 WeakPolarHBondContact OD1-CA 3.16Å; N271-A273 WeakPolarHBondContact OD1-CB 3.44Å; N271-A273 PolarHBondContact OD1-N 3.42Å; A273-F276 PolarHBondContact O-N 3Å; A273-G277 PolarHBondContact O-N 2.94Å; A273-F352 HydrophobicContact CB-CD1 4.27Å
274S91.9Very high89.9Confident21 Ų2135.1 Ų35.115%0.14722%0.223CC..Hα-helixtrans-68.6-39.6178.766.60000111.6V269 I270 N271 F276 G277 F278 M584V269-S274 WeakPolarHBondContact O-CB 3.38Å; V269-S274 PolarHBondContact O-OG 3.04Å; I270-S274 WeakPolarHBondContact CA-OG 3.15Å; N271-S274 PolarHBondContact N-OG 2.82Å; N271-S274 PolarHBondContact O-N 3.03Å; N271-S274 PolarHBondContact O-OG 3.45Å; N271-S274 PolarHBondContact OD1-N 3.45Å; N271-S274 PolarHBondContact OD1-OG 3.19Å; S274-F276 PolarHBondContact O-N 3.45Å; S274-G277 PolarHBondContact O-N 3.31Å; S274-F278 PolarHBondContact O-N 3.03Å; S274-F278 VanDerWaalsContact O-N 3.09Å; S274-M584 VanDerWaalsContact O-CE 3.22Å; S274-M584 WeakPolarHBondContact O-CE 3.32Å
275W94.4Very high90.6Very high1 Ų132.7 Ų32.70%0.00420%0.204CC..Hα-helixtrans-57.9-50.3171.3177.6-89.1000111.2T243 L246 N252 L255 I270 N271 G277 F278 A279 L525 T528 I529T243-W275 PolarHBondContact O-NE1 3.42Å; L246-W275 HydrophobicContact CB-CG 4.37Å; L246-W275 HydrophobicContact CD1-CB 4.23Å; L246-W275 HydrophobicContact CD1-CD2 3.85Å; L246-W275 HydrophobicContact CD1-CE3 4.22Å; L246-W275 HydrophobicContact CD1-CG 3.83Å; N252-W275 HydrophobicContact CB-CH2 4.03Å; N252-W275 HydrophobicContact CB-CZ2 3.6Å; N252-W275 WeakPolarHBondContact ND2-CZ2 3.15Å; N252-W275 VanDerWaalsContact OD1-CZ2 3.25Å; N252-W275 WeakPolarHBondContact OD1-CZ2 3.24Å; L255-W275 HydrophobicContact CD2-CE3 4.28Å; L255-W275 HydrophobicContact CD2-CH2 4.3Å; L255-W275 HydrophobicContact CD2-CZ3 3.48Å; L255-W275 VanDerWaalsContact CD2-CZ3 3.48Å; I270-W275 HydrophobicContact CG2-CB 4.49Å; I270-W275 HydrophobicContact CG2-CE3 4.25Å; N271-W275 VanDerWaalsContact O-CB 3.32Å; N271-W275 WeakPolarHBondContact O-CB 3.38Å; N271-W275 PolarHBondContact O-N 3.12Å; W275-G277 VanDerWaalsContact C-N 3.31Å; W275-G277 PolarHBondContact O-N 3.1Å; W275-F278 PolarHBondContact O-N 3.17Å; W275-F278 VanDerWaalsContact O-N 3.15Å; W275-A279 HydrophobicContact CD2-CB 4.42Å; W275-A279 HydrophobicContact CZ2-CB 4.12Å; W275-A279 VanDerWaalsContact O-CB 3.32Å; W275-A279 WeakPolarHBondContact O-CB 3.22Å; W275-A279 PolarHBondContact O-N 3.24Å; W275-L525 HydrophobicContact CE3-CD2 4.05Å; W275-L525 HydrophobicContact CZ3-CD2 3.62Å; W275-T528 HydrophobicContact CH2-CG2 4.1Å; W275-I529 HydrophobicContact CH2-CG1 4.2Å
276F94.7Very high91.2Very high38 Ų3825 Ų2517%0.16717%0.169CC..Hα-helixtrans-60.8-42.2179.6-172.5-89.7000111.6T245 F272 A273 S274 F278 A279 F280 F352T245-F276 HydrophobicContact CG2-CD2 3.95Å; T245-F276 HydrophobicContact CG2-CE2 4.14Å; F272-F276 VanDerWaalsContact O-CB 3.3Å; F272-F276 WeakPolarHBondContact O-CB 3.4Å; F272-F276 PolarHBondContact O-N 2.67Å; A273-F276 PolarHBondContact O-N 3Å; S274-F276 PolarHBondContact O-N 3.45Å; F276-F278 VanDerWaalsContact C-N 3.25Å; F276-F278 PolarHBondContact O-N 3.2Å; F276-A279 PolarHBondContact O-N 2.91Å; F276-F280 HydrophobicContact CD1-CB 3.93Å; F276-F280 HydrophobicContact CD1-CG 4.39Å; F276-F280 HydrophobicContact CD2-CB 4.02Å; F276-F280 HydrophobicContact CE1-CB 3.74Å; F276-F280 HydrophobicContact CE1-CD1 4.02Å; F276-F280 HydrophobicContact CE1-CD2 4.11Å; F276-F280 AromaticContact CE1-CG 3.7Å; F276-F280 HydrophobicContact CE1-CG 3.7Å; F276-F280 HydrophobicContact CE2-CB 3.84Å; F276-F280 AromaticContact CE2-CD2 3.56Å; F276-F280 HydrophobicContact CE2-CD2 3.56Å; F276-F280 HydrophobicContact CE2-CE2 4.34Å; F276-F280 AromaticContact CE2-CG 3.87Å; F276-F280 HydrophobicContact CE2-CG 3.87Å; F276-F280 HydrophobicContact CG-CB 4.09Å; F276-F280 HydrophobicContact CZ-CB 3.7Å; F276-F280 HydrophobicContact CZ-CD1 4.01Å; F276-F280 AromaticContact CZ-CD2 3.32Å; F276-F280 HydrophobicContact CZ-CD2 3.32Å; F276-F280 HydrophobicContact CZ-CE1 4.49Å; F276-F280 AromaticContact CZ-CE2 3.87Å; F276-F280 HydrophobicContact CZ-CE2 3.87Å; F276-F280 AromaticContact CZ-CG 3.4Å; F276-F280 HydrophobicContact CZ-CG 3.4Å; F276-F280 HydrophobicContact CZ-CZ 4.43Å; F276-F280 WeakPolarHBondContact O-CB 3.29Å; F276-F280 PolarHBondContact O-N 3.4Å; F276-F352 HydrophobicContact CB-CE1 4.13Å; F276-F352 HydrophobicContact CB-CZ 4.02Å; F276-F352 AromaticContact CD1-CE1 3.6Å; F276-F352 HydrophobicContact CD1-CE1 3.6Å; F276-F352 AromaticContact CD1-CZ 3.4Å; F276-F352 HydrophobicContact CD1-CZ 3.4Å; F276-F352 VanDerWaalsContact CD1-CZ 3.4Å; F276-F352 AromaticContact CD2-CZ 3.94Å; F276-F352 HydrophobicContact CD2-CZ 3.94Å; F276-F352 HydrophobicContact CE1-CE1 4.17Å; F276-F352 AromaticContact CE1-CZ 3.72Å; F276-F352 HydrophobicContact CE1-CZ 3.72Å; F276-F352 HydrophobicContact CE2-CZ 4.22Å; F276-F352 AromaticContact CG-CE1 3.93Å; F276-F352 HydrophobicContact CG-CE1 3.93Å; F276-F352 AromaticContact CG-CZ 3.5Å; F276-F352 HydrophobicContact CG-CZ 3.5Å; F276-F352 HydrophobicContact CZ-CZ 4.11Å
277G93.2Very high91.9Very high31 Ų3125.3 Ų25.332%0.3217%0.17SC..Hα-helixtrans-57.7-35.7175.900000113.4A273 S274 W275 P281A273-G277 PolarHBondContact O-N 2.94Å; S274-G277 PolarHBondContact O-N 3.31Å; W275-G277 VanDerWaalsContact C-N 3.31Å; W275-G277 PolarHBondContact O-N 3.1Å; G277-P281 VanDerWaalsContact O-CD 3.27Å; G277-P281 WeakPolarHBondContact O-CD 3.41Å; G277-P281 WeakPolarHBondContact O-CG 3.31Å
278F94.4Very high92.8Very high0 Ų024 Ų240%015%0.152CC..Hα-helixtrans-80.2-51.5175.2177.4-111.4000113S274 W275 F276 L525 I529 I577 W580 M584 F585S274-F278 PolarHBondContact O-N 3.03Å; S274-F278 VanDerWaalsContact O-N 3.09Å; W275-F278 PolarHBondContact O-N 3.17Å; W275-F278 VanDerWaalsContact O-N 3.15Å; F276-F278 VanDerWaalsContact C-N 3.25Å; F276-F278 PolarHBondContact O-N 3.2Å; F278-L525 HydrophobicContact CD1-CD1 4.3Å; F278-L525 HydrophobicContact CD1-CD2 4.21Å; F278-L525 HydrophobicContact CE1-CB 3.94Å; F278-L525 HydrophobicContact CE1-CD1 4.19Å; F278-L525 HydrophobicContact CE1-CD2 4.28Å; F278-L525 HydrophobicContact CE1-CG 4.39Å; F278-L525 HydrophobicContact CZ-CB 4.3Å; F278-L525 HydrophobicContact CZ-CD1 4.39Å; F278-I529 HydrophobicContact CD1-CD1 4.26Å; F278-I529 HydrophobicContact CE1-CD1 3.64Å; F278-I577 HydrophobicContact CE2-CB 4.46Å; F278-I577 HydrophobicContact CE2-CD1 3.83Å; F278-I577 HydrophobicContact CZ-CB 4.43Å; F278-I577 HydrophobicContact CZ-CD1 3.71Å; F278-W580 AromaticContact CD2-NE1 3.76Å; F278-W580 PolarHBondContact O-NE1 3.3Å; F278-W580 VanDerWaalsContact O-NE1 3.1Å; F278-M584 HydrophobicContact CB-CE 3.65Å; F278-F585 HydrophobicContact CB-CE2 4.08Å; F278-F585 HydrophobicContact CB-CZ 4.42Å; F278-F585 HydrophobicContact CD2-CE2 4.28Å; F278-F585 HydrophobicContact CG-CE2 4.21Å
279A96.1Very high93.6Very high0 Ų025.8 Ų25.80%016%0.155CC..Hα-helixtrans-85.7-32.4-164.300000113.4T243 W275 F276 N282 M283T243-A279 VanDerWaalsContact O-CB 3.32Å; T243-A279 WeakPolarHBondContact O-CB 3.22Å; W275-A279 HydrophobicContact CD2-CB 4.42Å; W275-A279 HydrophobicContact CZ2-CB 4.12Å; W275-A279 VanDerWaalsContact O-CB 3.32Å; W275-A279 WeakPolarHBondContact O-CB 3.22Å; W275-A279 PolarHBondContact O-N 3.24Å; F276-A279 PolarHBondContact O-N 2.91Å; A279-N282 PolarHBondContact O-N 3.45Å; A279-M283 WeakPolarHBondContact O-CB 3.45Å; A279-M283 PolarHBondContact O-N 3.09Å
280F96Very high94Very high72 Ų7224 Ų2432%0.31615%0.145SC..Hα-helixtrans-64.1-48179.6178.5-92.6000112.6M137 A244 F276 N282 M283 V284M137-F280 HydrophobicContact CE-CD2 4.2Å; M137-F280 HydrophobicContact CE-CE2 3.98Å; M137-F280 HydrophobicContact SD-CD2 4.31Å; M137-F280 HydrophobicContact SD-CE2 4.26Å; A244-F280 HydrophobicContact CB-CB 4.48Å; A244-F280 HydrophobicContact CB-CD2 4.25Å; F276-F280 HydrophobicContact CD1-CB 3.93Å; F276-F280 HydrophobicContact CD1-CG 4.39Å; F276-F280 HydrophobicContact CD2-CB 4.02Å; F276-F280 HydrophobicContact CE1-CB 3.74Å; F276-F280 HydrophobicContact CE1-CD1 4.02Å; F276-F280 HydrophobicContact CE1-CD2 4.11Å; F276-F280 AromaticContact CE1-CG 3.7Å; F276-F280 HydrophobicContact CE1-CG 3.7Å; F276-F280 HydrophobicContact CE2-CB 3.84Å; F276-F280 AromaticContact CE2-CD2 3.56Å; F276-F280 HydrophobicContact CE2-CD2 3.56Å; F276-F280 HydrophobicContact CE2-CE2 4.34Å; F276-F280 AromaticContact CE2-CG 3.87Å; F276-F280 HydrophobicContact CE2-CG 3.87Å; F276-F280 HydrophobicContact CG-CB 4.09Å; F276-F280 HydrophobicContact CZ-CB 3.7Å; F276-F280 HydrophobicContact CZ-CD1 4.01Å; F276-F280 AromaticContact CZ-CD2 3.32Å; F276-F280 HydrophobicContact CZ-CD2 3.32Å; F276-F280 HydrophobicContact CZ-CE1 4.49Å; F276-F280 AromaticContact CZ-CE2 3.87Å; F276-F280 HydrophobicContact CZ-CE2 3.87Å; F276-F280 AromaticContact CZ-CG 3.4Å; F276-F280 HydrophobicContact CZ-CG 3.4Å; F276-F280 HydrophobicContact CZ-CZ 4.43Å; F276-F280 WeakPolarHBondContact O-CB 3.29Å; F276-F280 PolarHBondContact O-N 3.4Å; F280-N282 VanDerWaalsContact C-N 3.29Å; F280-N282 PolarHBondContact O-N 3.13Å; F280-M283 HydrophobicContact CD2-CE 3.6Å; F280-M283 HydrophobicContact CE2-CE 3.68Å; F280-M283 HydrophobicContact CG-CE 4.3Å; F280-M283 HydrophobicContact CZ-CE 4.43Å; F280-M283 PolarHBondContact O-N 3.35Å; F280-V284 HydrophobicContact CD1-CG2 4.29Å; F280-V284 HydrophobicContact CE1-CG2 3.87Å; F280-V284 HydrophobicContact CE2-CG2 4.4Å; F280-V284 HydrophobicContact CZ-CG2 3.93Å; F280-V284 WeakPolarHBondContact O-CG2 3.37Å; F280-V284 PolarHBondContact O-N 2.87Å
281P96.3Very high94.2Very high52 Ų5225.1 Ų25.134%0.33815%0.149SC..Hα-helixtrans-58.9-40.6174.1-24.635.4000112.6G277 V284 L285 W580G277-P281 VanDerWaalsContact O-CD 3.27Å; G277-P281 WeakPolarHBondContact O-CD 3.41Å; G277-P281 WeakPolarHBondContact O-CG 3.31Å; P281-V284 PolarHBondContact O-N 3.47Å; P281-L285 WeakPolarHBondContact O-CB 3.39Å; P281-L285 PolarHBondContact O-N 3.33Å; P281-W580 HydrophobicContact CB-CZ2 4.1Å
282N95.3Very high94.3Very high0 Ų028.6 Ų28.60%017%0.167CC..Hα-helixtrans-62.7-42.9176.7-171.451.1000111.8A279 F280 L285 M286 C572 I573 W580A279-N282 PolarHBondContact O-N 3.45Å; F280-N282 VanDerWaalsContact C-N 3.29Å; F280-N282 PolarHBondContact O-N 3.13Å; N282-L285 PolarHBondContact O-N 3.29Å; N282-M286 VanDerWaalsContact O-CB 3.28Å; N282-M286 WeakPolarHBondContact O-CB 3.4Å; N282-M286 PolarHBondContact O-N 3.45Å; N282-C572 PolarHBondContact OD1-O 2.98Å; N282-C572 VanDerWaalsContact OD1-O 3.12Å; N282-I573 WeakPolarHBondContact ND2-CG1 3.41Å; N282-I573 PolarHBondContact OD1-N 3.1Å; N282-W580 HydrophobicContact CB-CZ2 4.03Å
283M96.2Very high94.5Very high4 Ų430.9 Ų30.92%0.0218%0.175CC..Hα-helixtrans-62.8-44.1176.8175.6-76.3-47.300111.4A133 M137 I240 A244 A279 F280 L285 M286 L287A133-M283 HydrophobicContact CB-SD 4.33Å; M137-M283 HydrophobicContact CE-CE 3.16Å; M137-M283 HydrophobicContact CE-SD 3.77Å; I240-M283 HydrophobicContact CG2-CG 3.78Å; I240-M283 HydrophobicContact CG2-SD 4.41Å; I240-M283 VanDerWaalsContact O-CG 3.3Å; I240-M283 WeakPolarHBondContact O-CG 3.47Å; A244-M283 HydrophobicContact CB-CB 3.98Å; A244-M283 HydrophobicContact CB-CE 4.08Å; A244-M283 HydrophobicContact CB-CG 3.98Å; A279-M283 WeakPolarHBondContact O-CB 3.45Å; A279-M283 PolarHBondContact O-N 3.09Å; F280-M283 HydrophobicContact CD2-CE 3.6Å; F280-M283 HydrophobicContact CE2-CE 3.68Å; F280-M283 HydrophobicContact CG-CE 4.3Å; F280-M283 HydrophobicContact CZ-CE 4.43Å; F280-M283 PolarHBondContact O-N 3.35Å; M283-L285 PolarHBondContact O-N 3.08Å; M283-M286 PolarHBondContact O-N 2.98Å; M283-L287 VanDerWaalsContact O-CB 3.22Å; M283-L287 WeakPolarHBondContact O-CB 3.2Å; M283-L287 PolarHBondContact O-N 3.36Å; M283-L287 HydrophobicContact SD-CD2 4.46Å
284V96.8Very high94.5Very high71 Ų7130.2 Ų30.243%0.4317%0.17SC..Hα-helixtrans-61.2-46.2177173.70000110.7F280 P281 L287 A288F280-V284 HydrophobicContact CD1-CG2 4.29Å; F280-V284 HydrophobicContact CE1-CG2 3.87Å; F280-V284 HydrophobicContact CE2-CG2 4.4Å; F280-V284 HydrophobicContact CZ-CG2 3.93Å; F280-V284 WeakPolarHBondContact O-CG2 3.37Å; F280-V284 PolarHBondContact O-N 2.87Å; P281-V284 PolarHBondContact O-N 3.47Å; V284-L287 PolarHBondContact O-N 3.43Å; V284-A288 WeakPolarHBondContact O-CB 3.43Å; V284-A288 PolarHBondContact O-N 3.01Å
285L96Very high94.3Very high53 Ų5329.7 Ų29.728%0.27717%0.165SC..Hα-helixtrans-60-50.1177.6179.366.5000111.2P281 N282 M283 L287 A288 I289 C572 L575 W580P281-L285 WeakPolarHBondContact O-CB 3.39Å; P281-L285 PolarHBondContact O-N 3.33Å; N282-L285 PolarHBondContact O-N 3.29Å; M283-L285 PolarHBondContact O-N 3.08Å; L285-L287 VanDerWaalsContact C-N 3.34Å; L285-L287 PolarHBondContact O-N 3.5Å; L285-A288 PolarHBondContact O-N 3.36Å; L285-I289 HydrophobicContact CD1-CD1 3.81Å; L285-I289 HydrophobicContact CD1-CG1 4.44Å; L285-I289 HydrophobicContact CG-CD1 3.98Å; L285-I289 WeakPolarHBondContact O-CG1 3.25Å; L285-I289 PolarHBondContact O-N 3.45Å; L285-C572 HydrophobicContact CD2-CB 4.06Å; L285-C572 HydrophobicContact CG-CB 4.47Å; L285-L575 HydrophobicContact CD2-CD2 3.9Å; L285-W580 HydrophobicContact CD2-CH2 4.45Å
286M95.3Very high94Very high0 Ų034.4 Ų34.40%019%0.186CC..Hα-helixtrans-62.2-42.1179.6-174.2167.355.900111.1I240 N282 M283 S290 L533 C572I240-M286 HydrophobicContact CB-CE 3.89Å; I240-M286 HydrophobicContact CD1-CG 4.07Å; I240-M286 HydrophobicContact CG1-CE 3.64Å; I240-M286 HydrophobicContact CG1-CG 4.17Å; I240-M286 HydrophobicContact CG1-SD 4.15Å; I240-M286 HydrophobicContact CG2-CB 4.45Å; I240-M286 HydrophobicContact CG2-CE 3.66Å; I240-M286 HydrophobicContact CG2-CG 4.43Å; N282-M286 VanDerWaalsContact O-CB 3.28Å; N282-M286 WeakPolarHBondContact O-CB 3.4Å; N282-M286 PolarHBondContact O-N 3.45Å; M283-M286 PolarHBondContact O-N 2.98Å; M286-S290 WeakPolarHBondContact O-CB 3.27Å; M286-S290 PolarHBondContact O-N 3.28Å; M286-S290 PolarHBondContact O-OG 2.89Å; M286-L533 HydrophobicContact CE-CD2 3.88Å; M286-L533 HydrophobicContact SD-CD2 3.58Å; M286-L533 VanDerWaalsContact SD-CD2 3.58Å; M286-C572 HydrophobicContact CB-CB 4.48Å
287L95.8Very high93.7Very high19 Ų1934.9 Ų34.910%0.09919%0.189CC..Hα-helixtrans-63.1-43.4177.6-168.770.7000111.8M129 I130 A133 I240 M283 V284 L285 S290 W291M129-L287 HydrophobicContact CB-CD1 4.21Å; M129-L287 HydrophobicContact CE-CD1 3.86Å; I130-L287 HydrophobicContact CG1-CD2 4.34Å; A133-L287 HydrophobicContact CB-CD1 4Å; A133-L287 HydrophobicContact CB-CD2 3.79Å; I240-L287 HydrophobicContact CG2-CB 4.13Å; I240-L287 HydrophobicContact CG2-CD1 4.14Å; M283-L287 VanDerWaalsContact O-CB 3.22Å; M283-L287 WeakPolarHBondContact O-CB 3.2Å; M283-L287 PolarHBondContact O-N 3.36Å; M283-L287 HydrophobicContact SD-CD2 4.46Å; V284-L287 PolarHBondContact O-N 3.43Å; L285-L287 VanDerWaalsContact C-N 3.34Å; L285-L287 PolarHBondContact O-N 3.5Å; L287-S290 PolarHBondContact O-N 3.32Å; L287-W291 VanDerWaalsContact O-CB 3.28Å; L287-W291 WeakPolarHBondContact O-CB 3.31Å; L287-W291 PolarHBondContact O-N 3.32Å
288A94.8Very high93.3Very high46 Ų4634.1 Ų34.138%0.3818%0.177SC..Hα-helixtrans-64.2-46.3179.400000112V284 L285 W291 L292V284-A288 WeakPolarHBondContact O-CB 3.43Å; V284-A288 PolarHBondContact O-N 3.01Å; L285-A288 PolarHBondContact O-N 3.36Å; A288-W291 PolarHBondContact O-N 3.32Å; A288-L292 WeakPolarHBondContact O-CG 3.47Å; A288-L292 PolarHBondContact O-N 2.81Å; A288-L292 VanDerWaalsContact O-N 3.09Å
289I94.9Very high92.6Very high61 Ų6137.1 Ų37.131%0.31319%0.193SC..Hα-helixtrans-70-38.7179-60.1168000110.6L285 W291 L292 W293 I568L285-I289 HydrophobicContact CD1-CD1 3.81Å; L285-I289 HydrophobicContact CD1-CG1 4.44Å; L285-I289 HydrophobicContact CG-CD1 3.98Å; L285-I289 WeakPolarHBondContact O-CG1 3.25Å; L285-I289 PolarHBondContact O-N 3.45Å; I289-W291 VanDerWaalsContact C-N 3.31Å; I289-W291 PolarHBondContact O-N 3.45Å; I289-L292 PolarHBondContact O-N 3.06Å; I289-W293 WeakPolarHBondContact O-CB 3.25Å; I289-W293 PolarHBondContact O-N 2.97Å; I289-I568 HydrophobicContact CB-CG2 3.88Å; I289-I568 HydrophobicContact CG2-CB 4.42Å; I289-I568 HydrophobicContact CG2-CD1 3.99Å; I289-I568 HydrophobicContact CG2-CG1 4.03Å; I289-I568 HydrophobicContact CG2-CG2 3.49Å; I289-I568 VanDerWaalsContact CG2-CG2 3.49Å
290S93.8Very high91.7Very high0 Ų038.6 Ų38.60%021%0.208CC..Hα-helixtrans-61.5-40.7174.8-60.60000111.8I240 M286 L287 W293 L294 L565I240-S290 WeakPolarHBondContact CD1-OG 3.38Å; M286-S290 WeakPolarHBondContact O-CB 3.27Å; M286-S290 PolarHBondContact O-N 3.28Å; M286-S290 PolarHBondContact O-OG 2.89Å; L287-S290 PolarHBondContact O-N 3.32Å; S290-W293 PolarHBondContact O-N 3.32Å; S290-L294 WeakPolarHBondContact O-CB 3.44Å; S290-L294 VanDerWaalsContact O-CG 3.29Å; S290-L294 WeakPolarHBondContact O-CG 3.37Å; S290-L294 PolarHBondContact O-N 3.45Å; S290-L565 WeakPolarHBondContact OG-CD2 3.42Å
291W92.8Very high90.1Very high27 Ų2742.5 Ų42.510%0.10223%0.225CC..Hα-helixtrans-62.9-45.7175.8168.867.6000111.4M126 M129 L287 A288 I289 W293 L294 Q295 F307M126-W291 HydrophobicContact CE-CD2 3.97Å; M126-W291 HydrophobicContact CE-CE3 4.02Å; M126-W291 HydrophobicContact CE-CH2 3.29Å; M126-W291 HydrophobicContact CE-CZ2 3.16Å; M126-W291 HydrophobicContact CE-CZ3 3.7Å; M129-W291 HydrophobicContact CE-CB 3.88Å; M129-W291 HydrophobicContact SD-CB 3.81Å; M129-W291 HydrophobicContact SD-CG 4.24Å; L287-W291 VanDerWaalsContact O-CB 3.28Å; L287-W291 WeakPolarHBondContact O-CB 3.31Å; L287-W291 PolarHBondContact O-N 3.32Å; A288-W291 PolarHBondContact O-N 3.32Å; I289-W291 VanDerWaalsContact C-N 3.31Å; I289-W291 PolarHBondContact O-N 3.45Å; W291-W293 VanDerWaalsContact C-N 3.34Å; W291-W293 PolarHBondContact O-N 2.97Å; W291-L294 PolarHBondContact O-N 3.02Å; W291-Q295 WeakPolarHBondContact O-CB 3.39Å; W291-Q295 PolarHBondContact O-N 2.78Å; W291-F307 AromaticContact CH2-CE2 3.73Å; W291-F307 HydrophobicContact CH2-CE2 3.73Å; W291-F307 AromaticContact CH2-CZ 3.53Å; W291-F307 HydrophobicContact CH2-CZ 3.53Å; W291-F307 HydrophobicContact CZ2-CE2 4.45Å; W291-F307 HydrophobicContact CZ2-CZ 4.32Å; W291-F307 HydrophobicContact CZ3-CZ 4.38Å
292L91.8Very high88.4Confident89 Ų8945 Ų4547%0.46624%0.235SC..Hα-helixtrans-60.2-42.7175.1-70173.3000112.2A288 I289 F296A288-L292 WeakPolarHBondContact O-CG 3.47Å; A288-L292 PolarHBondContact O-N 2.81Å; A288-L292 VanDerWaalsContact O-N 3.09Å; I289-L292 PolarHBondContact O-N 3.06Å; L292-F296 WeakPolarHBondContact O-CB 3.35Å; L292-F296 PolarHBondContact O-N 2.68Å
293W93Very high86.5Confident50 Ų5049.3 Ų49.319%0.18926%0.258CS..Hα-helixtrans-62.8-49.9177.7169.6-117.1000112.5I289 S290 W291 Q295 F296 M297 A561 M564 I568I289-W293 WeakPolarHBondContact O-CB 3.25Å; I289-W293 PolarHBondContact O-N 2.97Å; S290-W293 PolarHBondContact O-N 3.32Å; W291-W293 VanDerWaalsContact C-N 3.34Å; W291-W293 PolarHBondContact O-N 2.97Å; W293-Q295 VanDerWaalsContact C-N 3.34Å; W293-Q295 PolarHBondContact O-N 3.47Å; W293-F296 HydrophobicContact CE3-CD1 4.08Å; W293-F296 AromaticContact CZ3-CD1 3.84Å; W293-F296 HydrophobicContact CZ3-CD1 3.84Å; W293-F296 HydrophobicContact CZ3-CE1 4.12Å; W293-F296 PolarHBondContact O-N 2.84Å; W293-M297 HydrophobicContact CZ2-SD 4.38Å; W293-M297 WeakPolarHBondContact O-CB 3.29Å; W293-M297 PolarHBondContact O-N 3.01Å; W293-A561 PolarHBondContact NE1-O 2.95Å; W293-A561 VanDerWaalsContact NE1-O 3.15Å; W293-M564 HydrophobicContact CD2-CB 4.09Å; W293-M564 VanDerWaalsContact CE2-CB 3.44Å; W293-M564 HydrophobicContact CH2-CB 4.12Å; W293-M564 HydrophobicContact CH2-CG 3.68Å; W293-M564 HydrophobicContact CZ2-CB 3.48Å; W293-M564 VanDerWaalsContact CZ2-CB 3.48Å; W293-M564 HydrophobicContact CZ2-CG 3.45Å; W293-M564 VanDerWaalsContact CZ2-CG 3.45Å; W293-M564 HydrophobicContact CZ3-CG 4.35Å; W293-I568 HydrophobicContact CB-CD1 4.01Å; W293-I568 HydrophobicContact CG-CD1 4.16Å
294L91.6Very high84.5Confident0 Ų058.4 Ų58.40%030%0.298CS..Hα-helixtrans-66.4-38.5179.2-67172000111.3M125 M129 S233 Y236 S290 W291 F296 M297 F298 A561M125-L294 HydrophobicContact CE-CB 4.13Å; M129-L294 HydrophobicContact CE-CD1 4.13Å; M129-L294 HydrophobicContact SD-CD1 4.24Å; S233-L294 WeakPolarHBondContact OG-CD1 3.42Å; Y236-L294 HydrophobicContact CD2-CD1 4.13Å; Y236-L294 HydrophobicContact CD2-CD2 4.2Å; Y236-L294 HydrophobicContact CE2-CD2 4.2Å; S290-L294 WeakPolarHBondContact O-CB 3.44Å; S290-L294 VanDerWaalsContact O-CG 3.29Å; S290-L294 WeakPolarHBondContact O-CG 3.37Å; S290-L294 PolarHBondContact O-N 3.45Å; W291-L294 PolarHBondContact O-N 3.02Å; L294-F296 PolarHBondContact O-N 2.87Å; L294-M297 PolarHBondContact O-N 3.35Å; L294-F298 HydrophobicContact CD2-CD2 4.49Å; L294-F298 HydrophobicContact CD2-CE2 4.07Å; L294-F298 VanDerWaalsContact O-CD2 3.3Å; L294-F298 WeakPolarHBondContact O-CD2 3.4Å; L294-F298 PolarHBondContact O-N 3.17Å; L294-A561 HydrophobicContact CD2-CB 4.39Å
295Q88.1Confident82.6Confident9 Ų963.7 Ų63.74%0.04232%0.315CS..Hα-helixtrans-61.5-45.2174-173.1-179.43.500111W291 W293 M297 L299 G300 S306W291-Q295 WeakPolarHBondContact O-CB 3.39Å; W291-Q295 PolarHBondContact O-N 2.78Å; W293-Q295 VanDerWaalsContact C-N 3.34Å; W293-Q295 PolarHBondContact O-N 3.47Å; Q295-M297 VanDerWaalsContact C-N 3.33Å; Q295-M297 PolarHBondContact O-N 2.95Å; Q295-L299 HydrophobicContact CG-CB 4.28Å; Q295-L299 HydrophobicContact CG-CD1 4.07Å; Q295-L299 WeakPolarHBondContact O-CA 3.35Å; Q295-L299 WeakPolarHBondContact O-CB 3.47Å; Q295-L299 PolarHBondContact O-N 3.35Å; Q295-G300 PolarHBondContact O-N 3.03Å; Q295-S306 PolarHBondContact NE2-OG 3.15Å
296F87.9Confident80.6Confident100 Ų10061.9 Ų61.944%0.43931%0.307SS..Hα-helixtrans-60.1-43.9175.9170.4-107.8000111.9L292 W293 L294 G300 F301L292-F296 WeakPolarHBondContact O-CB 3.35Å; L292-F296 PolarHBondContact O-N 2.68Å; W293-F296 HydrophobicContact CE3-CD1 4.08Å; W293-F296 AromaticContact CZ3-CD1 3.84Å; W293-F296 HydrophobicContact CZ3-CD1 3.84Å; W293-F296 HydrophobicContact CZ3-CE1 4.12Å; W293-F296 PolarHBondContact O-N 2.84Å; L294-F296 PolarHBondContact O-N 2.87Å; F296-G300 WeakPolarHBondContact O-CA 3.33Å; F296-G300 PolarHBondContact O-N 3.41Å; F296-F301 AromaticContact CD2-CD2 3.35Å; F296-F301 HydrophobicContact CD2-CD2 3.35Å; F296-F301 AromaticContact CD2-CE2 3.41Å; F296-F301 HydrophobicContact CD2-CE2 3.41Å; F296-F301 VanDerWaalsContact CD2-CE2 3.41Å; F296-F301 HydrophobicContact CD2-CG 4.42Å; F296-F301 AromaticContact CE2-CD2 3.43Å; F296-F301 HydrophobicContact CE2-CD2 3.43Å; F296-F301 VanDerWaalsContact CE2-CD2 3.43Å; F296-F301 AromaticContact CE2-CE2 3.55Å; F296-F301 HydrophobicContact CE2-CE2 3.55Å; F296-F301 HydrophobicContact CG-CE2 4.39Å
297M88.3Confident78.6Confident48 Ų4867.1 Ų67.124%0.23633%0.33CS..Hα-helixtrans-67.1-38.8-177.9-178172.5168.400113.6W293 L294 Q295 A561W293-M297 HydrophobicContact CZ2-SD 4.38Å; W293-M297 WeakPolarHBondContact O-CB 3.29Å; W293-M297 PolarHBondContact O-N 3.01Å; L294-M297 PolarHBondContact O-N 3.35Å; Q295-M297 VanDerWaalsContact C-N 3.33Å; Q295-M297 PolarHBondContact O-N 2.95Å; M297-A561 HydrophobicContact CE-CB 4.07Å; M297-A561 HydrophobicContact SD-CB 3.73Å
298F85.2Confident76Confident16 Ų1667.7 Ų67.77%0.0734%0.34CS..Hα-helixtrans-106.5-24.3-171.7-68.4-77.4000114.9L225 K228 G229 L232 L294L225-F298 HydrophobicContact CD1-CD1 3.6Å; L225-F298 HydrophobicContact CD1-CE1 4.07Å; L225-F298 VanDerWaalsContact CD2-O 3.26Å; L225-F298 WeakPolarHBondContact CD2-O 3.13Å; L225-F298 HydrophobicContact CG-CD1 3.95Å; L225-F298 WeakPolarHBondContact O-CD1 3.31Å; K228-F298 HydrophobicContact CB-CD1 4.49Å; K228-F298 HydrophobicContact CB-CE1 3.86Å; G229-F298 VanDerWaalsContact CA-CD2 3.49Å; L232-F298 HydrophobicContact CD1-CE2 3.94Å; L232-F298 HydrophobicContact CD1-CZ 3.63Å; L294-F298 HydrophobicContact CD2-CD2 4.49Å; L294-F298 HydrophobicContact CD2-CE2 4.07Å; L294-F298 VanDerWaalsContact O-CD2 3.3Å; L294-F298 WeakPolarHBondContact O-CD2 3.4Å; L294-F298 PolarHBondContact O-N 3.17Å
299L78.8Confident73.4Confident63 Ų6372.1 Ų72.133%0.3337%0.367SS..Hα-helixtrans-119.5-14.1-177.3-72.1149.6000113.7P121 M125 Q295P121-L299 HydrophobicContact CB-CD2 4.29Å; M125-L299 HydrophobicContact SD-CD1 3.32Å; M125-L299 WeakPolarHBondContact SD-CD1 3.3Å; M125-L299 HydrophobicContact SD-CG 4.43Å; Q295-L299 HydrophobicContact CG-CB 4.28Å; Q295-L299 HydrophobicContact CG-CD1 4.07Å; Q295-L299 WeakPolarHBondContact O-CA 3.35Å; Q295-L299 WeakPolarHBondContact O-CB 3.47Å; Q295-L299 PolarHBondContact O-N 3.35Å
300G77.2Confident70.9Confident31 Ų3171.3 Ų71.332%0.3237%0.373SS..  trans74.1179.1-179.500000115.4Q295 F296 N302Q295-G300 PolarHBondContact O-N 3.03Å; F296-G300 WeakPolarHBondContact O-CA 3.33Å; F296-G300 PolarHBondContact O-N 3.41Å; G300-N302 PolarHBondContact O-N 3.42Å
301F61.4Low68.4Low154 Ų15477.2 Ų77.268%0.67541%0.409SS*.SBendtrans-77.784.6177.6-99.1-81.9000111.6F296 L303F296-F301 AromaticContact CD2-CD2 3.35Å; F296-F301 HydrophobicContact CD2-CD2 3.35Å; F296-F301 AromaticContact CD2-CE2 3.41Å; F296-F301 HydrophobicContact CD2-CE2 3.41Å; F296-F301 VanDerWaalsContact CD2-CE2 3.41Å; F296-F301 HydrophobicContact CD2-CG 4.42Å; F296-F301 AromaticContact CE2-CD2 3.43Å; F296-F301 HydrophobicContact CE2-CD2 3.43Å; F296-F301 VanDerWaalsContact CE2-CD2 3.43Å; F296-F301 AromaticContact CE2-CE2 3.55Å; F296-F301 HydrophobicContact CE2-CE2 3.55Å; F296-F301 HydrophobicContact CG-CE2 4.39Å; F301-L303 HydrophobicContact CD1-CD1 4.12Å; F301-L303 HydrophobicContact CE1-CD1 4.25Å
302N61.3Low66.3Low103 Ų10384.1 Ų84.155%0.55144%0.44SS*.  trans-138.563.2169.5-87.6-47.7000111.7G300 K304 K305 S306G300-N302 PolarHBondContact O-N 3.42Å; N302-K304 VanDerWaalsContact C-N 3.3Å; N302-K304 PolarHBondContact O-N 3.26Å; N302-K305 HydrophobicContact CB-CB 4.4Å; N302-K305 PolarHBondContact O-N 3.48Å; N302-K305 VanDerWaalsContact O-N 3.16Å; N302-S306 WeakPolarHBondContact O-CB 3.36Å; N302-S306 PolarHBondContact O-N 3.18Å; N302-S306 PolarHBondContact O-OG 3.02Å
303L56.3Low64.7Low91 Ų9184.1 Ų84.148%0.47644%0.44SS..Hα-helixtrans-56.6-38179.6-77.4145.3000112.8F301 K305 S306 F307F301-L303 HydrophobicContact CD1-CD1 4.12Å; F301-L303 HydrophobicContact CE1-CD1 4.25Å; L303-K305 PolarHBondContact O-N 3.03Å; L303-S306 PolarHBondContact O-N 3.19Å; L303-F307 HydrophobicContact CD2-CD2 4.06Å; L303-F307 HydrophobicContact CD2-CE2 4.01Å; L303-F307 WeakPolarHBondContact O-CB 3.3Å; L303-F307 PolarHBondContact O-N 3.15Å
304K54.1Low63.1Low196 Ų19686.9 Ų86.985%0.85246%0.459SS*.Hα-helixtrans-63.8-35.9176.9-87.6-174.6176.7179.90113.4N302 G308N302-K304 VanDerWaalsContact C-N 3.3Å; N302-K304 PolarHBondContact O-N 3.26Å; K304-G308 WeakPolarHBondContact O-CA 3.44Å; K304-G308 PolarHBondContact O-N 3.19Å
305K56.1Low61.7Low181 Ų18190.8 Ų90.879%0.78747%0.474SS*.Hα-helixtrans-83.8-27.4177.5-158.7174.1-178.5179.10111.9N302 L303N302-K305 HydrophobicContact CB-CB 4.4Å; N302-K305 PolarHBondContact O-N 3.48Å; N302-K305 VanDerWaalsContact O-N 3.16Å; L303-K305 PolarHBondContact O-N 3.03Å
306S53.8Low60.6Low16 Ų1692.4 Ų92.411%0.11248%0.483CS..Hα-helixtrans-76.3-39.5177.9-58.80000113.3Q295 N302 L303Q295-S306 PolarHBondContact NE2-OG 3.15Å; N302-S306 WeakPolarHBondContact O-CB 3.36Å; N302-S306 PolarHBondContact O-N 3.18Å; N302-S306 PolarHBondContact O-OG 3.02Å; L303-S306 PolarHBondContact O-N 3.19Å
307F53Low59.7Low110 Ų11093.2 Ų93.248%0.48249%0.486SS..Hα-helixtrans-107.3-13.8-179.2-81.2-85.3000114.7M126 W291 L303 C309M126-F307 HydrophobicContact CE-CZ 4.41Å; W291-F307 AromaticContact CH2-CE2 3.73Å; W291-F307 HydrophobicContact CH2-CE2 3.73Å; W291-F307 AromaticContact CH2-CZ 3.53Å; W291-F307 HydrophobicContact CH2-CZ 3.53Å; W291-F307 HydrophobicContact CZ2-CE2 4.45Å; W291-F307 HydrophobicContact CZ2-CZ 4.32Å; W291-F307 HydrophobicContact CZ3-CZ 4.38Å; L303-F307 HydrophobicContact CD2-CD2 4.06Å; L303-F307 HydrophobicContact CD2-CE2 4.01Å; L303-F307 WeakPolarHBondContact O-CB 3.3Å; L303-F307 PolarHBondContact O-N 3.15Å; F307-C309 PolarHBondContact O-N 3.36Å
308G42.4Very low58.7Low31 Ų3195 Ų9532%0.3249%0.494SS..  trans-62.4126.5-172.600000111.9R120 K304 G310R120-G308 PolarHBondContact NH1-O 3.04Å; R120-G308 PolarHBondContact NH2-O 3.41Å; K304-G308 WeakPolarHBondContact O-CA 3.44Å; K304-G308 PolarHBondContact O-N 3.19Å; G308-G310 PolarHBondContact O-N 3.1Å
309C39.5Very low57.8Low139 Ų13994.3 Ų94.394%0.93949%0.491SS*.  trans-64.862.1168.2-83.40000111.5F307F307-C309 PolarHBondContact O-N 3.36Å
310G42Very low57.6Low44 Ų4495.8 Ų95.845%0.45449%0.493SS..  trans-77.7147.9168.400000111.4R120 G308R120-G310 PolarHBondContact NH2-O 3.13Å; G308-G310 PolarHBondContact O-N 3.1Å
311V42Very low57.5Low123 Ų12396.8 Ų96.875%0.74550%0.498SS*.  trans-38.7134.1-178.4-176.10000112.1N313V311-N313 VanDerWaalsContact C-N 3.34Å; V311-N313 PolarHBondContact O-N 2.92Å
312K48.3Very low57.9Low172 Ų17290.8 Ų90.875%0.74847%0.474SS*.  trans-57.895.8171.5-75.1177.5176.8175.70108.6
313N57.6Low58.5Low89 Ų8986.1 Ų86.148%0.47645%0.449SS..  trans-65.8148.5173.6-78.5-10.8000108.9V311 R315 D316V311-N313 VanDerWaalsContact C-N 3.34Å; V311-N313 PolarHBondContact O-N 2.92Å; N313-R315 HydrophobicContact CB-CB 4.37Å; N313-R315 PolarHBondContact O-N 3.49Å; N313-D316 PolarHBondContact O-N 3.09Å
314D59.9Low59.7Low108 Ų10888 Ų8858%0.57845%0.45SS*.Hα-helixtrans-57-24.9176.1-71-38.9000112.5D316 K317 E318D314-D316 PolarHBondContact O-N 2.89Å; D314-K317 WeakPolarHBondContact O-CB 3.45Å; D314-K317 PolarHBondContact O-N 3.49Å; D314-K317 VanDerWaalsContact O-N 3.15Å; D314-K317 IonicContact OD1-NZ 3.9Å; D314-K317 PolarHBondContact OD1-NZ 3.04Å; D314-E318 PolarHBondContact O-N 3.27Å
315R61.9Low60.9Low83 Ų8383.8 Ų83.831%0.31343%0.433SS..Hα-helixtrans-57.8-41.6172-53.8-178.8-171.3-175.60.2113.5T162 D170 N313 K317 E318 A319T162-R315 HydrophobicContact CG2-CB 4.12Å; T162-R315 HydrophobicContact CG2-CG 4.18Å; D170-R315 IonicContact OD2-NH2 3.03Å; N313-R315 HydrophobicContact CB-CB 4.37Å; N313-R315 PolarHBondContact O-N 3.49Å; R315-K317 VanDerWaalsContact C-N 3.27Å; R315-K317 PolarHBondContact O-N 3.27Å; R315-E318 PolarHBondContact O-N 2.93Å; R315-A319 PolarHBondContact O-N 3.25Å
316D66.2Low61.9Low43 Ų4377.7 Ų77.723%0.2341%0.407CS..Hα-helixtrans-69.6-28.8178.9-69.4-14.7000111.2V119 N313 D314 Y320V119-D316 WeakPolarHBondContact CG2-O 3.39Å; N313-D316 PolarHBondContact O-N 3.09Å; D314-D316 PolarHBondContact O-N 2.89Å; D316-Y320 VanDerWaalsContact O-CB 3.26Å; D316-Y320 WeakPolarHBondContact O-CB 3.34Å; D316-Y320 PolarHBondContact O-N 3.31Å
317K68.9Low63.2Low117 Ų11779.9 Ų79.951%0.50941%0.413SS..Hα-helixtrans-72.6-38178.7-62.1176.8-170.1155.40111.5D314 R315 A321D314-K317 WeakPolarHBondContact O-CB 3.45Å; D314-K317 PolarHBondContact O-N 3.49Å; D314-K317 VanDerWaalsContact O-N 3.15Å; D314-K317 IonicContact OD1-NZ 3.9Å; D314-K317 PolarHBondContact OD1-NZ 3.04Å; R315-K317 VanDerWaalsContact C-N 3.27Å; R315-K317 PolarHBondContact O-N 3.27Å; K317-A321 WeakPolarHBondContact O-CB 3.37Å; K317-A321 PolarHBondContact O-N 3.46Å
318E67.3Low64.7Low85 Ų8581 Ų8140%0.39742%0.418SS..Hα-helixtrans-67.6-48.6179.7-70.4-174.8-177.100111.9T162 D314 R315 Y320 A321 V322T162-E318 WeakPolarHBondContact CB-OE2 3.27Å; T162-E318 HydrophobicContact CG2-CB 4.36Å; T162-E318 WeakPolarHBondContact CG2-OE2 3.39Å; T162-E318 PolarHBondContact OG1-OE2 3.42Å; D314-E318 PolarHBondContact O-N 3.27Å; R315-E318 PolarHBondContact O-N 2.93Å; E318-Y320 VanDerWaalsContact C-N 3.31Å; E318-Y320 PolarHBondContact O-N 3.24Å; E318-A321 WeakPolarHBondContact O-CA 3.48Å; E318-A321 VanDerWaalsContact O-CB 3.28Å; E318-A321 WeakPolarHBondContact O-CB 3.48Å; E318-A321 PolarHBondContact O-N 3.28Å; E318-V322 PolarHBondContact O-N 2.73Å
319A65.9Low66.7Low2 Ų286 Ų862%0.01743%0.431CS..Hα-helixtrans-68.5-31.5178.200000112.4V119 L159 R315 A321 V322 M323V119-A319 HydrophobicContact CB-CB 4.43Å; V119-A319 HydrophobicContact CG1-CB 3.34Å; L159-A319 HydrophobicContact CD2-CB 3.33Å; L159-A319 HydrophobicContact CG-CB 3.84Å; R315-A319 PolarHBondContact O-N 3.25Å; A319-A321 VanDerWaalsContact C-N 3.33Å; A319-V322 PolarHBondContact O-N 3.43Å; A319-M323 PolarHBondContact O-N 3.16Å
320Y74.8Confident68.7Low93 Ų9381.2 Ų81.237%0.36540%0.396SS..Hα-helixtrans-62.8-39.7167.7-173.2-95.3000112.3L115 V119 D316 E318 V322 M323 R324L115-Y320 HydrophobicContact CB-CE2 4.37Å; L115-Y320 HydrophobicContact CD2-CD2 4.15Å; L115-Y320 HydrophobicContact CD2-CE1 4.35Å; L115-Y320 HydrophobicContact CD2-CE2 3.65Å; L115-Y320 WeakPolarHBondContact O-CE2 3.34Å; V119-Y320 HydrophobicContact CG2-CD2 4.2Å; D316-Y320 VanDerWaalsContact O-CB 3.26Å; D316-Y320 WeakPolarHBondContact O-CB 3.34Å; D316-Y320 PolarHBondContact O-N 3.31Å; E318-Y320 VanDerWaalsContact C-N 3.31Å; E318-Y320 PolarHBondContact O-N 3.24Å; Y320-V322 PolarHBondContact O-N 2.84Å; Y320-M323 HydrophobicContact CD2-CE 4.38Å; Y320-M323 PolarHBondContact O-N 2.96Å; Y320-R324 WeakPolarHBondContact O-CB 3.37Å; Y320-R324 PolarHBondContact O-N 2.91Å
321A75.6Confident70.8Confident52 Ų5281 Ų8143%0.4339%0.394SS..Hα-helixtrans-60.8-35.4-178.700000111.6K317 E318 A319 R324 E325K317-A321 WeakPolarHBondContact O-CB 3.37Å; K317-A321 PolarHBondContact O-N 3.46Å; E318-A321 WeakPolarHBondContact O-CA 3.48Å; E318-A321 VanDerWaalsContact O-CB 3.28Å; E318-A321 WeakPolarHBondContact O-CB 3.48Å; E318-A321 PolarHBondContact O-N 3.28Å; A319-A321 VanDerWaalsContact C-N 3.33Å; A321-R324 WeakPolarHBondContact O-CB 3.17Å; A321-R324 PolarHBondContact O-N 3.02Å; A321-E325 WeakPolarHBondContact O-CB 3.18Å; A321-E325 PolarHBondContact O-N 2.91Å
322V70.3Confident72.9Confident29 Ų2978.2 Ų78.218%0.17639%0.39CS..Hα-helixtrans-77-43.6-179-175.60000111.5Q158 E318 A319 Y320 R324 E325 E326Q158-V322 VanDerWaalsContact CD-CG1 3.47Å; Q158-V322 VanDerWaalsContact NE2-CG2 3.27Å; E318-V322 PolarHBondContact O-N 2.73Å; A319-V322 PolarHBondContact O-N 3.43Å; Y320-V322 PolarHBondContact O-N 2.84Å; V322-R324 PolarHBondContact O-N 3.49Å; V322-E325 CarbonylContact O-C 3.58Å; V322-E325 WeakPolarHBondContact O-CA 3.38Å; V322-E325 WeakPolarHBondContact O-CB 3.21Å; V322-E325 PolarHBondContact O-N 3.07Å; V322-E326 PolarHBondContact O-N 3.16Å
323M72Confident74.7Confident4 Ų474.7 Ų74.72%0.0238%0.377CS..Hα-helixtrans-56.3-36.9173.1-62.4-165.3-35.500110.8L114 L115 V155 A319 Y320 Y327L114-M323 HydrophobicContact CB-CE 4.42Å; L114-M323 HydrophobicContact CB-SD 4.27Å; L114-M323 WeakPolarHBondContact O-CE 3.45Å; L115-M323 HydrophobicContact CD2-CB 3.82Å; L115-M323 HydrophobicContact CD2-CE 3.91Å; L115-M323 HydrophobicContact CG-CB 4.49Å; L115-M323 HydrophobicContact CG-CE 4.38Å; V155-M323 HydrophobicContact CG2-CG 3.88Å; V155-M323 HydrophobicContact CG2-SD 4.33Å; A319-M323 PolarHBondContact O-N 3.16Å; Y320-M323 HydrophobicContact CD2-CE 4.38Å; Y320-M323 PolarHBondContact O-N 2.96Å; M323-Y327 WeakPolarHBondContact O-CB 3.23Å; M323-Y327 PolarHBondContact O-N 3.41Å
324R81.4Confident76.2Confident132 Ų13276.4 Ų76.450%0.49838%0.381SS..Hα-helixtrans-68.9-34.8175.2-171-179.8-174.4-157.13.6111.9L115 Y320 A321 V322 Y327 K328L115-R324 HydrophobicContact CD2-CB 4.11Å; Y320-R324 WeakPolarHBondContact O-CB 3.37Å; Y320-R324 PolarHBondContact O-N 2.91Å; A321-R324 WeakPolarHBondContact O-CB 3.17Å; A321-R324 PolarHBondContact O-N 3.02Å; V322-R324 PolarHBondContact O-N 3.49Å; R324-Y327 PolarHBondContact O-N 2.64Å; R324-K328 WeakPolarHBondContact O-CB 3.45Å; R324-K328 VanDerWaalsContact O-CG 3.28Å; R324-K328 WeakPolarHBondContact O-CG 3.42Å; R324-K328 PolarHBondContact O-N 3.42Å
325E81.1Confident77.6Confident106 Ų10675.3 Ų75.350%0.49537%0.371SS..Hα-helixtrans-66.8-46.8174.4-166.5178.6169.600111.7A321 V322 Y327 K328 K329A321-E325 WeakPolarHBondContact O-CB 3.18Å; A321-E325 PolarHBondContact O-N 2.91Å; V322-E325 CarbonylContact O-C 3.58Å; V322-E325 WeakPolarHBondContact O-CA 3.38Å; V322-E325 WeakPolarHBondContact O-CB 3.21Å; V322-E325 PolarHBondContact O-N 3.07Å; E325-Y327 VanDerWaalsContact C-N 3.27Å; E325-Y327 PolarHBondContact O-N 3.31Å; E325-K328 CarbonylContact O-C 3.59Å; E325-K328 WeakPolarHBondContact O-CA 3.41Å; E325-K328 WeakPolarHBondContact O-CB 3.46Å; E325-K328 PolarHBondContact O-N 2.95Å; E325-K329 WeakPolarHBondContact O-CG 3.41Å; E325-K329 PolarHBondContact O-N 2.87Å
326E76.4Confident78.9Confident53 Ų5371.4 Ų71.425%0.24836%0.356CS..Hα-helixtrans-57.4-40172-80.3-60130.100112K107 L111 V322 K329K107-E326 IonicContact NZ-OE2 2.74Å; L111-E326 HydrophobicContact CD1-CB 4.2Å; L111-E326 HydrophobicContact CD2-CB 4.36Å; V322-E326 PolarHBondContact O-N 3.16Å; E326-K329 PolarHBondContact O-N 3.37Å; E326-K329 WeakPolarHBondContact OE1-CD 3.39Å; E326-K329 IonicContact OE1-NZ 2.87Å; E326-K329 PolarHBondContact OE1-NZ 3.16Å
327Y81.6Confident80.1Confident62 Ų6269.8 Ų69.824%0.24335%0.347CS..Hα-helixtrans-66.4-40.2173.4-175.7-96.7000112.3R108 L111 R112 L115 M323 R324 E325 K329 L330R108-Y327 HydrophobicContact CG-CE2 3.86Å; L111-Y327 HydrophobicContact CB-CD2 3.92Å; R112-Y327 HydrophobicContact CB-CE2 4.15Å; L115-Y327 HydrophobicContact CD1-CD1 4.42Å; L115-Y327 HydrophobicContact CD1-CD2 4.32Å; L115-Y327 HydrophobicContact CD1-CG 3.95Å; M323-Y327 WeakPolarHBondContact O-CB 3.23Å; M323-Y327 PolarHBondContact O-N 3.41Å; R324-Y327 PolarHBondContact O-N 2.64Å; E325-Y327 VanDerWaalsContact C-N 3.27Å; E325-Y327 PolarHBondContact O-N 3.31Å; Y327-K329 VanDerWaalsContact C-N 3.31Å; Y327-K329 PolarHBondContact O-N 3.39Å; Y327-L330 HydrophobicContact CD2-CD1 4.42Å; Y327-L330 WeakPolarHBondContact O-CB 3.43Å; Y327-L330 PolarHBondContact O-N 2.88Å
328K84.6Confident81.2Confident135 Ų13565.3 Ų65.359%0.58733%0.334SS*.Hα-helixtrans-64.3-34.2176.2-78.9175.7177.7-176.20112.2R324 E325 L330 G331R324-K328 WeakPolarHBondContact O-CB 3.45Å; R324-K328 VanDerWaalsContact O-CG 3.28Å; R324-K328 WeakPolarHBondContact O-CG 3.42Å; R324-K328 PolarHBondContact O-N 3.42Å; E325-K328 CarbonylContact O-C 3.59Å; E325-K328 WeakPolarHBondContact O-CA 3.41Å; E325-K328 WeakPolarHBondContact O-CB 3.46Å; E325-K328 PolarHBondContact O-N 2.95Å; K328-L330 PolarHBondContact O-N 3.28Å; K328-L330 VanDerWaalsContact O-N 3.17Å; K328-G331 PolarHBondContact O-N 3.43Å
329K84.6Confident82.5Confident136 Ų13662 Ų6259%0.59132%0.321SS*.Hα-helixtrans-58.7-24.5175.8-71.6175.9-171.3172.90113.1E325 E326 Y327 G331E325-K329 WeakPolarHBondContact O-CG 3.41Å; E325-K329 PolarHBondContact O-N 2.87Å; E326-K329 PolarHBondContact O-N 3.37Å; E326-K329 WeakPolarHBondContact OE1-CD 3.39Å; E326-K329 IonicContact OE1-NZ 2.87Å; E326-K329 PolarHBondContact OE1-NZ 3.16Å; Y327-K329 VanDerWaalsContact C-N 3.31Å; Y327-K329 PolarHBondContact O-N 3.39Å; K329-G331 VanDerWaalsContact C-N 3.31Å; K329-G331 PolarHBondContact O-N 3.2Å
330L81.1Confident83.8Confident37 Ų3761.9 Ų61.919%0.19432%0.321CS..THydrogen-bonded Turntrans-73.8-18.8176-68.1167.7000113.8K107 R108 L111 Y327 K328K107-L330 HydrophobicContact CD-CD2 4.15Å; K107-L330 HydrophobicContact CG-CD1 4.41Å; K107-L330 HydrophobicContact CG-CD2 4.36Å; R108-L330 HydrophobicContact CB-CD1 4.14Å; L111-L330 HydrophobicContact CD1-CD1 3.82Å; Y327-L330 HydrophobicContact CD2-CD1 4.42Å; Y327-L330 WeakPolarHBondContact O-CB 3.43Å; Y327-L330 PolarHBondContact O-N 2.88Å; K328-L330 PolarHBondContact O-N 3.28Å; K328-L330 VanDerWaalsContact O-N 3.17Å
331G85.9Confident84.8Confident41 Ų4160 Ų6042%0.42332%0.316SS..  trans66.6-170.7-17500000114.3R108 K328 K329R108-G331 PolarHBondContact NH1-O 2.99Å; R108-G331 PolarHBondContact NH2-O 3.36Å; R108-G331 VanDerWaalsContact NH2-O 3.15Å; K328-G331 PolarHBondContact O-N 3.43Å; K329-G331 VanDerWaalsContact C-N 3.31Å; K329-G331 PolarHBondContact O-N 3.2Å
332G86.4Confident85.7Confident63 Ų6361.4 Ų61.465%0.64932%0.32SS*.SBendtrans-65.6156177.100000113.2R108 K334R108-G332 PolarHBondContact NH2-O 3.2Å; G332-K334 PolarHBondContact O-N 2.84Å
333M86.2Confident86.9Confident98 Ų9860.3 Ų60.348%0.48331%0.313SS..PPolyproline II helixtrans-65.9121.1-179.9-165.8175.6-17100110.3L105 E337 L341L105-M333 HydrophobicContact CD1-CE 4.14Å; M333-E337 HydrophobicContact CE-CB 4.16Å; M333-E337 HydrophobicContact CG-CB 3.96Å; M333-L341 HydrophobicContact CE-CB 4.34Å; M333-L341 HydrophobicContact CE-CD2 3.8Å
334K87.7Confident87.9Confident126 Ų12661.8 Ų61.855%0.54832%0.319SS..PPolyproline II helixtrans-76.3155.1178.4-65.6172.4-175.9164.20110.5G332 A336 E337 G338G332-K334 PolarHBondContact O-N 2.84Å; K334-A336 VanDerWaalsContact C-N 3.26Å; K334-A336 PolarHBondContact O-N 3.36Å; K334-E337 HydrophobicContact CB-CG 4.26Å; K334-E337 WeakPolarHBondContact O-CB 3.34Å; K334-E337 PolarHBondContact O-N 3.33Å; K334-G338 PolarHBondContact O-N 2.7Å; K334-G338 VanDerWaalsContact O-N 3.09Å
335F89.1Confident88.5Confident85 Ų8559.5 Ų59.537%0.37332%0.316SS..Hα-helixtrans-52.8-44.7174.7176-100.7000112.3E337 G338 A339 P391 L394F335-E337 VanDerWaalsContact C-N 3.35Å; F335-E337 PolarHBondContact O-N 2.93Å; F335-G338 CarbonylContact O-C 3.49Å; F335-G338 WeakPolarHBondContact O-CA 3.3Å; F335-G338 PolarHBondContact O-N 3.43Å; F335-G338 VanDerWaalsContact O-N 3.1Å; F335-A339 HydrophobicContact CE1-CB 4.35Å; F335-A339 HydrophobicContact CZ-CB 4.49Å; F335-A339 PolarHBondContact O-N 3.12Å; F335-P391 WeakPolarHBondContact CE1-O 3.28Å; F335-L394 HydrophobicContact CD1-CG 4.35Å; F335-L394 HydrophobicContact CD2-CD1 3.64Å; F335-L394 HydrophobicContact CD2-CG 3.69Å; F335-L394 HydrophobicContact CE1-CG 4.14Å; F335-L394 HydrophobicContact CE2-CD1 3.63Å; F335-L394 HydrophobicContact CE2-CD2 3.82Å; F335-L394 HydrophobicContact CE2-CG 3.46Å; F335-L394 VanDerWaalsContact CE2-CG 3.46Å; F335-L394 HydrophobicContact CG-CD1 4.39Å; F335-L394 HydrophobicContact CG-CG 4.14Å; F335-L394 HydrophobicContact CZ-CD1 4.37Å; F335-L394 HydrophobicContact CZ-CD2 3.8Å; F335-L394 HydrophobicContact CZ-CG 3.7Å
336A89.5Confident89.2Confident1 Ų158.4 Ų58.41%0.00831%0.313CS..Hα-helixtrans-61.2-39.2177.700000113.6W103 K334 G338 A339 V340 S392 L429W103-A336 HydrophobicContact CD2-CB 3.45Å; W103-A336 VanDerWaalsContact CD2-CB 3.45Å; W103-A336 HydrophobicContact CE3-CB 3.3Å; W103-A336 HydrophobicContact CG-CB 4.29Å; W103-A336 HydrophobicContact CH2-CB 3.51Å; W103-A336 HydrophobicContact CZ2-CB 3.63Å; W103-A336 HydrophobicContact CZ3-CB 3.33Å; K334-A336 VanDerWaalsContact C-N 3.26Å; K334-A336 PolarHBondContact O-N 3.36Å; A336-G338 VanDerWaalsContact C-N 3.29Å; A336-G338 PolarHBondContact O-N 3.01Å; A336-A339 PolarHBondContact O-N 2.88Å; A336-V340 WeakPolarHBondContact O-CB 3.33Å; A336-V340 VanDerWaalsContact O-CG2 3.25Å; A336-V340 WeakPolarHBondContact O-CG2 3.46Å; A336-V340 PolarHBondContact O-N 2.87Å; A336-S392 WeakPolarHBondContact CB-O 3.49Å; A336-L429 HydrophobicContact CB-CD2 3.59Å
337E91.8Very high90.1Very high9 Ų956 Ų564%0.04230%0.302CS..Hα-helixtrans-62.4-40.4174.1-68.4169.6-143.800110.8W103 L105 R108 M333 K334 F335 L341W103-E337 HydrophobicContact CB-CG 4.37Å; L105-E337 HydrophobicContact CD1-CB 4.36Å; R108-E337 IonicContact CZ-OE2 2.78Å; R108-E337 IonicContact NE-OE2 2.81Å; R108-E337 PolarHBondContact NE-OE2 3.48Å; R108-E337 IonicContact NH2-OE1 3.18Å; R108-E337 PolarHBondContact NH2-OE1 2.94Å; R108-E337 IonicContact NH2-OE2 3.39Å; R108-E337 PolarHBondContact NH2-OE2 3.3Å; M333-E337 HydrophobicContact CE-CB 4.16Å; M333-E337 HydrophobicContact CG-CB 3.96Å; K334-E337 HydrophobicContact CB-CG 4.26Å; K334-E337 WeakPolarHBondContact O-CB 3.34Å; K334-E337 PolarHBondContact O-N 3.33Å; F335-E337 VanDerWaalsContact C-N 3.35Å; F335-E337 PolarHBondContact O-N 2.93Å; E337-L341 WeakPolarHBondContact O-CB 3.23Å; E337-L341 PolarHBondContact O-N 3.36Å
338G92.1Very high90.6Very high23 Ų2354.2 Ų54.224%0.23730%0.298CS..Hα-helixtrans-64.7-47.4175.500000112.5K334 F335 A336 V340 L341 T342K334-G338 PolarHBondContact O-N 2.7Å; K334-G338 VanDerWaalsContact O-N 3.09Å; F335-G338 CarbonylContact O-C 3.49Å; F335-G338 WeakPolarHBondContact O-CA 3.3Å; F335-G338 PolarHBondContact O-N 3.43Å; F335-G338 VanDerWaalsContact O-N 3.1Å; A336-G338 VanDerWaalsContact C-N 3.29Å; A336-G338 PolarHBondContact O-N 3.01Å; G338-V340 PolarHBondContact O-N 3.45Å; G338-L341 PolarHBondContact O-N 3.37Å; G338-T342 PolarHBondContact O-N 2.97Å; G338-T342 PolarHBondContact O-OG1 3.1Å; G338-T342 VanDerWaalsContact O-OG1 3.07Å
339A93.8Very high91Very high15 Ų1552.4 Ų52.412%0.12429%0.294CS..Hα-helixtrans-62.2-44.5178.900000112F335 A336 L341 T342 I343 I390 L429F335-A339 HydrophobicContact CE1-CB 4.35Å; F335-A339 HydrophobicContact CZ-CB 4.49Å; F335-A339 PolarHBondContact O-N 3.12Å; A336-A339 PolarHBondContact O-N 2.88Å; A339-L341 VanDerWaalsContact C-N 3.34Å; A339-L341 PolarHBondContact O-N 3.2Å; A339-T342 PolarHBondContact O-N 3.5Å; A339-I343 VanDerWaalsContact O-CG1 3.27Å; A339-I343 WeakPolarHBondContact O-CG1 3.33Å; A339-I343 PolarHBondContact O-N 3.32Å; A339-I390 HydrophobicContact CB-CG2 4.43Å; A339-L429 HydrophobicContact CB-CD1 3.95Å; A339-L429 HydrophobicContact CB-CD2 4.36Å
340V94.4Very high91.4Very high0 Ų048.5 Ų48.50%028%0.279CS..Hα-helixtrans-62.1-42.9175.7172.70000111A99 V100 W103 L105 A336 G338 T342 I343 F344 F387 L429A99-V340 HydrophobicContact CB-CG1 4.26Å; A99-V340 HydrophobicContact CB-CG2 4.46Å; V100-V340 HydrophobicContact CB-CG1 4.5Å; V100-V340 HydrophobicContact CG2-CG1 3.76Å; W103-V340 HydrophobicContact CG-CG2 4.21Å; L105-V340 HydrophobicContact CD2-CB 4.43Å; L105-V340 HydrophobicContact CD2-CG1 4Å; A336-V340 WeakPolarHBondContact O-CB 3.33Å; A336-V340 VanDerWaalsContact O-CG2 3.25Å; A336-V340 WeakPolarHBondContact O-CG2 3.46Å; A336-V340 PolarHBondContact O-N 2.87Å; G338-V340 PolarHBondContact O-N 3.45Å; V340-T342 VanDerWaalsContact C-N 3.34Å; V340-T342 PolarHBondContact O-N 2.76Å; V340-I343 PolarHBondContact O-N 3.26Å; V340-F344 VanDerWaalsContact O-CB 3.26Å; V340-F344 WeakPolarHBondContact O-CB 3.37Å; V340-F344 PolarHBondContact O-N 3.01Å; V340-F387 HydrophobicContact CB-CE1 4.42Å; V340-F387 HydrophobicContact CG1-CE1 4.27Å; V340-F387 HydrophobicContact CG2-CD1 4.43Å; V340-F387 HydrophobicContact CG2-CE1 4.08Å; V340-L429 HydrophobicContact CG2-CD1 4.18Å; V340-L429 HydrophobicContact CG2-CD2 4.18Å
341L94.2Very high91.9Very high52 Ų5247 Ų4727%0.27227%0.271SS..Hα-helixtrans-61.6-42.1176-178.562.5000111.8L105 M333 E337 G338 A339 F344 I345L105-L341 HydrophobicContact CD1-CB 4.45Å; L105-L341 HydrophobicContact CD2-CB 3.86Å; L105-L341 HydrophobicContact CD2-CD1 4.25Å; M333-L341 HydrophobicContact CE-CB 4.34Å; M333-L341 HydrophobicContact CE-CD2 3.8Å; E337-L341 WeakPolarHBondContact O-CB 3.23Å; E337-L341 PolarHBondContact O-N 3.36Å; G338-L341 PolarHBondContact O-N 3.37Å; A339-L341 VanDerWaalsContact C-N 3.34Å; A339-L341 PolarHBondContact O-N 3.2Å; L341-F344 PolarHBondContact O-N 3.01Å; L341-I345 HydrophobicContact CD1-CD1 4.04Å; L341-I345 HydrophobicContact CD1-CG1 4.3Å; L341-I345 HydrophobicContact CG-CD1 3.91Å; L341-I345 VanDerWaalsContact O-CG1 3.28Å; L341-I345 WeakPolarHBondContact O-CG1 3.18Å; L341-I345 PolarHBondContact O-N 3.35Å
342T94.9Very high92.1Very high82 Ų8248.1 Ų48.150%0.50326%0.264SS..Hα-helixtrans-63.6-47.4176.8-590000111.7G338 A339 V340 F344 I345 L346G338-T342 PolarHBondContact O-N 2.97Å; G338-T342 PolarHBondContact O-OG1 3.1Å; G338-T342 VanDerWaalsContact O-OG1 3.07Å; A339-T342 PolarHBondContact O-N 3.5Å; V340-T342 VanDerWaalsContact C-N 3.34Å; V340-T342 PolarHBondContact O-N 2.76Å; T342-F344 VanDerWaalsContact C-N 3.29Å; T342-F344 PolarHBondContact O-N 2.61Å; T342-I345 PolarHBondContact O-N 3.42Å; T342-L346 HydrophobicContact CG2-CD1 4.03Å; T342-L346 HydrophobicContact CG2-CG 4.43Å; T342-L346 WeakPolarHBondContact O-CB 3.44Å; T342-L346 VanDerWaalsContact O-CG 3.28Å; T342-L346 WeakPolarHBondContact O-CG 3.4Å; T342-L346 PolarHBondContact O-N 2.97Å
343I95.5Very high92.3Very high7 Ų748.3 Ų48.34%0.03625%0.253CS..Hα-helixtrans-60.3-42.4177.3-66.3164.2000110.3A339 V340 L346 L347 M383 L386 F387 I390 L429A339-I343 VanDerWaalsContact O-CG1 3.27Å; A339-I343 WeakPolarHBondContact O-CG1 3.33Å; A339-I343 PolarHBondContact O-N 3.32Å; V340-I343 PolarHBondContact O-N 3.26Å; I343-L346 PolarHBondContact O-N 2.97Å; I343-L347 WeakPolarHBondContact O-CB 3.3Å; I343-L347 PolarHBondContact O-N 3.09Å; I343-M383 HydrophobicContact CG2-CB 4.48Å; I343-M383 HydrophobicContact CG2-CE 3.95Å; I343-M383 VanDerWaalsContact O-CE 3.29Å; I343-M383 WeakPolarHBondContact O-CE 3.31Å; I343-L386 HydrophobicContact CD1-CB 4.42Å; I343-F387 HydrophobicContact CB-CE1 3.9Å; I343-F387 HydrophobicContact CB-CZ 4.12Å; I343-F387 HydrophobicContact CD1-CD1 3.66Å; I343-F387 HydrophobicContact CD1-CE1 3.57Å; I343-F387 HydrophobicContact CD1-CZ 4.48Å; I343-F387 HydrophobicContact CG1-CE1 4.36Å; I343-F387 HydrophobicContact CG2-CD1 4.39Å; I343-F387 HydrophobicContact CG2-CE1 3.62Å; I343-F387 HydrophobicContact CG2-CE2 4.1Å; I343-F387 HydrophobicContact CG2-CZ 3.44Å; I343-F387 VanDerWaalsContact CG2-CZ 3.44Å; I343-I390 HydrophobicContact CD1-CD1 3.71Å; I343-I390 HydrophobicContact CG1-CD1 4.28Å; I343-L429 HydrophobicContact CD1-CD1 3.75Å
344F93.9Very high92.4Very high34 Ų3444.3 Ų44.315%0.14923%0.232CC..Hα-helixtrans-62.4-47.3176.9175.8-99.4000112.4V96 W138 V340 L341 T342 L346 L347 V348V96-F344 HydrophobicContact CG1-CD2 3.76Å; W138-F344 HydrophobicContact CB-CE2 4.14Å; W138-F344 HydrophobicContact CB-CZ 4.28Å; W138-F344 AromaticContact CD2-CE2 3.81Å; W138-F344 HydrophobicContact CD2-CE2 3.81Å; W138-F344 AromaticContact CD2-CZ 3.43Å; W138-F344 HydrophobicContact CD2-CZ 3.43Å; W138-F344 VanDerWaalsContact CD2-CZ 3.43Å; W138-F344 AromaticContact CE2-CZ 3.73Å; W138-F344 AromaticContact CE3-CE2 3.76Å; W138-F344 HydrophobicContact CE3-CE2 3.76Å; W138-F344 AromaticContact CE3-CZ 3.73Å; W138-F344 HydrophobicContact CE3-CZ 3.73Å; W138-F344 AromaticContact CG-CE2 3.97Å; W138-F344 HydrophobicContact CG-CE2 3.97Å; W138-F344 AromaticContact CG-CZ 3.66Å; W138-F344 HydrophobicContact CG-CZ 3.66Å; W138-F344 HydrophobicContact CH2-CZ 4.48Å; W138-F344 HydrophobicContact CZ2-CZ 4.26Å; W138-F344 HydrophobicContact CZ3-CE2 4.41Å; W138-F344 HydrophobicContact CZ3-CZ 4.23Å; V340-F344 VanDerWaalsContact O-CB 3.26Å; V340-F344 WeakPolarHBondContact O-CB 3.37Å; V340-F344 PolarHBondContact O-N 3.01Å; L341-F344 PolarHBondContact O-N 3.01Å; T342-F344 VanDerWaalsContact C-N 3.29Å; T342-F344 PolarHBondContact O-N 2.61Å; F344-L346 VanDerWaalsContact C-N 3.34Å; F344-L346 PolarHBondContact O-N 3.07Å; F344-L347 WeakPolarHBondContact O-CB 3.28Å; F344-L347 PolarHBondContact O-N 3.41Å; F344-V348 HydrophobicContact CE1-CG2 4.24Å; F344-V348 HydrophobicContact CE2-CG2 4.28Å; F344-V348 HydrophobicContact CZ-CG2 4.03Å; F344-V348 WeakPolarHBondContact O-CG2 3.36Å; F344-V348 PolarHBondContact O-N 2.62Å
345I94.4Very high92.1Very high84 Ų8440 Ų4043%0.43121%0.214SC..Hα-helixtrans-61.9-43.6176.8-70167.2000110.6L341 T342 L347 V348 L349L341-I345 HydrophobicContact CD1-CD1 4.04Å; L341-I345 HydrophobicContact CD1-CG1 4.3Å; L341-I345 HydrophobicContact CG-CD1 3.91Å; L341-I345 VanDerWaalsContact O-CG1 3.28Å; L341-I345 WeakPolarHBondContact O-CG1 3.18Å; L341-I345 PolarHBondContact O-N 3.35Å; T342-I345 PolarHBondContact O-N 3.42Å; I345-L347 VanDerWaalsContact C-N 3.34Å; I345-L347 PolarHBondContact O-N 3.17Å; I345-V348 PolarHBondContact O-N 3.21Å; I345-L349 HydrophobicContact CG2-CD1 3.87Å; I345-L349 HydrophobicContact CG2-CG 4.31Å; I345-L349 WeakPolarHBondContact O-CB 3.08Å; I345-L349 VanDerWaalsContact O-CG 3.28Å; I345-L349 WeakPolarHBondContact O-CG 3.38Å; I345-L349 PolarHBondContact O-N 3.07Å
346L95.6Very high91.6Very high83 Ų8337 Ų3744%0.43520%0.203SC..Hα-helixtrans-61.6-41.7177.1-73.8173.1000112T342 I343 F344 L349 L350 M383T342-L346 HydrophobicContact CG2-CD1 4.03Å; T342-L346 HydrophobicContact CG2-CG 4.43Å; T342-L346 WeakPolarHBondContact O-CB 3.44Å; T342-L346 VanDerWaalsContact O-CG 3.28Å; T342-L346 WeakPolarHBondContact O-CG 3.4Å; T342-L346 PolarHBondContact O-N 2.97Å; I343-L346 PolarHBondContact O-N 2.97Å; F344-L346 VanDerWaalsContact C-N 3.34Å; F344-L346 PolarHBondContact O-N 3.07Å; L346-L349 PolarHBondContact O-N 3Å; L346-L350 WeakPolarHBondContact O-CB 3.44Å; L346-L350 VanDerWaalsContact O-CG 3.28Å; L346-L350 WeakPolarHBondContact O-CG 3.49Å; L346-L350 PolarHBondContact O-N 3.09Å; L346-M383 HydrophobicContact CB-CE 3.4Å; L346-M383 VanDerWaalsContact CB-CE 3.4Å; L346-M383 HydrophobicContact CD1-CE 4.3Å
347L94.1Very high90.8Very high2 Ų240.7 Ų40.71%0.0124%0.241CC..Hα-helixtrans-59.3-50.4175.9172.165.1000111.2V96 I343 F344 I345 L349 L350 W351 V379 M383V96-L347 HydrophobicContact CB-CD2 4.23Å; V96-L347 HydrophobicContact CG1-CD2 4.02Å; V96-L347 HydrophobicContact CG2-CD2 3.52Å; I343-L347 WeakPolarHBondContact O-CB 3.3Å; I343-L347 PolarHBondContact O-N 3.09Å; F344-L347 WeakPolarHBondContact O-CB 3.28Å; F344-L347 PolarHBondContact O-N 3.41Å; I345-L347 VanDerWaalsContact C-N 3.34Å; I345-L347 PolarHBondContact O-N 3.17Å; L347-L349 VanDerWaalsContact C-N 3.34Å; L347-L349 PolarHBondContact O-N 3.34Å; L347-L350 PolarHBondContact O-N 2.86Å; L347-W351 HydrophobicContact CD1-CD2 4.04Å; L347-W351 HydrophobicContact CD1-CE3 4.42Å; L347-W351 HydrophobicContact CD1-CH2 4.28Å; L347-W351 HydrophobicContact CD1-CZ2 3.86Å; L347-W351 HydrophobicContact CD2-CH2 3.89Å; L347-W351 HydrophobicContact CD2-CZ2 4.26Å; L347-W351 HydrophobicContact CD2-CZ3 4.09Å; L347-W351 HydrophobicContact CG-CD2 4.21Å; L347-W351 HydrophobicContact CG-CE3 4.1Å; L347-W351 HydrophobicContact CG-CH2 4.14Å; L347-W351 HydrophobicContact CG-CZ2 4.23Å; L347-W351 HydrophobicContact CG-CZ3 4.08Å; L347-W351 PolarHBondContact O-N 2.84Å; L347-V379 HydrophobicContact CD1-CG1 3.91Å; L347-M383 HydrophobicContact CB-CB 4.3Å; L347-M383 HydrophobicContact CB-CE 4.46Å; L347-M383 HydrophobicContact CB-CG 4.1Å; L347-M383 HydrophobicContact CD1-CB 4.04Å; L347-M383 HydrophobicContact CD1-CG 3.87Å
348V92.7Very high90Very high26 Ų2648.1 Ų48.116%0.15827%0.274CS..Hα-helixtrans-60.2-45.7179.3173.90000110.5W138 F344 I345 L350 W351 F352W138-V348 HydrophobicContact CH2-CG1 4.35Å; W138-V348 HydrophobicContact CH2-CG2 3.79Å; W138-V348 HydrophobicContact CZ3-CG2 3.8Å; F344-V348 HydrophobicContact CE1-CG2 4.24Å; F344-V348 HydrophobicContact CE2-CG2 4.28Å; F344-V348 HydrophobicContact CZ-CG2 4.03Å; F344-V348 WeakPolarHBondContact O-CG2 3.36Å; F344-V348 PolarHBondContact O-N 2.62Å; I345-V348 PolarHBondContact O-N 3.21Å; V348-L350 VanDerWaalsContact C-N 3.35Å; V348-L350 PolarHBondContact O-N 3.17Å; V348-W351 PolarHBondContact O-N 3.24Å; V348-F352 HydrophobicContact CG1-CD2 3.7Å; V348-F352 HydrophobicContact CG1-CE2 3.74Å; V348-F352 VanDerWaalsContact O-CD2 3.31Å; V348-F352 WeakPolarHBondContact O-CD2 3.43Å; V348-F352 PolarHBondContact O-N 3.15Å
349L93.4Very high89.5Confident97 Ų9752 Ų5251%0.50829%0.288SS..Hα-helixtrans-60.5-43.1176.8-71.7173.5000112I345 L346 L347 F352 T353I345-L349 HydrophobicContact CG2-CD1 3.87Å; I345-L349 HydrophobicContact CG2-CG 4.31Å; I345-L349 WeakPolarHBondContact O-CB 3.08Å; I345-L349 VanDerWaalsContact O-CG 3.28Å; I345-L349 WeakPolarHBondContact O-CG 3.38Å; I345-L349 PolarHBondContact O-N 3.07Å; L346-L349 PolarHBondContact O-N 3Å; L347-L349 VanDerWaalsContact C-N 3.34Å; L347-L349 PolarHBondContact O-N 3.34Å; L349-F352 PolarHBondContact O-N 3.44Å; L349-T353 WeakPolarHBondContact O-CB 3.47Å; L349-T353 WeakPolarHBondContact O-CG2 3.41Å; L349-T353 PolarHBondContact O-N 3.5Å; L349-T353 PolarHBondContact O-OG1 3.01Å
350L93.1Very high88.9Confident54 Ų5456 Ų5628%0.28331%0.313SS..Hα-helixtrans-63.9-41.9178.5-75.4171.2000112L346 L347 V348 T353 R354 W362 V379 M383L346-L350 WeakPolarHBondContact O-CB 3.44Å; L346-L350 VanDerWaalsContact O-CG 3.28Å; L346-L350 WeakPolarHBondContact O-CG 3.49Å; L346-L350 PolarHBondContact O-N 3.09Å; L347-L350 PolarHBondContact O-N 2.86Å; V348-L350 VanDerWaalsContact C-N 3.35Å; V348-L350 PolarHBondContact O-N 3.17Å; L350-T353 PolarHBondContact O-N 3.27Å; L350-T353 PolarHBondContact O-OG1 2.91Å; L350-R354 WeakPolarHBondContact O-CB 3.35Å; L350-R354 PolarHBondContact O-N 3.45Å; L350-W362 HydrophobicContact CD2-CZ2 4.24Å; L350-W362 PolarHBondContact O-NE1 3.09Å; L350-V379 HydrophobicContact CB-CG1 3.58Å; L350-V379 HydrophobicContact CD1-CG1 4.01Å; L350-V379 HydrophobicContact CG-CG1 4.44Å; L350-M383 HydrophobicContact CD1-CG 4.23Å; L350-M383 HydrophobicContact CD1-SD 3.79Å
351W91.5Very high88.5Confident5 Ų556.3 Ų56.32%0.01932%0.316CS..Hα-helixtrans-61.8-49.3174.8-80.7-28.3000112.3L89 W138 T247 F272 L347 V348 T353 R354 D376 A380L89-W351 HydrophobicContact CD1-CH2 4.45Å; L89-W351 HydrophobicContact CD1-CZ2 3.48Å; L89-W351 VanDerWaalsContact CD1-CZ2 3.48Å; W138-W351 HydrophobicContact CZ3-CZ3 4.48Å; T247-W351 HydrophobicContact CG2-CH2 3.68Å; T247-W351 HydrophobicContact CG2-CZ2 4.22Å; T247-W351 HydrophobicContact CG2-CZ3 4.47Å; F272-W351 HydrophobicContact CB-CB 4Å; F272-W351 HydrophobicContact CB-CG 4.11Å; F272-W351 HydrophobicContact CD1-CB 3.64Å; F272-W351 HydrophobicContact CD1-CD2 4.31Å; F272-W351 HydrophobicContact CD1-CE3 4.08Å; F272-W351 HydrophobicContact CD1-CG 4.2Å; F272-W351 HydrophobicContact CD2-CB 4.46Å; F272-W351 AromaticContact CD2-CD2 3.67Å; F272-W351 HydrophobicContact CD2-CD2 3.67Å; F272-W351 AromaticContact CD2-CE3 3.47Å; F272-W351 HydrophobicContact CD2-CE3 3.47Å; F272-W351 VanDerWaalsContact CD2-CE3 3.47Å; F272-W351 HydrophobicContact CD2-CG 4.15Å; F272-W351 HydrophobicContact CD2-CH2 4.39Å; F272-W351 AromaticContact CD2-CZ3 3.86Å; F272-W351 HydrophobicContact CD2-CZ3 3.86Å; F272-W351 HydrophobicContact CE1-CB 4.27Å; F272-W351 AromaticContact CE1-CE3 3.85Å; F272-W351 HydrophobicContact CE1-CE3 3.85Å; F272-W351 AromaticContact CE2-CD2 3.93Å; F272-W351 HydrophobicContact CE2-CD2 3.93Å; F272-W351 AromaticContact CE2-CE3 3.2Å; F272-W351 HydrophobicContact CE2-CE3 3.2Å; F272-W351 HydrophobicContact CE2-CH2 4.07Å; F272-W351 AromaticContact CE2-CZ3 3.28Å; F272-W351 HydrophobicContact CE2-CZ3 3.28Å; F272-W351 HydrophobicContact CG-CB 3.76Å; F272-W351 AromaticContact CG-CD2 3.89Å; F272-W351 HydrophobicContact CG-CD2 3.89Å; F272-W351 AromaticContact CG-CE3 3.91Å; F272-W351 HydrophobicContact CG-CE3 3.91Å; F272-W351 AromaticContact CG-CG 3.87Å; F272-W351 HydrophobicContact CG-CG 3.87Å; F272-W351 HydrophobicContact CZ-CD2 4.35Å; F272-W351 AromaticContact CZ-CE3 3.42Å; F272-W351 HydrophobicContact CZ-CE3 3.42Å; F272-W351 VanDerWaalsContact CZ-CE3 3.42Å; F272-W351 AromaticContact CZ-CZ3 3.73Å; F272-W351 HydrophobicContact CZ-CZ3 3.73Å; L347-W351 HydrophobicContact CD1-CD2 4.04Å; L347-W351 HydrophobicContact CD1-CE3 4.42Å; L347-W351 HydrophobicContact CD1-CH2 4.28Å; L347-W351 HydrophobicContact CD1-CZ2 3.86Å; L347-W351 HydrophobicContact CD2-CH2 3.89Å; L347-W351 HydrophobicContact CD2-CZ2 4.26Å; L347-W351 HydrophobicContact CD2-CZ3 4.09Å; L347-W351 HydrophobicContact CG-CD2 4.21Å; L347-W351 HydrophobicContact CG-CE3 4.1Å; L347-W351 HydrophobicContact CG-CH2 4.14Å; L347-W351 HydrophobicContact CG-CZ2 4.23Å; L347-W351 HydrophobicContact CG-CZ3 4.08Å; L347-W351 PolarHBondContact O-N 2.84Å; V348-W351 PolarHBondContact O-N 3.24Å; W351-T353 VanDerWaalsContact C-N 3.29Å; W351-T353 PolarHBondContact O-N 3.36Å; W351-R354 WeakPolarHBondContact O-CB 3.2Å; W351-R354 PolarHBondContact O-N 2.9Å; W351-D376 PolarHBondContact NE1-O 3.49Å; W351-A380 HydrophobicContact CZ2-CB 3.9Å
352F90.1Very high88.3Confident65 Ų6556.9 Ų56.929%0.28531%0.314SS..Hα-helixtrans-66.4-30.1-179.8-85.6-77.9000113.5F272 A273 F276 V348 L349 P356F272-F352 HydrophobicContact CD1-CE2 4.35Å; F272-F352 HydrophobicContact CE1-CD2 4.25Å; F272-F352 AromaticContact CE1-CE2 3.74Å; F272-F352 HydrophobicContact CE1-CE2 3.74Å; F272-F352 HydrophobicContact CE1-CZ 4.1Å; A273-F352 HydrophobicContact CB-CD1 4.27Å; F276-F352 HydrophobicContact CB-CE1 4.13Å; F276-F352 HydrophobicContact CB-CZ 4.02Å; F276-F352 AromaticContact CD1-CE1 3.6Å; F276-F352 HydrophobicContact CD1-CE1 3.6Å; F276-F352 AromaticContact CD1-CZ 3.4Å; F276-F352 HydrophobicContact CD1-CZ 3.4Å; F276-F352 VanDerWaalsContact CD1-CZ 3.4Å; F276-F352 AromaticContact CD2-CZ 3.94Å; F276-F352 HydrophobicContact CD2-CZ 3.94Å; F276-F352 HydrophobicContact CE1-CE1 4.17Å; F276-F352 AromaticContact CE1-CZ 3.72Å; F276-F352 HydrophobicContact CE1-CZ 3.72Å; F276-F352 HydrophobicContact CE2-CZ 4.22Å; F276-F352 AromaticContact CG-CE1 3.93Å; F276-F352 HydrophobicContact CG-CE1 3.93Å; F276-F352 AromaticContact CG-CZ 3.5Å; F276-F352 HydrophobicContact CG-CZ 3.5Å; F276-F352 HydrophobicContact CZ-CZ 4.11Å; V348-F352 HydrophobicContact CG1-CD2 3.7Å; V348-F352 HydrophobicContact CG1-CE2 3.74Å; V348-F352 VanDerWaalsContact O-CD2 3.31Å; V348-F352 WeakPolarHBondContact O-CD2 3.43Å; V348-F352 PolarHBondContact O-N 3.15Å; L349-F352 PolarHBondContact O-N 3.44Å; F352-P356 WeakPolarHBondContact O-CB 3.32Å
353T90.1Very high87.8Confident67 Ų6753 Ų5341%0.41129%0.29SS..Hα-helixtrans-93.1-4.9-178.857.60000113.7L349 L350 W351 G361 W362L349-T353 WeakPolarHBondContact O-CB 3.47Å; L349-T353 WeakPolarHBondContact O-CG2 3.41Å; L349-T353 PolarHBondContact O-N 3.5Å; L349-T353 PolarHBondContact O-OG1 3.01Å; L350-T353 PolarHBondContact O-N 3.27Å; L350-T353 PolarHBondContact O-OG1 2.91Å; W351-T353 VanDerWaalsContact C-N 3.29Å; W351-T353 PolarHBondContact O-N 3.36Å; T353-G361 VanDerWaalsContact O-CA 3.27Å; T353-G361 WeakPolarHBondContact O-CA 3.48Å; T353-W362 PolarHBondContact O-N 3.46Å; T353-W362 VanDerWaalsContact O-N 3.12Å; T353-W362 PolarHBondContact OG1-NE1 3.38Å
354R88.4Confident87.2Confident13 Ų1354.1 Ų54.15%0.04930%0.301CS..Hα-helixtrans-59.5-63.3-177.6-171.5-164.7115.9-161.51.5111.3L350 W351 G361 W362 A363 D376L350-R354 WeakPolarHBondContact O-CB 3.35Å; L350-R354 PolarHBondContact O-N 3.45Å; W351-R354 WeakPolarHBondContact O-CB 3.2Å; W351-R354 PolarHBondContact O-N 2.9Å; R354-G361 CarbonylContact O-C 3.59Å; R354-G361 VanDerWaalsContact O-C 3.26Å; R354-G361 WeakPolarHBondContact O-CA 3.47Å; R354-W362 VanDerWaalsContact CA-NE1 3.31Å; R354-W362 HydrophobicContact CB-CZ2 4.06Å; R354-W362 HydrophobicContact CG-CH2 4.4Å; R354-W362 HydrophobicContact CG-CZ2 3.91Å; R354-W362 PolarHBondContact O-N 3Å; R354-A363 HydrophobicContact CG-CB 3.46Å; R354-A363 VanDerWaalsContact CG-CB 3.46Å; R354-A363 PolarHBondContact O-N 3.3Å; R354-D376 WeakPolarHBondContact CD-OD1 3.42Å; R354-D376 IonicContact CZ-OD1 3.85Å; R354-D376 IonicContact NE-OD1 2.75Å; R354-D376 IonicContact NH1-OD1 2.69Å; R354-D376 PolarHBondContact NH1-OD1 3.42Å; R354-D376 IonicContact NH1-OD2 3.45Å; R354-D376 PolarHBondContact NH1-OD2 3.41Å
355E82.2Confident86.7Confident36 Ų3656.1 Ų56.117%0.16832%0.316CS..  trans-147.672-179.1-80.8166.6-174.400108.8N271 G357 A363 A364 N368N271-E355 PolarHBondContact ND2-O 3.12Å; N271-E355 VanDerWaalsContact ND2-O 3.08Å; E355-G357 PolarHBondContact O-N 2.88Å; E355-G357 VanDerWaalsContact O-N 3.09Å; E355-A363 HydrophobicContact CG-CB 4.45Å; E355-A364 HydrophobicContact CG-CB 4.39Å; E355-N368 PolarHBondContact OE1-ND2 3.16Å
356P78.4Confident86.3Confident22 Ų2257.5 Ų57.514%0.14332%0.323CS..  trans-67.6-8.5-173.823.8-31.2000114.6F352 F358 I359F352-P356 WeakPolarHBondContact O-CB 3.32Å; P356-F358 HydrophobicContact CB-CD1 3.96Å; P356-F358 HydrophobicContact CB-CE1 3.47Å; P356-F358 VanDerWaalsContact CB-CE1 3.47Å; P356-F358 HydrophobicContact CB-CE2 4.38Å; P356-F358 HydrophobicContact CB-CZ 3.68Å; P356-F358 HydrophobicContact CG-CE1 4.48Å; P356-F358 HydrophobicContact CG-CZ 4.35Å; P356-F358 WeakPolarHBondContact O-CD1 3.5Å; P356-F358 PolarHBondContact O-N 3.04Å; P356-F358 VanDerWaalsContact O-N 3.12Å; P356-I359 HydrophobicContact CG-CD1 4.34Å; P356-I359 HydrophobicContact CG-CG1 3.55Å; P356-I359 WeakPolarHBondContact CG-O 3.23Å
357G72.8Confident85.8Confident78 Ų7858.8 Ų58.880%0.80433%0.326SS*.SBendtrans82.2-30.1177.500000115.2E355E355-G357 PolarHBondContact O-N 2.88Å; E355-G357 VanDerWaalsContact O-N 3.09Å
358F74.9Confident85.3Confident166 Ų16659.7 Ų59.773%0.72833%0.331SS*.SBendtrans-95.5-20178.557.2-94.6000114.4P356P356-F358 HydrophobicContact CB-CD1 3.96Å; P356-F358 HydrophobicContact CB-CE1 3.47Å; P356-F358 VanDerWaalsContact CB-CE1 3.47Å; P356-F358 HydrophobicContact CB-CE2 4.38Å; P356-F358 HydrophobicContact CB-CZ 3.68Å; P356-F358 HydrophobicContact CG-CE1 4.48Å; P356-F358 HydrophobicContact CG-CZ 4.35Å; P356-F358 WeakPolarHBondContact O-CD1 3.5Å; P356-F358 PolarHBondContact O-N 3.04Å; P356-F358 VanDerWaalsContact O-N 3.12Å
359I82.1Confident84.3Confident103 Ų10366.4 Ų66.453%0.52836%0.358SS..SBendtrans-136152.2171.254.2178.4000109P356 G361P356-I359 HydrophobicContact CG-CD1 4.34Å; P356-I359 HydrophobicContact CG-CG1 3.55Å; P356-I359 WeakPolarHBondContact CG-O 3.23Å; I359-G361 PolarHBondContact O-N 3.35Å
360P80.9Confident82.9Confident101 Ų10170.5 Ų70.566%0.65637%0.374SS*.  trans-61.8113.7170.726.7-33.5000108.7V365P360-V365 HydrophobicContact CB-CG2 3.89Å; P360-V365 HydrophobicContact CG-CG2 4.48Å
361G85.7Confident81.6Confident5 Ų573 Ų735%0.05239%0.388CS..  trans-77.1173.3179.600000112.3T353 R354 I359 A363 A364 V365T353-G361 VanDerWaalsContact O-CA 3.27Å; T353-G361 WeakPolarHBondContact O-CA 3.48Å; R354-G361 CarbonylContact O-C 3.59Å; R354-G361 VanDerWaalsContact O-C 3.26Å; R354-G361 WeakPolarHBondContact O-CA 3.47Å; I359-G361 PolarHBondContact O-N 3.35Å; G361-A363 PolarHBondContact O-N 2.95Å; G361-A364 PolarHBondContact O-N 3.46Å; G361-V365 WeakPolarHBondContact O-CG2 3.47Å; G361-V365 PolarHBondContact O-N 3.02Å; G361-V365 VanDerWaalsContact O-N 3.08Å
362W89.6Confident80.6Confident64 Ų6477.1 Ų77.124%0.24242%0.417CS..Hα-helixtrans-62.7-31.1-174.663.3-99000112.4L350 T353 R354 L366 F367 V374 V379L350-W362 HydrophobicContact CD2-CZ2 4.24Å; L350-W362 PolarHBondContact O-NE1 3.09Å; T353-W362 PolarHBondContact O-N 3.46Å; T353-W362 VanDerWaalsContact O-N 3.12Å; T353-W362 PolarHBondContact OG1-NE1 3.38Å; R354-W362 VanDerWaalsContact CA-NE1 3.31Å; R354-W362 HydrophobicContact CB-CZ2 4.06Å; R354-W362 HydrophobicContact CG-CH2 4.4Å; R354-W362 HydrophobicContact CG-CZ2 3.91Å; R354-W362 PolarHBondContact O-N 3Å; W362-L366 HydrophobicContact CB-CD1 4.48Å; W362-L366 VanDerWaalsContact O-CB 3.25Å; W362-L366 WeakPolarHBondContact O-CB 3.44Å; W362-L366 WeakPolarHBondContact O-CG 3.34Å; W362-L366 PolarHBondContact O-N 2.85Å; W362-F367 HydrophobicContact CE3-CD2 4.23Å; W362-F367 HydrophobicContact CE3-CE2 4.27Å; W362-F367 HydrophobicContact CZ3-CD2 4.03Å; W362-F367 HydrophobicContact CZ3-CE2 4.12Å; W362-V374 HydrophobicContact CH2-CG1 3.57Å; W362-V374 HydrophobicContact CZ3-CG1 3.77Å; W362-V379 HydrophobicContact CH2-CG2 3.7Å; W362-V379 HydrophobicContact CZ2-CG2 3.66Å
363A85.1Confident80.3Confident0 Ų080.9 Ų80.90%043%0.434CS..Hα-helixtrans-70-47.8178.300000110.9R354 E355 G361 V365 L366 F367 N368 V374R354-A363 HydrophobicContact CG-CB 3.46Å; R354-A363 VanDerWaalsContact CG-CB 3.46Å; R354-A363 PolarHBondContact O-N 3.3Å; E355-A363 HydrophobicContact CG-CB 4.45Å; G361-A363 PolarHBondContact O-N 2.95Å; A363-V365 VanDerWaalsContact C-N 3.29Å; A363-V365 PolarHBondContact O-N 3.41Å; A363-L366 PolarHBondContact O-N 3.26Å; A363-F367 CarbonylContact O-C 3.39Å; A363-F367 PolarHBondContact O-N 3.36Å; A363-N368 PolarHBondContact O-N 3.42Å; A363-V374 HydrophobicContact CB-CB 4.39Å; A363-V374 HydrophobicContact CB-CG1 4.34Å
364A81.9Confident80.2Confident32 Ų3278.6 Ų78.626%0.26442%0.42SS..Hα-helixtrans-57.6-39.7176.100000112.8E355 G361E355-A364 HydrophobicContact CG-CB 4.39Å; G361-A364 PolarHBondContact O-N 3.46Å
365V84.7Confident80.2Confident75 Ų7578.7 Ų78.746%0.45542%0.422SS..Hα-helixtrans-77.1-40.3-177.5176.60000112.7P360 G361 A363 K369P360-V365 HydrophobicContact CB-CG2 3.89Å; P360-V365 HydrophobicContact CG-CG2 4.48Å; G361-V365 WeakPolarHBondContact O-CG2 3.47Å; G361-V365 PolarHBondContact O-N 3.02Å; G361-V365 VanDerWaalsContact O-N 3.08Å; A363-V365 VanDerWaalsContact C-N 3.29Å; A363-V365 PolarHBondContact O-N 3.41Å; V365-K369 WeakPolarHBondContact O-CE 3.17Å
366L85.7Confident80.5Confident113 Ų11377 Ų7759%0.59242%0.415SS*.Hα-helixtrans-95.9-36.2-170-64.1173.4000113.6W362 A363W362-L366 HydrophobicContact CB-CD1 4.48Å; W362-L366 VanDerWaalsContact O-CB 3.25Å; W362-L366 WeakPolarHBondContact O-CB 3.44Å; W362-L366 WeakPolarHBondContact O-CG 3.34Å; W362-L366 PolarHBondContact O-N 2.85Å; A363-L366 PolarHBondContact O-N 3.26Å
367F85.2Confident81.2Confident111 Ų11176 Ų7649%0.48741%0.408SS..THydrogen-bonded Turntrans-129.4-36.1-165.8-58.5-73.1000114.1W362 A363 K369 F373 V374W362-F367 HydrophobicContact CE3-CD2 4.23Å; W362-F367 HydrophobicContact CE3-CE2 4.27Å; W362-F367 HydrophobicContact CZ3-CD2 4.03Å; W362-F367 HydrophobicContact CZ3-CE2 4.12Å; A363-F367 CarbonylContact O-C 3.39Å; A363-F367 PolarHBondContact O-N 3.36Å; F367-K369 PolarHBondContact O-N 3.21Å; F367-F373 WeakPolarHBondContact O-CD2 3.46Å; F367-V374 HydrophobicContact CB-CB 4.23Å; F367-V374 HydrophobicContact CB-CG2 3.47Å; F367-V374 VanDerWaalsContact CB-CG2 3.47Å; F367-V374 HydrophobicContact CD1-CG2 4.34Å; F367-V374 HydrophobicContact CD2-CG2 3.9Å; F367-V374 HydrophobicContact CG-CG2 3.65Å
368N82.3Confident82.1Confident21 Ų2175.5 Ų75.511%0.11239%0.389CS..  trans-102.148.5-171.7-62.9-6000112.8E355 A363 D371 F373 V374E355-N368 PolarHBondContact OE1-ND2 3.16Å; A363-N368 PolarHBondContact O-N 3.42Å; N368-D371 VanDerWaalsContact CA-O 3.25Å; N368-D371 WeakPolarHBondContact CA-O 3.23Å; N368-F373 PolarHBondContact OD1-N 3.31Å; N368-V374 PolarHBondContact ND2-O 3.17Å; N368-V374 PolarHBondContact OD1-N 3.22Å
369K71.4Confident83Confident166 Ų16667.9 Ų67.972%0.72236%0.357SS*.SBendtrans-76.8-36.5-178.6-73.5-173.6-178.5178.10113.9V365 F367V365-K369 WeakPolarHBondContact O-CE 3.17Å; F367-K369 PolarHBondContact O-N 3.21Å
370E65.6Low83.5Confident183 Ų18363 Ų6386%0.85533%0.332SS*.SBendtrans-119.9-41-176.1-67-178178.400111.2
371D64.6Low84.2Confident108 Ų10860.1 Ų60.158%0.57831%0.31SS*.SBendtrans-131.7157.1176.1-76.2-45000111.4N368 F373N368-D371 VanDerWaalsContact CA-O 3.25Å; N368-D371 WeakPolarHBondContact CA-O 3.23Å; D371-F373 HydrophobicContact CB-CD2 4.13Å; D371-F373 HydrophobicContact CB-CE2 3.68Å; D371-F373 HydrophobicContact CB-CZ 4.01Å; D371-F373 VanDerWaalsContact O-CD2 3.3Å; D371-F373 WeakPolarHBondContact O-CD2 3.48Å; D371-F373 PolarHBondContact O-N 3.25Å
372S72Confident84.7Confident90 Ų9065.7 Ų65.763%0.62933%0.333SS*.  trans-77.382.3176.6-172.40000111.2
373F83.1Confident84.9Confident144 Ų14462.9 Ų62.963%0.63232%0.323SS*.  trans-81-39.8178.1-71.4-75.8000113F367 N368 D371F367-F373 WeakPolarHBondContact O-CD2 3.46Å; N368-F373 PolarHBondContact OD1-N 3.31Å; D371-F373 HydrophobicContact CB-CD2 4.13Å; D371-F373 HydrophobicContact CB-CE2 3.68Å; D371-F373 HydrophobicContact CB-CZ 4.01Å; D371-F373 VanDerWaalsContact O-CD2 3.3Å; D371-F373 WeakPolarHBondContact O-CD2 3.48Å; D371-F373 PolarHBondContact O-N 3.25Å
374V87.9Confident85.4Confident19 Ų1963 Ų6312%0.11532%0.324CS..  trans-105.3120.4-176.9177.70000110.4W362 A363 F367 N368 T378W362-V374 HydrophobicContact CH2-CG1 3.57Å; W362-V374 HydrophobicContact CZ3-CG1 3.77Å; A363-V374 HydrophobicContact CB-CB 4.39Å; A363-V374 HydrophobicContact CB-CG1 4.34Å; F367-V374 HydrophobicContact CB-CB 4.23Å; F367-V374 HydrophobicContact CB-CG2 3.47Å; F367-V374 VanDerWaalsContact CB-CG2 3.47Å; F367-V374 HydrophobicContact CD1-CG2 4.34Å; F367-V374 HydrophobicContact CD2-CG2 3.9Å; F367-V374 HydrophobicContact CG-CG2 3.65Å; N368-V374 PolarHBondContact ND2-O 3.17Å; N368-V374 PolarHBondContact OD1-N 3.22Å; V374-T378 HydrophobicContact CG1-CG2 4.46Å
375S88.8Confident86Confident15 Ų1566.9 Ų66.911%0.10534%0.338CS..  trans-113.2174.9-177.966.90000112.9D85 G377 T378 V379D85-S375 VanDerWaalsContact CG-CB 3.49Å; D85-S375 WeakPolarHBondContact OD1-CB 3.12Å; D85-S375 PolarHBondContact OD1-OG 3.4Å; D85-S375 WeakPolarHBondContact OD2-CB 3.47Å; D85-S375 PolarHBondContact OD2-OG 3Å; D85-S375 VanDerWaalsContact OD2-OG 3.07Å; S375-G377 PolarHBondContact O-N 3.25Å; S375-G377 PolarHBondContact OG-N 2.92Å; S375-T378 PolarHBondContact N-OG1 2.66Å; S375-T378 WeakPolarHBondContact O-CB 3.32Å; S375-T378 PolarHBondContact O-N 3.48Å; S375-T378 PolarHBondContact OG-N 3.38Å; S375-T378 PolarHBondContact OG-OG1 3.44Å; S375-V379 PolarHBondContact O-N 3.1Å
376D88.9Confident86.5Confident2 Ų265.6 Ų65.61%0.01133%0.328CS..Hα-helixtrans-65.1-34.5172.1-73.6-27.7000110.4L89 F272 W351 R354 T378 V379 A380L89-D376 HydrophobicContact CD1-CB 3.86Å; L89-D376 HydrophobicContact CD2-CB 3.95Å; L89-D376 HydrophobicContact CG-CB 4.45Å; F272-D376 PolarHBondContact N-OD2 3Å; W351-D376 PolarHBondContact NE1-O 3.49Å; R354-D376 WeakPolarHBondContact CD-OD1 3.42Å; R354-D376 IonicContact CZ-OD1 3.85Å; R354-D376 IonicContact NE-OD1 2.75Å; R354-D376 IonicContact NH1-OD1 2.69Å; R354-D376 PolarHBondContact NH1-OD1 3.42Å; R354-D376 IonicContact NH1-OD2 3.45Å; R354-D376 PolarHBondContact NH1-OD2 3.41Å; D376-T378 VanDerWaalsContact C-N 3.34Å; D376-V379 PolarHBondContact O-N 3.3Å; D376-A380 WeakPolarHBondContact O-CB 3.22Å; D376-A380 PolarHBondContact O-N 3.42Å
377G91.4Very high86.9Confident1 Ų160.2 Ų60.21%0.0130%0.3CS..Hα-helixtrans-61.2-41.6174.700000112.7S375 V379 A380 I381S375-G377 PolarHBondContact O-N 3.25Å; S375-G377 PolarHBondContact OG-N 2.92Å; G377-V379 PolarHBondContact O-N 3.25Å; G377-A380 PolarHBondContact O-N 3.02Å; G377-I381 WeakPolarHBondContact O-CG1 3.36Å; G377-I381 PolarHBondContact O-N 3.43Å
378T92.3Very high87.3Confident66 Ų6658.1 Ų58.141%0.40529%0.291SS..Hα-helixtrans-59.5-47.7177-56.10000111.4V374 S375 D376 F382V374-T378 HydrophobicContact CG1-CG2 4.46Å; S375-T378 PolarHBondContact N-OG1 2.66Å; S375-T378 WeakPolarHBondContact O-CB 3.32Å; S375-T378 PolarHBondContact O-N 3.48Å; S375-T378 PolarHBondContact OG-N 3.38Å; S375-T378 PolarHBondContact OG-OG1 3.44Å; D376-T378 VanDerWaalsContact C-N 3.34Å; T378-F382 WeakPolarHBondContact O-CB 3.5Å; T378-F382 PolarHBondContact O-N 3.25Å
379V93.5Very high87.7Confident7 Ų762.3 Ų62.34%0.04232%0.317CS..Hα-helixtrans-62.8-45.2177.9-178.80000110.8L347 L350 W362 S375 D376 G377 I381 F382 M383L347-V379 HydrophobicContact CD1-CG1 3.91Å; L350-V379 HydrophobicContact CB-CG1 3.58Å; L350-V379 HydrophobicContact CD1-CG1 4.01Å; L350-V379 HydrophobicContact CG-CG1 4.44Å; W362-V379 HydrophobicContact CH2-CG2 3.7Å; W362-V379 HydrophobicContact CZ2-CG2 3.66Å; S375-V379 PolarHBondContact O-N 3.1Å; D376-V379 PolarHBondContact O-N 3.3Å; G377-V379 PolarHBondContact O-N 3.25Å; V379-I381 PolarHBondContact O-N 3.01Å; V379-F382 PolarHBondContact O-N 2.94Å; V379-M383 HydrophobicContact CG1-CG 4.37Å; V379-M383 WeakPolarHBondContact O-CG 3.31Å; V379-M383 PolarHBondContact O-N 3.35Å
380A93.9Very high88.7Confident0 Ų056.7 Ų56.70%029%0.294CS..Hα-helixtrans-62.1-45.2-177.400000112.2L89 W351 D376 G377 S384L89-A380 HydrophobicContact CD1-CB 3.83Å; W351-A380 HydrophobicContact CZ2-CB 3.9Å; D376-A380 WeakPolarHBondContact O-CB 3.22Å; D376-A380 PolarHBondContact O-N 3.42Å; G377-A380 PolarHBondContact O-N 3.02Å; A380-S384 VanDerWaalsContact O-CB 3.29Å; A380-S384 WeakPolarHBondContact O-CB 3.22Å; A380-S384 PolarHBondContact O-N 3.42Å; A380-S384 PolarHBondContact O-OG 3.37Å
381I95.1Very high89.8Confident41 Ų4150 Ų5021%0.2127%0.267CS..Hα-helixtrans-66.9-45.5177.5-67.9-61.4000110.9M88 M91 G377 V379 M383 S384 M385M88-I381 HydrophobicContact CB-CG1 4.1Å; M88-I381 WeakPolarHBondContact O-CD1 3.24Å; M91-I381 HydrophobicContact CB-CD1 4.3Å; G377-I381 WeakPolarHBondContact O-CG1 3.36Å; G377-I381 PolarHBondContact O-N 3.43Å; V379-I381 PolarHBondContact O-N 3.01Å; I381-M383 PolarHBondContact O-N 3.48Å; I381-S384 WeakPolarHBondContact O-CB 3.42Å; I381-S384 PolarHBondContact O-N 2.91Å; I381-S384 VanDerWaalsContact O-N 3.14Å; I381-M385 HydrophobicContact CG2-CE 3.71Å; I381-M385 HydrophobicContact CG2-CG 4.46Å; I381-M385 WeakPolarHBondContact O-CG 3.42Å; I381-M385 PolarHBondContact O-N 2.91Å
382F95.2Very high90.8Very high122 Ų12245.5 Ų45.554%0.53524%0.244SC..Hα-helixtrans-57.3-49.7178.6175.6-105.8000112.1T378 V379 S384 M385 L386T378-F382 WeakPolarHBondContact O-CB 3.5Å; T378-F382 PolarHBondContact O-N 3.25Å; V379-F382 PolarHBondContact O-N 2.94Å; F382-S384 VanDerWaalsContact C-N 3.27Å; F382-S384 PolarHBondContact O-N 3.5Å; F382-M385 WeakPolarHBondContact O-CB 3.34Å; F382-M385 PolarHBondContact O-N 2.93Å; F382-L386 PolarHBondContact O-N 3.3Å
383M95.2Very high91.3Very high5 Ų549.9 Ų49.93%0.02525%0.246CC..Hα-helixtrans-65-33.7178.1-65.2-55.9-72.300112I343 L346 L347 L350 V379 I381 L386I343-M383 HydrophobicContact CG2-CB 4.48Å; I343-M383 HydrophobicContact CG2-CE 3.95Å; I343-M383 VanDerWaalsContact O-CE 3.29Å; I343-M383 WeakPolarHBondContact O-CE 3.31Å; L346-M383 HydrophobicContact CB-CE 3.4Å; L346-M383 VanDerWaalsContact CB-CE 3.4Å; L346-M383 HydrophobicContact CD1-CE 4.3Å; L347-M383 HydrophobicContact CB-CB 4.3Å; L347-M383 HydrophobicContact CB-CE 4.46Å; L347-M383 HydrophobicContact CB-CG 4.1Å; L347-M383 HydrophobicContact CD1-CB 4.04Å; L347-M383 HydrophobicContact CD1-CG 3.87Å; L350-M383 HydrophobicContact CD1-CG 4.23Å; L350-M383 HydrophobicContact CD1-SD 3.79Å; V379-M383 HydrophobicContact CG1-CG 4.37Å; V379-M383 WeakPolarHBondContact O-CG 3.31Å; V379-M383 PolarHBondContact O-N 3.35Å; I381-M383 PolarHBondContact O-N 3.48Å; M383-L386 HydrophobicContact CE-CD1 4.13Å; M383-L386 WeakPolarHBondContact O-CB 3.18Å; M383-L386 PolarHBondContact O-N 3.32Å; M383-L386 HydrophobicContact SD-CD1 3.93Å
384S94Very high91Very high2 Ų248.6 Ų48.61%0.01425%0.245CC..Hα-helixtrans-68.6-35.4176.4-61.10000113G92 A380 I381 F382 L386 F387 F388G92-S384 WeakPolarHBondContact CA-OG 3.16Å; G92-S384 PolarHBondContact O-OG 3.47Å; A380-S384 VanDerWaalsContact O-CB 3.29Å; A380-S384 WeakPolarHBondContact O-CB 3.22Å; A380-S384 PolarHBondContact O-N 3.42Å; A380-S384 PolarHBondContact O-OG 3.37Å; I381-S384 WeakPolarHBondContact O-CB 3.42Å; I381-S384 PolarHBondContact O-N 2.91Å; I381-S384 VanDerWaalsContact O-N 3.14Å; F382-S384 VanDerWaalsContact C-N 3.27Å; F382-S384 PolarHBondContact O-N 3.5Å; S384-L386 PolarHBondContact O-N 3.34Å; S384-F387 WeakPolarHBondContact O-CB 3.5Å; S384-F387 WeakPolarHBondContact O-CD2 3.38Å; S384-F387 PolarHBondContact O-N 3.01Å; S384-F387 VanDerWaalsContact O-N 3.16Å; S384-F388 WeakPolarHBondContact O-CD2 3.22Å
385M94.6Very high89.8Confident114 Ų11451.4 Ų51.456%0.56226%0.264SS*.Hα-helixtrans-59.5-33.5174.7-71.8-176177.500111.7I381 F382 F387 F388 V389I381-M385 HydrophobicContact CG2-CE 3.71Å; I381-M385 HydrophobicContact CG2-CG 4.46Å; I381-M385 WeakPolarHBondContact O-CG 3.42Å; I381-M385 PolarHBondContact O-N 2.91Å; F382-M385 WeakPolarHBondContact O-CB 3.34Å; F382-M385 PolarHBondContact O-N 2.93Å; M385-F387 PolarHBondContact O-N 2.93Å; M385-F388 PolarHBondContact O-N 2.97Å; M385-V389 PolarHBondContact O-N 3.46Å
386L95.2Very high88.4Confident47 Ų4753.9 Ų53.925%0.24628%0.282CS..Hα-helixtrans-60.4-28.9178.6-60.6178.9000113I343 F382 M383 S384 F388 V389 I390I343-L386 HydrophobicContact CD1-CB 4.42Å; F382-L386 PolarHBondContact O-N 3.3Å; M383-L386 HydrophobicContact CE-CD1 4.13Å; M383-L386 WeakPolarHBondContact O-CB 3.18Å; M383-L386 PolarHBondContact O-N 3.32Å; M383-L386 HydrophobicContact SD-CD1 3.93Å; S384-L386 PolarHBondContact O-N 3.34Å; L386-F388 PolarHBondContact O-N 3.49Å; L386-V389 PolarHBondContact O-N 2.85Å; L386-V389 VanDerWaalsContact O-N 3.12Å; L386-I390 HydrophobicContact CB-CD1 4.02Å; L386-I390 WeakPolarHBondContact O-CB 3.48Å; L386-I390 WeakPolarHBondContact O-CG1 3.31Å; L386-I390 PolarHBondContact O-N 2.86Å
387F94.4Very high86.4Confident0 Ų060.6 Ų60.60%033%0.327CS..Hα-helixtrans-65.2-25175.5-63.3-57.3000113.4V96 A99 V340 I343 S384 M385 L429 L430V96-F387 HydrophobicContact CB-CE2 4.18Å; V96-F387 HydrophobicContact CG1-CZ 4.41Å; V96-F387 HydrophobicContact CG2-CE2 3.74Å; V96-F387 HydrophobicContact CG2-CZ 4.3Å; A99-F387 HydrophobicContact CB-CD1 3.89Å; A99-F387 HydrophobicContact CB-CD2 4.06Å; A99-F387 HydrophobicContact CB-CE1 3.68Å; A99-F387 HydrophobicContact CB-CE2 3.88Å; A99-F387 HydrophobicContact CB-CG 4.08Å; A99-F387 HydrophobicContact CB-CZ 3.68Å; V340-F387 HydrophobicContact CB-CE1 4.42Å; V340-F387 HydrophobicContact CG1-CE1 4.27Å; V340-F387 HydrophobicContact CG2-CD1 4.43Å; V340-F387 HydrophobicContact CG2-CE1 4.08Å; I343-F387 HydrophobicContact CB-CE1 3.9Å; I343-F387 HydrophobicContact CB-CZ 4.12Å; I343-F387 HydrophobicContact CD1-CD1 3.66Å; I343-F387 HydrophobicContact CD1-CE1 3.57Å; I343-F387 HydrophobicContact CD1-CZ 4.48Å; I343-F387 HydrophobicContact CG1-CE1 4.36Å; I343-F387 HydrophobicContact CG2-CD1 4.39Å; I343-F387 HydrophobicContact CG2-CE1 3.62Å; I343-F387 HydrophobicContact CG2-CE2 4.1Å; I343-F387 HydrophobicContact CG2-CZ 3.44Å; I343-F387 VanDerWaalsContact CG2-CZ 3.44Å; S384-F387 WeakPolarHBondContact O-CB 3.5Å; S384-F387 WeakPolarHBondContact O-CD2 3.38Å; S384-F387 PolarHBondContact O-N 3.01Å; S384-F387 VanDerWaalsContact O-N 3.16Å; M385-F387 PolarHBondContact O-N 2.93Å; F387-L429 HydrophobicContact CB-CB 4.27Å; F387-L429 HydrophobicContact CD1-CB 4.15Å; F387-L429 HydrophobicContact CD1-CD1 3.93Å; F387-L429 WeakPolarHBondContact O-CB 3.31Å; F387-L429 PolarHBondContact O-N 3.49Å; F387-L429 VanDerWaalsContact O-N 3.1Å; F387-L430 HydrophobicContact CB-CB 3.95Å; F387-L430 HydrophobicContact CB-CD1 3.9Å; F387-L430 HydrophobicContact CB-CG 4Å; F387-L430 HydrophobicContact CD2-CD1 4.1Å; F387-L430 HydrophobicContact CG-CD1 4.13Å; F387-L430 HydrophobicContact CG-CG 4.47Å; F387-L430 PolarHBondContact O-N 3.45Å
388F93.8Very high84.6Confident67 Ų6764.2 Ų64.229%0.29437%0.365SS..Hα-helixtrans-89.4-9.5176.7-62-86.8000112.9L95 S384 M385 L386 T428 L430 W432 V435L95-F388 HydrophobicContact CD2-CE2 4.33Å; L95-F388 HydrophobicContact CD2-CZ 4.26Å; S384-F388 WeakPolarHBondContact O-CD2 3.22Å; M385-F388 PolarHBondContact O-N 2.97Å; L386-F388 PolarHBondContact O-N 3.49Å; F388-T428 WeakPolarHBondContact O-CG2 3.46Å; F388-L430 HydrophobicContact CD1-CB 4.49Å; F388-L430 HydrophobicContact CE1-CB 4.23Å; F388-L430 HydrophobicContact CZ-CB 4.36Å; F388-W432 HydrophobicContact CE1-CE3 4.42Å; F388-W432 HydrophobicContact CZ-CE3 4.26Å; F388-V435 HydrophobicContact CE1-CG2 4.38Å; F388-V435 HydrophobicContact CZ-CG2 3.85Å
389V91.9Very high82.3Confident110 Ų11064.6 Ų64.667%0.66737%0.37SS*.Hα-helixtrans-103.3-41.8179.9179.80000111M385 L386M385-V389 PolarHBondContact O-N 3.46Å; L386-V389 PolarHBondContact O-N 2.85Å; L386-V389 VanDerWaalsContact O-N 3.12Å
390I91.3Very high80Confident48 Ų4872.3 Ų72.325%0.24640%0.399CS..SBendtrans-77.5130.1-173.2-65.9167.8000110.6A339 I343 L386 T428 L429A339-I390 HydrophobicContact CB-CG2 4.43Å; I343-I390 HydrophobicContact CD1-CD1 3.71Å; I343-I390 HydrophobicContact CG1-CD1 4.28Å; L386-I390 HydrophobicContact CB-CD1 4.02Å; L386-I390 WeakPolarHBondContact O-CB 3.48Å; L386-I390 WeakPolarHBondContact O-CG1 3.31Å; L386-I390 PolarHBondContact O-N 2.86Å; I390-T428 WeakPolarHBondContact O-CA 3.49Å; I390-L429 HydrophobicContact CB-CD1 3.95Å; I390-L429 HydrophobicContact CB-CG 4.42Å; I390-L429 HydrophobicContact CG2-CD1 3.79Å; I390-L429 HydrophobicContact CG2-CG 4.24Å; I390-L429 PolarHBondContact O-N 2.8Å
391P88.3Confident77.5Confident42 Ų4274.1 Ų74.127%0.27342%0.418SS..BIsolated β-bridgetrans-73.3147.2177.930.6-35.2000111.8F335 R393 P426F335-P391 WeakPolarHBondContact CE1-O 3.28Å; P391-R393 PolarHBondContact O-N 2.86Å; P391-P426 HydrophobicContact CB-CB 4.25Å; P391-P426 HydrophobicContact CB-CG 3.85Å
392S86Confident74.9Confident14 Ų1479.6 Ų79.610%0.09844%0.44CS..SBendtrans-70.6-13.9178.157.40000115W103 A336 R427W103-S392 VanDerWaalsContact CZ2-CB 3.47Å; A336-S392 WeakPolarHBondContact CB-O 3.49Å; S392-R427 WeakPolarHBondContact CB-O 3.4Å; S392-R427 PolarHBondContact N-O 3.42Å; S392-R427 PolarHBondContact OG-O 2.99Å
393R82.9Confident72.1Confident181 Ų18178.8 Ų78.868%0.68345%0.446SS*.SBendtrans-139.2139175.5-61.7-174.8-176.7-174-0.1108.4P391 P426P391-R393 PolarHBondContact O-N 2.86Å; R393-P426 HydrophobicContact CB-CB 4.25Å
394L75.9Confident69.5Low117 Ų11786.5 Ų86.561%0.61348%0.482SS*.  trans-57.4132.8171.6-78.6162.2000109.3F335 S396F335-L394 HydrophobicContact CD1-CG 4.35Å; F335-L394 HydrophobicContact CD2-CD1 3.64Å; F335-L394 HydrophobicContact CD2-CG 3.69Å; F335-L394 HydrophobicContact CE1-CG 4.14Å; F335-L394 HydrophobicContact CE2-CD1 3.63Å; F335-L394 HydrophobicContact CE2-CD2 3.82Å; F335-L394 HydrophobicContact CE2-CG 3.46Å; F335-L394 VanDerWaalsContact CE2-CG 3.46Å; F335-L394 HydrophobicContact CG-CD1 4.39Å; F335-L394 HydrophobicContact CG-CG 4.14Å; F335-L394 HydrophobicContact CZ-CD1 4.37Å; F335-L394 HydrophobicContact CZ-CD2 3.8Å; F335-L394 HydrophobicContact CZ-CG 3.7Å; L394-S396 PolarHBondContact O-N 2.97Å
395P63.2Low66.9Low79 Ų7991 Ų9151%0.51352%0.519SS..  trans-62.8112.7167.725.3-29.3000107.5C397P395-C397 PolarHBondContact O-N 2.84Å; P395-C397 VanDerWaalsContact O-N 3.08Å
396S58.9Low64.4Low67 Ų6787.3 Ų87.347%0.46950%0.502SS..  trans-68.3108.5172.6-177.80000107.6L394 G398 S399L394-S396 PolarHBondContact O-N 2.97Å; S396-G398 VanDerWaalsContact C-N 3.28Å; S396-G398 PolarHBondContact O-N 3.45Å; S396-S399 PolarHBondContact O-N 3.49Å
397C48Very low62.1Low142 Ų14293.2 Ų93.296%0.95952%0.522SS*.THydrogen-bonded Turntrans-68.890171.8-157.30000107.6P395P395-C397 PolarHBondContact O-N 2.84Å; P395-C397 VanDerWaalsContact O-N 3.08Å
398G53.2Low59.6Low78 Ų78100.4 Ų100.480%0.80456%0.56SS**THydrogen-bonded Turntrans126.9-9.417700000116.6S396S396-G398 VanDerWaalsContact C-N 3.28Å; S396-G398 PolarHBondContact O-N 3.45Å
399S43.3Very low57.4Low73 Ų7398.9 Ų98.951%0.5156%0.557SS.*  trans-128.871.9175.9-159.30000111.8S396 G401S396-S399 PolarHBondContact O-N 3.49Å; S399-G401 PolarHBondContact O-N 2.99Å
400Y45.7Very low55.3Low170 Ų17096.3 Ų96.367%0.66754%0.542SS*.  trans-84.170.3151.9-74.7-81000107.7I423Y400-I423 HydrophobicContact CD1-CG2 3.56Å; Y400-I423 HydrophobicContact CE1-CG2 3.66Å
401G42.4Very low53.5Low38 Ų38103.5 Ų103.539%0.39257%0.567SS.*  trans-162122.3-174.600000113.7S399S399-G401 PolarHBondContact O-N 2.99Å
402F39.2Very low51.9Low155 Ų155106.5 Ų106.568%0.6858%0.58SS**  trans48.7102.4154.3-60.7-86.6000118.6V410F402-V410 HydrophobicContact CE1-CG2 4.02Å
403T37.5Very low50.1Low105 Ų105110.3 Ų110.364%0.64459%0.594SS**  trans-72.7133.2150.420.70000109.6A405 D406T403-A405 PolarHBondContact O-N 2.82Å; T403-D406 PolarHBondContact O-N 3.45Å
404E39.7Very low48.5Very low167 Ų167109.3 Ų109.378%0.7860%0.6SS**G310 helixtrans-53.6-16.3-176.5-75.8-165.1145.400116.2D406E404-D406 PolarHBondContact O-N 3.4Å; E404-D406 VanDerWaalsContact O-N 3.11Å
405A39.7Very low47.6Very low98 Ų98112.9 Ų112.981%0.8161%0.611SS**G310 helixtrans-68.3-3.2175.600000114.4T403T403-A405 PolarHBondContact O-N 2.82Å
406D42.2Very low47.3Very low35 Ų35114.4 Ų114.419%0.18761%0.614CS.*G310 helixtrans-98.6-6.8-174.8-91-49.5000115T403 E404 L408 S409 V410 K421T403-D406 PolarHBondContact O-N 3.45Å; E404-D406 PolarHBondContact O-N 3.4Å; E404-D406 VanDerWaalsContact O-N 3.11Å; D406-L408 VanDerWaalsContact C-N 3.33Å; D406-L408 PolarHBondContact O-N 3.38Å; D406-S409 WeakPolarHBondContact O-CA 3.25Å; D406-S409 WeakPolarHBondContact O-CB 3.41Å; D406-S409 PolarHBondContact O-N 2.86Å; D406-V410 HydrophobicContact CB-CG2 4.48Å; D406-V410 VanDerWaalsContact O-CG2 3.3Å; D406-V410 WeakPolarHBondContact O-CG2 3.41Å; D406-V410 PolarHBondContact O-N 3.39Å; D406-K421 IonicContact OD1-NZ 3.67Å; D406-K421 PolarHBondContact OD1-NZ 2.85Å; D406-K421 IonicContact OD2-NZ 2.71Å; D406-K421 PolarHBondContact OD2-NZ 2.92Å
407Y46.7Very low46.7Very low172 Ų172120 Ų12068%0.67563%0.632SS**Hα-helixtrans-60.7-35.6-172.4-83.7-76.5000114.4
408L41.4Very low46.7Very low151 Ų151118.2 Ų118.279%0.79162%0.616SS**Hα-helixtrans-77.4-23.6175.2-163.568.6000112.5D406D406-L408 VanDerWaalsContact C-N 3.33Å; D406-L408 PolarHBondContact O-N 3.38Å
409S47.9Very low46.3Very low35 Ų35120.8 Ų120.825%0.24562%0.617CS.*Hα-helixtrans-81.4-22.7179.3-173.40000112.7D406 K413D406-S409 WeakPolarHBondContact O-CA 3.25Å; D406-S409 WeakPolarHBondContact O-CB 3.41Å; D406-S409 PolarHBondContact O-N 2.86Å; S409-K413 VanDerWaalsContact O-CB 3.31Å; S409-K413 WeakPolarHBondContact O-CB 3.41Å; S409-K413 WeakPolarHBondContact O-CG 3.45Å; S409-K413 PolarHBondContact O-N 2.95Å; S409-K413 WeakPolarHBondContact OG-CD 3.41Å; S409-K413 VanDerWaalsContact OG-CE 3.28Å; S409-K413 WeakPolarHBondContact OG-CE 3.32Å; S409-K413 PolarHBondContact OG-NZ 3.48Å
410V47.9Very low46.3Very low56 Ų56120.6 Ų120.634%0.33963%0.627SS.*Hα-helixtrans-71-46.1-176.1169.10000112.1F402 D406 I412 K413 M414F402-V410 HydrophobicContact CE1-CG2 4.02Å; D406-V410 HydrophobicContact CB-CG2 4.48Å; D406-V410 VanDerWaalsContact O-CG2 3.3Å; D406-V410 WeakPolarHBondContact O-CG2 3.41Å; D406-V410 PolarHBondContact O-N 3.39Å; V410-I412 VanDerWaalsContact C-N 3.31Å; V410-I412 PolarHBondContact O-N 3.38Å; V410-K413 PolarHBondContact O-N 2.9Å; V410-M414 VanDerWaalsContact O-CB 3.3Å; V410-M414 WeakPolarHBondContact O-CB 3.38Å; V410-M414 PolarHBondContact O-N 3.25Å
411Y53.4Low46.1Very low199 Ų199118.9 Ų118.978%0.7862%0.622SS**Hα-helixtrans-61.5-41177.8-99.6-84.3000112F415Y411-F415 PolarHBondContact O-N 3.38Å
412I53.9Low46.3Very low104 Ų104128 Ų12853%0.53365%0.645SS.*Hα-helixtrans-69.3-42179.3-65.1173.3000111.2V410 F415 L416V410-I412 VanDerWaalsContact C-N 3.31Å; V410-I412 PolarHBondContact O-N 3.38Å; I412-F415 PolarHBondContact O-N 3.41Å; I412-L416 HydrophobicContact CG2-CD1 3.87Å; I412-L416 PolarHBondContact O-N 2.92Å
413K49.8Very low47Very low94 Ų94126.8 Ų126.841%0.40964%0.644SS.*Hα-helixtrans-72.6-29.8-180-78.9174.1177150.10113.4S409 V410 F415 L416S409-K413 VanDerWaalsContact O-CB 3.31Å; S409-K413 WeakPolarHBondContact O-CB 3.41Å; S409-K413 WeakPolarHBondContact O-CG 3.45Å; S409-K413 PolarHBondContact O-N 2.95Å; S409-K413 WeakPolarHBondContact OG-CD 3.41Å; S409-K413 VanDerWaalsContact OG-CE 3.28Å; S409-K413 WeakPolarHBondContact OG-CE 3.32Å; S409-K413 PolarHBondContact OG-NZ 3.48Å; V410-K413 PolarHBondContact O-N 2.9Å; K413-F415 VanDerWaalsContact C-N 3.32Å; K413-L416 PolarHBondContact O-N 2.96Å
414M48.7Very low48Very low161 Ų161130.7 Ų130.779%0.79365%0.652SS**Hα-helixtrans-68.9-32175.5-171169.3158.600111.7V410V410-M414 VanDerWaalsContact O-CB 3.3Å; V410-M414 WeakPolarHBondContact O-CB 3.38Å; V410-M414 PolarHBondContact O-N 3.25Å
415F57.5Low49.1Very low192 Ų192126.5 Ų126.584%0.84265%0.646SS**Hα-helixtrans-75.7-24.4174.2-152.7-94.7000113.3Y411 I412 K413Y411-F415 PolarHBondContact O-N 3.38Å; I412-F415 PolarHBondContact O-N 3.41Å; K413-F415 VanDerWaalsContact C-N 3.32Å
416L56.7Low50.7Low111 Ų111124.3 Ų124.358%0.58162%0.624SS**THydrogen-bonded Turntrans-974.8-170.4-90160000116.1I412 K413 V418I412-L416 HydrophobicContact CG2-CD1 3.87Å; I412-L416 PolarHBondContact O-N 2.92Å; K413-L416 PolarHBondContact O-N 2.96Å; L416-V418 HydrophobicContact CB-CG2 4.13Å; L416-V418 PolarHBondContact O-N 3.06Å
417H44.9Very low52.7Low184 Ų184131.9 Ų131.985%0.85265%0.65SS**THydrogen-bonded Turntrans49.134.6178.1-107.2108.1000114.4T419H417-T419 PolarHBondContact O-N 3.23Å
418V48.7Very low54.8Low104 Ų104126.2 Ų126.263%0.6363%0.633SS**  trans-83.9112178.2179.80000109.8L416L416-V418 HydrophobicContact CB-CG2 4.13Å; L416-V418 PolarHBondContact O-N 3.06Å
419T44.9Very low57.1Low133 Ų133119 Ų11982%0.81660%0.595SS**  trans-53.2127.8177.744.70000114H417H417-T419 PolarHBondContact O-N 3.23Å
420G42.7Very low59.3Low69 Ų69117.4 Ų117.471%0.71158%0.584SS**  trans48.399149.100000118.8R422G420-R422 PolarHBondContact O-N 3.42Å; G420-R422 VanDerWaalsContact O-N 3.09Å
421K43.1Very low61.4Low133 Ų133117.6 Ų117.658%0.57858%0.583SS**  trans-64.4109.9160.3-82.8-177175.4176.60108.7D406 I423D406-K421 IonicContact OD1-NZ 3.67Å; D406-K421 PolarHBondContact OD1-NZ 2.85Å; D406-K421 IonicContact OD2-NZ 2.71Å; D406-K421 PolarHBondContact OD2-NZ 2.92Å; K421-I423 PolarHBondContact O-N 3.28Å
422R46.8Very low63.2Low231 Ų231115.4 Ų115.487%0.87257%0.573SS**  trans-58.5120169.7-67.3-170.3-177.7-167.41.3109.2G420 K424G420-R422 PolarHBondContact O-N 3.42Å; G420-R422 VanDerWaalsContact O-N 3.09Å; R422-K424 PolarHBondContact O-N 3.48Å
423I53.8Low65Low128 Ų128116.5 Ų116.566%0.65658%0.576SS**  trans-60.6109.1172.5-60170.6000107.1Y400 K421 A425Y400-I423 HydrophobicContact CD1-CG2 3.56Å; Y400-I423 HydrophobicContact CE1-CG2 3.66Å; K421-I423 PolarHBondContact O-N 3.28Å; I423-A425 PolarHBondContact O-N 2.9Å
424K56.9Low67Low187 Ų187113 Ų11381%0.81356%0.562SS**  trans-82.6115.3176.7-73.7-176.5179.3177.90108.1R422R422-K424 PolarHBondContact O-N 3.48Å
425A64.1Low69.1Low80 Ų80105.3 Ų105.366%0.66153%0.525SS*.PPolyproline II helixtrans-52.3143.4169.700000110.1I423 R427I423-A425 PolarHBondContact O-N 2.9Å; A425-R427 PolarHBondContact O-N 2.92Å
426P73.4Confident70.8Confident51 Ų51101.7 Ų101.733%0.33151%0.51SS..PPolyproline II helixtrans-57.9133.8174.925.3-32.5000108.8P391 R393P391-P426 HydrophobicContact CB-CB 4.25Å; P391-P426 HydrophobicContact CB-CG 3.85Å; R393-P426 HydrophobicContact CB-CB 4.25Å
427R82.9Confident72.5Confident195 Ų195102.6 Ų102.674%0.73651%0.512SS*.PPolyproline II helixtrans-61.5149176.3-64.1-179.7178.7-178.8-2.9109.3S392 A425S392-R427 WeakPolarHBondContact CB-O 3.4Å; S392-R427 PolarHBondContact N-O 3.42Å; S392-R427 PolarHBondContact OG-O 2.99Å; A425-R427 PolarHBondContact O-N 2.92Å
428T91.4Very high74.5Confident52 Ų5299 Ų9932%0.31949%0.49SS..BIsolated β-bridgetrans-63164.9171.248.70000111F388 I390 L430F388-T428 WeakPolarHBondContact O-CG2 3.46Å; I390-T428 WeakPolarHBondContact O-CA 3.49Å; T428-L430 VanDerWaalsContact C-N 3.25Å; T428-L430 WeakPolarHBondContact CB-O 3.48Å; T428-L430 PolarHBondContact O-N 2.97Å; T428-L430 PolarHBondContact OG1-O 2.98Å
429L90.5Very high76.5Confident0 Ų094.6 Ų94.60%046%0.463CS..SBendtrans-61.1-36.2179.2-67.8172.8000112.2W103 A336 A339 V340 I343 F387 I390W103-L429 HydrophobicContact CZ2-CD2 4.23Å; W103-L429 PolarHBondContact NE1-O 3.29Å; A336-L429 HydrophobicContact CB-CD2 3.59Å; A339-L429 HydrophobicContact CB-CD1 3.95Å; A339-L429 HydrophobicContact CB-CD2 4.36Å; V340-L429 HydrophobicContact CG2-CD1 4.18Å; V340-L429 HydrophobicContact CG2-CD2 4.18Å; I343-L429 HydrophobicContact CD1-CD1 3.75Å; F387-L429 HydrophobicContact CB-CB 4.27Å; F387-L429 HydrophobicContact CD1-CB 4.15Å; F387-L429 HydrophobicContact CD1-CD1 3.93Å; F387-L429 WeakPolarHBondContact O-CB 3.31Å; F387-L429 PolarHBondContact O-N 3.49Å; F387-L429 VanDerWaalsContact O-N 3.1Å; I390-L429 HydrophobicContact CB-CD1 3.95Å; I390-L429 HydrophobicContact CB-CG 4.42Å; I390-L429 HydrophobicContact CG2-CD1 3.79Å; I390-L429 HydrophobicContact CG2-CG 4.24Å; I390-L429 PolarHBondContact O-N 2.8Å
430L92.7Very high78.6Confident1 Ų189.9 Ų89.91%0.00544%0.435CS..  trans-129.2153.1170.2-76.9180000111.6I98 A99 H102 F387 F388 T428 V434 V435I98-L430 HydrophobicContact CG2-CD2 4.04Å; A99-L430 HydrophobicContact CB-CD1 3.77Å; A99-L430 HydrophobicContact CB-CD2 4.39Å; A99-L430 HydrophobicContact CB-CG 4.02Å; H102-L430 HydrophobicContact CB-CD2 4.34Å; F387-L430 HydrophobicContact CB-CB 3.95Å; F387-L430 HydrophobicContact CB-CD1 3.9Å; F387-L430 HydrophobicContact CB-CG 4Å; F387-L430 HydrophobicContact CD2-CD1 4.1Å; F387-L430 HydrophobicContact CG-CD1 4.13Å; F387-L430 HydrophobicContact CG-CG 4.47Å; F387-L430 PolarHBondContact O-N 3.45Å; F388-L430 HydrophobicContact CD1-CB 4.49Å; F388-L430 HydrophobicContact CE1-CB 4.23Å; F388-L430 HydrophobicContact CZ-CB 4.36Å; T428-L430 VanDerWaalsContact C-N 3.25Å; T428-L430 WeakPolarHBondContact CB-O 3.48Å; T428-L430 PolarHBondContact O-N 2.97Å; T428-L430 PolarHBondContact OG1-O 2.98Å; L430-V434 HydrophobicContact CD2-CG1 4.15Å; L430-V435 HydrophobicContact CD1-CG2 4.43Å
431N91.9Very high80.9Confident60 Ų6091.1 Ų91.132%0.32142%0.418SS..  trans-124.1159.216868.747000109.4Q433 V434 V435N431-Q433 VanDerWaalsContact C-N 3.25Å; N431-Q433 PolarHBondContact O-N 3.02Å; N431-Q433 PolarHBondContact OD1-N 3.39Å; N431-V434 PolarHBondContact O-N 3.32Å; N431-V434 VanDerWaalsContact OD1-CG2 3.28Å; N431-V434 WeakPolarHBondContact OD1-CG2 3.43Å; N431-V434 PolarHBondContact OD1-N 2.87Å; N431-V435 PolarHBondContact O-N 3.31Å
432W92.8Very high83Confident153 Ų15388.5 Ų88.558%0.5841%0.41SS*.Hα-helixtrans-65.5-29.7-175.2-172.2-108.9000113.1F388 V435 H436 W441F388-W432 HydrophobicContact CE1-CE3 4.42Å; F388-W432 HydrophobicContact CZ-CE3 4.26Å; W432-V435 HydrophobicContact CE3-CB 4.29Å; W432-V435 HydrophobicContact CE3-CG1 4.18Å; W432-V435 HydrophobicContact CH2-CG1 4.42Å; W432-V435 HydrophobicContact CZ3-CG1 3.98Å; W432-V435 PolarHBondContact O-N 3Å; W432-H436 WeakPolarHBondContact O-CB 3.28Å; W432-H436 PolarHBondContact O-N 2.69Å; W432-W441 HydrophobicContact CH2-CH2 4.14Å; W432-W441 HydrophobicContact CZ2-CH2 4.14Å; W432-W441 HydrophobicContact CZ2-CZ2 4.36Å
433Q91.1Very high84.9Confident128 Ų12879.1 Ų79.160%0.59838%0.377SS*.Hα-helixtrans-64.2-44.7178.8-175.9173.7-3.100111.8N431 V435 H436 E437N431-Q433 VanDerWaalsContact C-N 3.25Å; N431-Q433 PolarHBondContact O-N 3.02Å; N431-Q433 PolarHBondContact OD1-N 3.39Å; Q433-V435 VanDerWaalsContact C-N 3.27Å; Q433-V435 PolarHBondContact O-N 3.44Å; Q433-H436 PolarHBondContact O-N 3.12Å; Q433-E437 WeakPolarHBondContact CG-OE1 3.25Å; Q433-E437 PolarHBondContact NE2-OE1 3.42Å; Q433-E437 VanDerWaalsContact NE2-OE1 3.08Å; Q433-E437 WeakPolarHBondContact O-CG 3.42Å; Q433-E437 PolarHBondContact O-N 3.28Å
434V92.1Very high86.5Confident19 Ų1973.7 Ų73.712%0.11535%0.349CS..Hα-helixtrans-61-39.9175.7170.70000110.7I98 L430 N431 R438I98-V434 HydrophobicContact CG2-CG1 3.94Å; L430-V434 HydrophobicContact CD2-CG1 4.15Å; N431-V434 PolarHBondContact O-N 3.32Å; N431-V434 VanDerWaalsContact OD1-CG2 3.28Å; N431-V434 WeakPolarHBondContact OD1-CG2 3.43Å; N431-V434 PolarHBondContact OD1-N 2.87Å; V434-R438 WeakPolarHBondContact O-CB 3.48Å; V434-R438 WeakPolarHBondContact O-CG 3.38Å; V434-R438 PolarHBondContact O-N 3.23Å; V434-R438 VanDerWaalsContact O-N 3.1Å
435V93.3Very high88.2Confident0 Ų067.8 Ų67.80%033%0.327CS..Hα-helixtrans-64.6-49175.4174.30000110.9L95 F388 L430 N431 W432 Q433 E437 R438 M439L95-V435 HydrophobicContact CD2-CB 4.2Å; L95-V435 HydrophobicContact CD2-CG1 3.56Å; L95-V435 HydrophobicContact CD2-CG2 3.48Å; L95-V435 VanDerWaalsContact CD2-CG2 3.48Å; F388-V435 HydrophobicContact CE1-CG2 4.38Å; F388-V435 HydrophobicContact CZ-CG2 3.85Å; L430-V435 HydrophobicContact CD1-CG2 4.43Å; N431-V435 PolarHBondContact O-N 3.31Å; W432-V435 HydrophobicContact CE3-CB 4.29Å; W432-V435 HydrophobicContact CE3-CG1 4.18Å; W432-V435 HydrophobicContact CH2-CG1 4.42Å; W432-V435 HydrophobicContact CZ3-CG1 3.98Å; W432-V435 PolarHBondContact O-N 3Å; Q433-V435 VanDerWaalsContact C-N 3.27Å; Q433-V435 PolarHBondContact O-N 3.44Å; V435-E437 VanDerWaalsContact C-N 3.28Å; V435-E437 PolarHBondContact O-N 3.35Å; V435-R438 PolarHBondContact O-N 3.04Å; V435-M439 HydrophobicContact CG1-CB 4.31Å; V435-M439 HydrophobicContact CG1-CE 3.66Å; V435-M439 HydrophobicContact CG1-SD 4.03Å; V435-M439 WeakPolarHBondContact O-CB 3.5Å; V435-M439 PolarHBondContact O-N 2.87Å
436H92.9Very high89.4Confident116 Ų11664.2 Ų64.254%0.53730%0.296SS..Hα-helixtrans-57-42-179.9178.866000112.4W432 Q433 W441W432-H436 WeakPolarHBondContact O-CB 3.28Å; W432-H436 PolarHBondContact O-N 2.69Å; Q433-H436 PolarHBondContact O-N 3.12Å; H436-W441 PolarHBondContact O-NE1 3.14Å
437E90.8Very high90.1Very high131 Ų13161.8 Ų61.861%0.61228%0.281SS*.Hα-helixtrans-72.6-33.3-180-71.2171.7-16700113.4Q433 V435Q433-E437 WeakPolarHBondContact CG-OE1 3.25Å; Q433-E437 PolarHBondContact NE2-OE1 3.42Å; Q433-E437 VanDerWaalsContact NE2-OE1 3.08Å; Q433-E437 WeakPolarHBondContact O-CG 3.42Å; Q433-E437 PolarHBondContact O-N 3.28Å; V435-E437 VanDerWaalsContact C-N 3.28Å; V435-E437 PolarHBondContact O-N 3.35Å
438R88Confident90.4Very high108 Ų10852.5 Ų52.541%0.40825%0.245SC..Hα-helixtrans-102.2-16-172.9-65.3-172.9176.1-127.9-1.5114.8I98 E101 V434 V435 P440I98-R438 HydrophobicContact CD1-CB 3.98Å; I98-R438 HydrophobicContact CG1-CB 3.99Å; I98-R438 HydrophobicContact CG2-CB 4.26Å; E101-R438 IonicContact OE1-CZ 2.75Å; E101-R438 IonicContact OE1-NH1 3.87Å; E101-R438 PolarHBondContact OE1-NH1 2.85Å; E101-R438 IonicContact OE2-NH1 2.98Å; E101-R438 PolarHBondContact OE2-NH1 2.92Å; V434-R438 WeakPolarHBondContact O-CB 3.48Å; V434-R438 WeakPolarHBondContact O-CG 3.38Å; V434-R438 PolarHBondContact O-N 3.23Å; V434-R438 VanDerWaalsContact O-N 3.1Å; V435-R438 PolarHBondContact O-N 3.04Å; R438-P440 WeakPolarHBondContact O-CD 3.44Å
439M90.2Very high90.4Very high12 Ų1250 Ų506%0.05923%0.23CC..  trans-77.5126.8-176-175.2161.9-81.100111.3L94 L95 I98 V435 W441 I444L94-M439 HydrophobicContact CB-CE 4.34Å; L95-M439 HydrophobicContact CD2-CE 3.77Å; L95-M439 HydrophobicContact CG-CE 3.78Å; I98-M439 HydrophobicContact CD1-CB 4.28Å; I98-M439 HydrophobicContact CD1-CE 4.43Å; V435-M439 HydrophobicContact CG1-CB 4.31Å; V435-M439 HydrophobicContact CG1-CE 3.66Å; V435-M439 HydrophobicContact CG1-SD 4.03Å; V435-M439 WeakPolarHBondContact O-CB 3.5Å; V435-M439 PolarHBondContact O-N 2.87Å; M439-W441 VanDerWaalsContact C-N 3.32Å; M439-W441 HydrophobicContact CB-CZ2 4.18Å; M439-W441 HydrophobicContact CG-CD2 4.19Å; M439-W441 HydrophobicContact CG-CE3 4.5Å; M439-W441 HydrophobicContact CG-CH2 4.46Å; M439-W441 HydrophobicContact CG-CZ2 4.15Å; M439-W441 PolarHBondContact O-N 3.18Å; M439-W441 HydrophobicContact SD-CD2 4.42Å; M439-W441 HydrophobicContact SD-CE3 4.29Å; M439-W441 HydrophobicContact SD-CH2 3.54Å; M439-W441 VanDerWaalsContact SD-CH2 3.54Å; M439-W441 HydrophobicContact SD-CZ2 3.68Å; M439-W441 HydrophobicContact SD-CZ3 3.86Å; M439-I444 HydrophobicContact CG-CD1 4.19Å; M439-I444 HydrophobicContact SD-CD1 4.09Å
440P89Confident90.2Very high34 Ų3450.1 Ų50.122%0.22123%0.231CC..  trans-79.875.8177.333.5-37.5000111.6L94 R438 N442 I443L94-P440 HydrophobicContact CD1-CG 3.71Å; L94-P440 HydrophobicContact CD2-CG 4.07Å; R438-P440 WeakPolarHBondContact O-CD 3.44Å; P440-N442 VanDerWaalsContact C-OD1 3.25Å; P440-N442 WeakPolarHBondContact CA-OD1 3.41Å; P440-N442 WeakPolarHBondContact CB-OD1 3.35Å; P440-N442 PolarHBondContact O-N 3.31Å; P440-N442 VanDerWaalsContact O-N 3.12Å; P440-N442 PolarHBondContact O-OD1 3.07Å; P440-I443 HydrophobicContact CB-CD1 3.79Å; P440-I443 HydrophobicContact CB-CG1 4.05Å; P440-I443 HydrophobicContact CG-CD1 4Å; P440-I443 PolarHBondContact O-N 2.94Å
441W91Very high90.1Very high94 Ų9450.1 Ų50.136%0.35623%0.231SC..Hα-helixtrans-55-30.9-180-61.4102.4000113.8W432 H436 M439 I443 I444 L445W432-W441 HydrophobicContact CH2-CH2 4.14Å; W432-W441 HydrophobicContact CZ2-CH2 4.14Å; W432-W441 HydrophobicContact CZ2-CZ2 4.36Å; H436-W441 PolarHBondContact O-NE1 3.14Å; M439-W441 VanDerWaalsContact C-N 3.32Å; M439-W441 HydrophobicContact CB-CZ2 4.18Å; M439-W441 HydrophobicContact CG-CD2 4.19Å; M439-W441 HydrophobicContact CG-CE3 4.5Å; M439-W441 HydrophobicContact CG-CH2 4.46Å; M439-W441 HydrophobicContact CG-CZ2 4.15Å; M439-W441 PolarHBondContact O-N 3.18Å; M439-W441 HydrophobicContact SD-CD2 4.42Å; M439-W441 HydrophobicContact SD-CE3 4.29Å; M439-W441 HydrophobicContact SD-CH2 3.54Å; M439-W441 VanDerWaalsContact SD-CH2 3.54Å; M439-W441 HydrophobicContact SD-CZ2 3.68Å; M439-W441 HydrophobicContact SD-CZ3 3.86Å; W441-I443 PolarHBondContact O-N 2.87Å; W441-I444 HydrophobicContact CE3-CD1 3.86Å; W441-I444 HydrophobicContact CZ3-CD1 4.16Å; W441-I444 PolarHBondContact O-N 3.16Å; W441-L445 PolarHBondContact O-N 3.4Å
442N88.3Confident90.1Very high78 Ų7847.2 Ų47.242%0.41722%0.215SC..Hα-helixtrans-58.1-36176.761.7-42000112.7A57 P440 L446A57-N442 HydrophobicContact CB-CB 3.86Å; P440-N442 VanDerWaalsContact C-OD1 3.25Å; P440-N442 WeakPolarHBondContact CA-OD1 3.41Å; P440-N442 WeakPolarHBondContact CB-OD1 3.35Å; P440-N442 PolarHBondContact O-N 3.31Å; P440-N442 VanDerWaalsContact O-N 3.12Å; P440-N442 PolarHBondContact O-OD1 3.07Å; N442-L446 WeakPolarHBondContact O-CB 3.43Å; N442-L446 PolarHBondContact O-N 3.05Å; N442-L446 VanDerWaalsContact O-N 3.1Å
443I84.9Confident89.9Confident34 Ų3440.1 Ų40.117%0.17419%0.189CC..Hα-helixtrans-74.8-38-178.9-58.4179.2000110.8F90 T250 P440 W441 L445 L446 L447F90-I443 HydrophobicContact CD1-CG2 4.46Å; F90-I443 HydrophobicContact CE1-CB 3.78Å; F90-I443 HydrophobicContact CE1-CG2 3.4Å; F90-I443 HydrophobicContact CZ-CB 4.04Å; F90-I443 HydrophobicContact CZ-CD1 4.37Å; F90-I443 HydrophobicContact CZ-CG2 3.5Å; T250-I443 HydrophobicContact CG2-CG2 3.28Å; T250-I443 WeakPolarHBondContact OG1-CG2 3.4Å; P440-I443 HydrophobicContact CB-CD1 3.79Å; P440-I443 HydrophobicContact CB-CG1 4.05Å; P440-I443 HydrophobicContact CG-CD1 4Å; P440-I443 PolarHBondContact O-N 2.94Å; W441-I443 PolarHBondContact O-N 2.87Å; I443-L445 VanDerWaalsContact C-N 3.33Å; I443-L445 PolarHBondContact O-N 2.8Å; I443-L446 WeakPolarHBondContact O-CB 3.39Å; I443-L446 PolarHBondContact O-N 2.86Å; I443-L446 VanDerWaalsContact O-N 3.17Å; I443-L447 HydrophobicContact CG2-CD1 4.48Å; I443-L447 WeakPolarHBondContact O-CG 3.48Å; I443-L447 PolarHBondContact O-N 3.29Å
444I89.3Confident89.7Confident14 Ų1434 Ų347%0.07216%0.16CC..Hα-helixtrans-60.8-44.7176.8-60.8168.5000110.3N87 F90 M91 M439 W441 L446 G448N87-I444 PolarHBondContact ND2-O 3.36Å; F90-I444 HydrophobicContact CD1-CG1 3.92Å; F90-I444 HydrophobicContact CE1-CG1 4.05Å; M91-I444 HydrophobicContact CG-CD1 3.61Å; M91-I444 HydrophobicContact CG-CG1 4.22Å; M91-I444 HydrophobicContact SD-CD1 4.09Å; M439-I444 HydrophobicContact CG-CD1 4.19Å; M439-I444 HydrophobicContact SD-CD1 4.09Å; W441-I444 HydrophobicContact CE3-CD1 3.86Å; W441-I444 HydrophobicContact CZ3-CD1 4.16Å; W441-I444 PolarHBondContact O-N 3.16Å; I444-L446 VanDerWaalsContact C-N 3.33Å; I444-G448 PolarHBondContact O-N 3.02Å
445L92.4Very high89.5Confident64 Ų6433.3 Ų33.334%0.33516%0.156SC..Hα-helixtrans-66.1-36.6175.7-68.1175.9000112.4A57 L61 Y82 W441 I443 G448 G449A57-L445 HydrophobicContact CB-CB 4.22Å; A57-L445 HydrophobicContact CB-CD1 4.1Å; L61-L445 HydrophobicContact CD2-CD2 4.29Å; Y82-L445 HydrophobicContact CD1-CD2 4.35Å; Y82-L445 WeakPolarHBondContact CE1-O 3.25Å; W441-L445 PolarHBondContact O-N 3.4Å; I443-L445 VanDerWaalsContact C-N 3.33Å; I443-L445 PolarHBondContact O-N 2.8Å; L445-G448 PolarHBondContact O-N 2.97Å; L445-G449 PolarHBondContact O-N 3.01Å
446L88.9Confident89.3Confident4 Ų433.3 Ų33.32%0.02116%0.156CC..Hα-helixtrans-63.5-46.5178.5-161.5166.9000111.9W49 L56 A60 N442 I443 I444 G448 G449 G450 T499 T503W49-L446 HydrophobicContact CZ2-CD2 4.36Å; W49-L446 HydrophobicContact CZ2-CG 4.41Å; L56-L446 HydrophobicContact CB-CD1 3.8Å; L56-L446 HydrophobicContact CD1-CD1 4.08Å; L56-L446 HydrophobicContact CG-CD1 4.48Å; A60-L446 HydrophobicContact CB-CB 4.36Å; A60-L446 HydrophobicContact CB-CG 4.47Å; N442-L446 WeakPolarHBondContact O-CB 3.43Å; N442-L446 PolarHBondContact O-N 3.05Å; N442-L446 VanDerWaalsContact O-N 3.1Å; I443-L446 WeakPolarHBondContact O-CB 3.39Å; I443-L446 PolarHBondContact O-N 2.86Å; I443-L446 VanDerWaalsContact O-N 3.17Å; I444-L446 VanDerWaalsContact C-N 3.33Å; L446-G448 VanDerWaalsContact C-N 3.28Å; L446-G448 PolarHBondContact O-N 3.41Å; L446-G449 PolarHBondContact O-N 2.97Å; L446-G450 PolarHBondContact O-N 3.07Å; L446-T499 HydrophobicContact CD1-CG2 3.73Å; L446-T499 HydrophobicContact CD2-CG2 3.44Å; L446-T499 VanDerWaalsContact CD2-CG2 3.44Å; L446-T499 HydrophobicContact CG-CG2 4.1Å; L446-T503 WeakPolarHBondContact CD2-OG1 3.35Å
447L87.2Confident89Confident1 Ų128.1 Ų28.11%0.00513%0.133CC..Hα-helixtrans-52.9-48.4173.6-74.4161.5000111.1N87 F90 T250 L253 I254 I443 G449 G450 F451N87-L447 WeakPolarHBondContact OD1-CB 3.34Å; N87-L447 WeakPolarHBondContact OD1-CD1 3.39Å; F90-L447 HydrophobicContact CB-CD1 4.24Å; F90-L447 HydrophobicContact CD1-CD1 3.52Å; F90-L447 HydrophobicContact CE1-CD1 4.06Å; F90-L447 HydrophobicContact CG-CD1 4.01Å; T250-L447 HydrophobicContact CG2-CD1 4.32Å; T250-L447 HydrophobicContact CG2-CD2 4.03Å; T250-L447 HydrophobicContact CG2-CG 4.13Å; L253-L447 HydrophobicContact CB-CD2 4.34Å; I254-L447 HydrophobicContact CB-CD2 4.25Å; I254-L447 HydrophobicContact CD1-CD2 4.47Å; I254-L447 HydrophobicContact CG1-CD2 3.35Å; I254-L447 HydrophobicContact CG1-CG 4.49Å; I443-L447 HydrophobicContact CG2-CD1 4.48Å; I443-L447 WeakPolarHBondContact O-CG 3.48Å; I443-L447 PolarHBondContact O-N 3.29Å; L447-G449 PolarHBondContact O-N 3.32Å; L447-G450 PolarHBondContact O-N 3.4Å; L447-G450 VanDerWaalsContact O-N 3.14Å; L447-F451 HydrophobicContact CB-CE2 4.09Å; L447-F451 HydrophobicContact CB-CZ 4.37Å; L447-F451 HydrophobicContact CD2-CZ 4.14Å; L447-F451 VanDerWaalsContact O-CD2 3.28Å; L447-F451 WeakPolarHBondContact O-CD2 3.44Å; L447-F451 WeakPolarHBondContact O-CG 3.41Å; L447-F451 PolarHBondContact O-N 2.94Å
448G90.1Very high88.7Confident0 Ų026 Ų260%012%0.123CC..Hα-helixtrans-60.8-43.217800000114.1I444 L445 L446 G450 F451 A452I444-G448 PolarHBondContact O-N 3.02Å; L445-G448 PolarHBondContact O-N 2.97Å; L446-G448 VanDerWaalsContact C-N 3.28Å; L446-G448 PolarHBondContact O-N 3.41Å; G448-G450 VanDerWaalsContact C-N 3.26Å; G448-G450 PolarHBondContact O-N 2.97Å; G448-F451 PolarHBondContact O-N 3.4Å; G448-A452 WeakPolarHBondContact O-CB 3.46Å; G448-A452 PolarHBondContact O-N 2.61Å
449G90.4Very high88.7Confident0 Ų025 Ų250%013%0.129CC..Hα-helixtrans-61.5-35.7174.300000112.7A60 Y82 L445 L446 L447 L453A60-G449 VanDerWaalsContact O-CA 3.25Å; A60-G449 WeakPolarHBondContact O-CA 3.44Å; Y82-G449 VanDerWaalsContact CE1-N 3.34Å; Y82-G449 WeakPolarHBondContact OH-CA 3.37Å; L445-G449 PolarHBondContact O-N 3.01Å; L446-G449 PolarHBondContact O-N 2.97Å; L447-G449 PolarHBondContact O-N 3.32Å; G449-L453 WeakPolarHBondContact O-CG 3.36Å; G449-L453 PolarHBondContact O-N 3.45Å
450G87.6Confident88.6Confident1 Ų124.7 Ų24.71%0.0113%0.128CC..Hα-helixtrans-67.5-43.6174.200000114.8Q258 L446 L447 G448 A452 L453 A454Q258-G450 VanDerWaalsContact NE2-C 3.3Å; Q258-G450 PolarHBondContact NE2-O 3.15Å; L446-G450 PolarHBondContact O-N 3.07Å; L447-G450 PolarHBondContact O-N 3.4Å; L447-G450 VanDerWaalsContact O-N 3.14Å; G448-G450 VanDerWaalsContact C-N 3.26Å; G448-G450 PolarHBondContact O-N 2.97Å; G450-A452 VanDerWaalsContact C-N 3.31Å; G450-L453 PolarHBondContact O-N 2.83Å; G450-A454 PolarHBondContact O-N 3.41Å
451F89.1Confident88.5Confident1 Ų124.1 Ų24.10%0.00413%0.128CC..Hα-helixtrans-65.9-37.7174.7-57.3-34.9000111.3E81 K84 N87 G257 Q258 L447 G448 A454 A455E81-F451 HydrophobicContact CB-CB 4.17Å; E81-F451 WeakPolarHBondContact O-CD2 3.32Å; K84-F451 HydrophobicContact CB-CD2 4.29Å; K84-F451 HydrophobicContact CB-CE2 4.38Å; K84-F451 HydrophobicContact CG-CD2 4.14Å; N87-F451 WeakPolarHBondContact OD1-CE2 3.35Å; G257-F451 VanDerWaalsContact C-CE1 3.47Å; Q258-F451 HydrophobicContact CG-CD1 4.32Å; Q258-F451 HydrophobicContact CG-CE1 4.22Å; L447-F451 HydrophobicContact CB-CE2 4.09Å; L447-F451 HydrophobicContact CB-CZ 4.37Å; L447-F451 HydrophobicContact CD2-CZ 4.14Å; L447-F451 VanDerWaalsContact O-CD2 3.28Å; L447-F451 WeakPolarHBondContact O-CD2 3.44Å; L447-F451 WeakPolarHBondContact O-CG 3.41Å; L447-F451 PolarHBondContact O-N 2.94Å; G448-F451 PolarHBondContact O-N 3.4Å; F451-A454 PolarHBondContact O-N 3.49Å; F451-A455 WeakPolarHBondContact O-CB 3.33Å; F451-A455 PolarHBondContact O-N 3.39Å
452A91.9Very high88.2Confident0 Ų020.3 Ų20.30%012%0.115CC..Hα-helixtrans-58.5-51.5171.100000110.8P63 F67 V78 E81 Y82 G448 G450 A454 A455 G456P63-A452 HydrophobicContact CB-CB 3.75Å; P63-A452 HydrophobicContact CG-CB 4.2Å; F67-A452 HydrophobicContact CE2-CB 4.37Å; F67-A452 VanDerWaalsContact CE2-O 3.31Å; F67-A452 WeakPolarHBondContact CE2-O 3.38Å; V78-A452 HydrophobicContact CG1-CB 4.23Å; E81-A452 HydrophobicContact CB-CB 4.16Å; Y82-A452 HydrophobicContact CE2-CB 4.17Å; G448-A452 WeakPolarHBondContact O-CB 3.46Å; G448-A452 PolarHBondContact O-N 2.61Å; G450-A452 VanDerWaalsContact C-N 3.31Å; A452-A454 VanDerWaalsContact C-N 3.28Å; A452-A454 PolarHBondContact O-N 3.24Å; A452-A455 WeakPolarHBondContact O-CB 3.41Å; A452-A455 PolarHBondContact O-N 2.88Å; A452-A455 VanDerWaalsContact O-N 3.13Å; A452-G456 PolarHBondContact O-N 2.93Å
453L90.1Very high87.8Confident4 Ų416.8 Ų16.82%0.02110%0.096CC..Hα-helixtrans-54.6-43.2177.8-77.7-175.8000113V41 I42 M45 W49 P63 F67 G449 G450 G456 S457V41-L453 HydrophobicContact CG1-CD2 4.22Å; I42-L453 HydrophobicContact CG1-CD2 3.72Å; M45-L453 HydrophobicContact CE-CD1 3.72Å; M45-L453 HydrophobicContact CE-CD2 4.33Å; M45-L453 HydrophobicContact CE-CG 3.97Å; M45-L453 HydrophobicContact SD-CD1 3.85Å; M45-L453 HydrophobicContact SD-CD2 3.49Å; M45-L453 WeakPolarHBondContact SD-CD2 3.28Å; M45-L453 HydrophobicContact SD-CG 3.8Å; W49-L453 HydrophobicContact CH2-CD1 3.81Å; W49-L453 HydrophobicContact CZ3-CD1 3.82Å; P63-L453 HydrophobicContact CG-CD2 4.23Å; P63-L453 HydrophobicContact CG-CG 4.42Å; F67-L453 HydrophobicContact CE1-CD2 4.44Å; F67-L453 HydrophobicContact CZ-CD2 3.83Å; G449-L453 WeakPolarHBondContact O-CG 3.36Å; G449-L453 PolarHBondContact O-N 3.45Å; G450-L453 PolarHBondContact O-N 2.83Å; L453-G456 PolarHBondContact O-N 2.9Å; L453-S457 WeakPolarHBondContact O-CB 3.39Å; L453-S457 PolarHBondContact O-N 2.84Å; L453-S457 PolarHBondContact O-OG 3.25Å
454A85.8Confident87.6Confident0 Ų022.6 Ų22.60%012%0.12CC..Hα-helixtrans-63.8-46.5177.200000112.1L262 G450 F451 A452 G456 S457 E458 P507L262-A454 HydrophobicContact CD1-CB 4.47Å; L262-A454 HydrophobicContact CD2-CB 4.04Å; L262-A454 HydrophobicContact CG-CB 4.33Å; G450-A454 PolarHBondContact O-N 3.41Å; F451-A454 PolarHBondContact O-N 3.49Å; A452-A454 VanDerWaalsContact C-N 3.28Å; A452-A454 PolarHBondContact O-N 3.24Å; A454-G456 PolarHBondContact O-N 3.45Å; A454-S457 PolarHBondContact O-N 2.84Å; A454-E458 PolarHBondContact O-N 2.93Å; A454-E458 VanDerWaalsContact O-N 3.13Å; A454-P507 HydrophobicContact CB-CB 4.18Å; A454-P507 HydrophobicContact CB-CG 3.98Å
455A87.9Confident87.3Confident4 Ų428.9 Ų28.93%0.03314%0.143CC..Hα-helixtrans-59.8-45.6175.600000111.9M73 E81 K261 F451 A452 S457 E458 V459M73-A455 HydrophobicContact CE-CB 3.77Å; M73-A455 HydrophobicContact SD-CB 3.89Å; E81-A455 HydrophobicContact CG-CB 4.12Å; K261-A455 VanDerWaalsContact CE-CB 3.43Å; F451-A455 WeakPolarHBondContact O-CB 3.33Å; F451-A455 PolarHBondContact O-N 3.39Å; A452-A455 WeakPolarHBondContact O-CB 3.41Å; A452-A455 PolarHBondContact O-N 2.88Å; A452-A455 VanDerWaalsContact O-N 3.13Å; A455-S457 VanDerWaalsContact C-N 3.32Å; A455-S457 PolarHBondContact O-N 3.43Å; A455-E458 PolarHBondContact O-N 3.15Å; A455-V459 VanDerWaalsContact O-CG2 3.31Å; A455-V459 WeakPolarHBondContact O-CG2 3.31Å; A455-V459 PolarHBondContact O-N 2.77Å
456G89Confident86.6Confident0 Ų027.9 Ų27.90%014%0.138CC..Hα-helixtrans-65.4-35.3178.600000112.5C38 A452 L453 A454 S460C38-G456 PolarHBondContact SG-O 3.49Å; A452-G456 PolarHBondContact O-N 2.93Å; L453-G456 PolarHBondContact O-N 2.9Å; A454-G456 PolarHBondContact O-N 3.45Å; G456-S460 WeakPolarHBondContact O-CB 3.16Å; G456-S460 PolarHBondContact O-N 2.87Å; G456-S460 PolarHBondContact O-OG 3.43Å
457S87.1Confident85.9Confident6 Ų627.7 Ų27.74%0.04214%0.137CC..Hα-helixtrans-67-38177.3-57.70000112.1I42 L453 A454 A455 S460 G461 L462 S463I42-S457 WeakPolarHBondContact CD1-OG 3.31Å; L453-S457 WeakPolarHBondContact O-CB 3.39Å; L453-S457 PolarHBondContact O-N 2.84Å; L453-S457 PolarHBondContact O-OG 3.25Å; A454-S457 PolarHBondContact O-N 2.84Å; A455-S457 VanDerWaalsContact C-N 3.32Å; A455-S457 PolarHBondContact O-N 3.43Å; S457-S460 PolarHBondContact O-OG 2.96Å; S457-G461 PolarHBondContact O-N 2.87Å; S457-L462 PolarHBondContact O-N 3.44Å; S457-S463 WeakPolarHBondContact CB-OG 3.32Å; S457-S463 PolarHBondContact O-N 3.39Å; S457-S463 PolarHBondContact O-OG 3Å
458E84.6Confident85.5Confident88 Ų8832.5 Ų32.541%0.41116%0.163SC..Hα-helixtrans-71.9-50.7176.9-171.764.2-166.500111.2A454 A455 S460 G461A454-E458 PolarHBondContact O-N 2.93Å; A454-E458 VanDerWaalsContact O-N 3.13Å; A455-E458 PolarHBondContact O-N 3.15Å; E458-S460 VanDerWaalsContact C-N 3.31Å; E458-S460 PolarHBondContact O-N 3.3Å; E458-G461 PolarHBondContact O-N 2.61Å; E458-G461 VanDerWaalsContact O-N 3.11Å
459V88.4Confident85.1Confident87 Ų8735.5 Ų35.553%0.52718%0.184SC..Hα-helixtrans-62.5-38.3-178.1173.50000111.7I72 A455 G461I72-V459 WeakPolarHBondContact O-CG1 3.18Å; A455-V459 VanDerWaalsContact O-CG2 3.31Å; A455-V459 WeakPolarHBondContact O-CG2 3.31Å; A455-V459 PolarHBondContact O-N 2.77Å; V459-G461 VanDerWaalsContact C-N 3.26Å; V459-G461 PolarHBondContact O-N 3.47Å
460S88.5Confident84.4Confident4 Ų437.9 Ų37.93%0.02820%0.196CC..THydrogen-bonded Turntrans-76.1-8.8178.962.60000114.5E35 C38 G456 S457 E458 L462E35-S460 VanDerWaalsContact CD-O 3.29Å; E35-S460 VanDerWaalsContact CG-O 3.24Å; E35-S460 WeakPolarHBondContact CG-O 3.37Å; E35-S460 PolarHBondContact N-O 2.99Å; C38-S460 WeakPolarHBondContact CB-OG 3.4Å; G456-S460 WeakPolarHBondContact O-CB 3.16Å; G456-S460 PolarHBondContact O-N 2.87Å; G456-S460 PolarHBondContact O-OG 3.43Å; S457-S460 PolarHBondContact O-OG 2.96Å; E458-S460 VanDerWaalsContact C-N 3.31Å; E458-S460 PolarHBondContact O-N 3.3Å; S460-L462 PolarHBondContact O-N 2.87Å; S460-L462 WeakPolarHBondContact OG-CB 3.48Å; S460-L462 PolarHBondContact OG-N 3.4Å
461G85.2Confident83.6Confident23 Ų2339.7 Ų39.724%0.23721%0.211CC..THydrogen-bonded Turntrans760.3-172.500000114.8S457 E458 V459 S463 K464 W465S457-G461 PolarHBondContact O-N 2.87Å; E458-G461 PolarHBondContact O-N 2.61Å; E458-G461 VanDerWaalsContact O-N 3.11Å; V459-G461 VanDerWaalsContact C-N 3.26Å; V459-G461 PolarHBondContact O-N 3.47Å; G461-S463 PolarHBondContact O-N 2.9Å; G461-K464 WeakPolarHBondContact O-CB 3.37Å; G461-K464 PolarHBondContact O-N 3.38Å; G461-W465 PolarHBondContact O-N 2.8Å; G461-W465 VanDerWaalsContact O-N 3.12Å
462L84.6Confident83.2Confident13 Ų1344.2 Ų44.27%0.06824%0.241CC..Hα-helixtrans-60-38.1-179.2178.263.4000111.6E35 C38 I42 S457 S460 K464 W465 L466E35-L462 HydrophobicContact CB-CB 4.32Å; E35-L462 HydrophobicContact CB-CD1 4.25Å; E35-L462 HydrophobicContact CG-CB 4.5Å; C38-L462 HydrophobicContact CB-CB 4.45Å; C38-L462 HydrophobicContact CB-CD2 4.08Å; I42-L462 HydrophobicContact CD1-CD2 3.49Å; I42-L462 VanDerWaalsContact CD1-CD2 3.49Å; S457-L462 PolarHBondContact O-N 3.44Å; S460-L462 PolarHBondContact O-N 2.87Å; S460-L462 WeakPolarHBondContact OG-CB 3.48Å; S460-L462 PolarHBondContact OG-N 3.4Å; L462-K464 VanDerWaalsContact C-N 3.31Å; L462-K464 PolarHBondContact O-N 3.31Å; L462-W465 HydrophobicContact CD1-CE3 4.06Å; L462-W465 PolarHBondContact O-N 3.11Å; L462-L466 HydrophobicContact CD1-CD1 4.38Å; L462-L466 HydrophobicContact CD1-CG 4.33Å; L462-L466 HydrophobicContact CG-CD1 4.07Å; L462-L466 HydrophobicContact CG-CG 4.47Å; L462-L466 WeakPolarHBondContact O-CB 3.44Å; L462-L466 PolarHBondContact O-N 3.36Å
463S81.4Confident82.3Confident4 Ų446.5 Ų46.53%0.02825%0.252CS..Hα-helixtrans-54.6-46.1174.5-79.40000112S457 G461 G467 S511S457-S463 WeakPolarHBondContact CB-OG 3.32Å; S457-S463 PolarHBondContact O-N 3.39Å; S457-S463 PolarHBondContact O-OG 3Å; G461-S463 PolarHBondContact O-N 2.9Å; S463-G467 PolarHBondContact O-N 2.9Å; S463-S511 WeakPolarHBondContact CB-OG 3.39Å; S463-S511 VanDerWaalsContact O-CB 3.28Å; S463-S511 WeakPolarHBondContact O-CB 3.48Å; S463-S511 PolarHBondContact OG-OG 3.32Å
464K78.9Confident81.7Confident156 Ų15651.8 Ų51.868%0.67828%0.277SS*.Hα-helixtrans-66.3-45.5177.9-173.1176.9-180178.80111.7G461 L462 L466 G467 D468G461-K464 WeakPolarHBondContact O-CB 3.37Å; G461-K464 PolarHBondContact O-N 3.38Å; L462-K464 VanDerWaalsContact C-N 3.31Å; L462-K464 PolarHBondContact O-N 3.31Å; K464-L466 PolarHBondContact O-N 3.28Å; K464-G467 PolarHBondContact O-N 3.44Å; K464-G467 VanDerWaalsContact O-N 3.15Å; K464-D468 PolarHBondContact O-N 3.16Å
465W83.2Confident81.4Confident147 Ų14761.1 Ų61.156%0.55732%0.318SS*.Hα-helixtrans-61.1-42.2178.8179.688000113E35 G461 L462 G467 D468 S469E35-W465 HydrophobicContact CG-CB 4.39Å; G461-W465 PolarHBondContact O-N 2.8Å; G461-W465 VanDerWaalsContact O-N 3.12Å; L462-W465 HydrophobicContact CD1-CE3 4.06Å; L462-W465 PolarHBondContact O-N 3.11Å; W465-G467 VanDerWaalsContact C-N 3.34Å; W465-D468 PolarHBondContact O-N 2.89Å; W465-S469 WeakPolarHBondContact O-CB 3.49Å; W465-S469 PolarHBondContact O-N 3.06Å; W465-S469 VanDerWaalsContact O-N 3.08Å; W465-S469 PolarHBondContact O-OG 3.38Å
466L79.3Confident81.3Confident42 Ų4264.1 Ų64.122%0.2233%0.332CS..Hα-helixtrans-63.5-42.3173.9-81.9169.4000111.2L462 K464 S469 L470 I508L462-L466 HydrophobicContact CD1-CD1 4.38Å; L462-L466 HydrophobicContact CD1-CG 4.33Å; L462-L466 HydrophobicContact CG-CD1 4.07Å; L462-L466 HydrophobicContact CG-CG 4.47Å; L462-L466 WeakPolarHBondContact O-CB 3.44Å; L462-L466 PolarHBondContact O-N 3.36Å; K464-L466 PolarHBondContact O-N 3.28Å; L466-S469 PolarHBondContact O-N 3.45Å; L466-L470 VanDerWaalsContact O-CG 3.27Å; L466-L470 WeakPolarHBondContact O-CG 3.27Å; L466-L470 PolarHBondContact O-N 3.27Å; L466-L470 VanDerWaalsContact O-N 3.15Å; L466-I508 HydrophobicContact CD1-CG1 4.32Å; L466-I508 HydrophobicContact CD1-CG2 4.5Å
467G74.1Confident81.2Confident1 Ų167.1 Ų67.11%0.0135%0.352CS..Hα-helixtrans-57.9-49.8175.700000112.7S463 K464 W465 S469 L470 A471 A515S463-G467 PolarHBondContact O-N 2.9Å; K464-G467 PolarHBondContact O-N 3.44Å; K464-G467 VanDerWaalsContact O-N 3.15Å; W465-G467 VanDerWaalsContact C-N 3.34Å; G467-S469 VanDerWaalsContact C-N 3.3Å; G467-S469 PolarHBondContact O-N 2.71Å; G467-L470 CarbonylContact O-C 3.26Å; G467-L470 PolarHBondContact O-N 2.98Å; G467-A471 PolarHBondContact O-N 3.46Å; G467-A515 VanDerWaalsContact C-CB 3.43Å; G467-A515 WeakPolarHBondContact O-CB 3.4Å
468D77.7Confident81.2Confident102 Ų10269.6 Ų69.655%0.54537%0.368SS..Hα-helixtrans-62.1-39178.8-69.7-21.6000111.8K464 W465 L470 A471K464-D468 PolarHBondContact O-N 3.16Å; W465-D468 PolarHBondContact O-N 2.89Å; D468-L470 PolarHBondContact O-N 2.79Å; D468-A471 VanDerWaalsContact O-CB 3.23Å; D468-A471 WeakPolarHBondContact O-CB 3.11Å; D468-A471 PolarHBondContact O-N 3.5Å
469S81.4Confident81.4Confident62 Ų6270.4 Ų70.443%0.43437%0.37SS..Hα-helixtrans-64.9-25176.4-60.20000112.9W465 L466 G467W465-S469 WeakPolarHBondContact O-CB 3.49Å; W465-S469 PolarHBondContact O-N 3.06Å; W465-S469 VanDerWaalsContact O-N 3.08Å; W465-S469 PolarHBondContact O-OG 3.38Å; L466-S469 PolarHBondContact O-N 3.45Å; G467-S469 VanDerWaalsContact C-N 3.3Å; G467-S469 PolarHBondContact O-N 2.71Å
470L75.7Confident81.5Confident50 Ų5067.7 Ų67.726%0.26236%0.357SS..THydrogen-bonded Turntrans-96.70.3-179.9-67.3172000113.1L466 G467 D468 P472 L473 M512L466-L470 VanDerWaalsContact O-CG 3.27Å; L466-L470 WeakPolarHBondContact O-CG 3.27Å; L466-L470 PolarHBondContact O-N 3.27Å; L466-L470 VanDerWaalsContact O-N 3.15Å; G467-L470 CarbonylContact O-C 3.26Å; G467-L470 PolarHBondContact O-N 2.98Å; D468-L470 PolarHBondContact O-N 2.79Å; L470-P472 VanDerWaalsContact C-N 3.28Å; L470-P472 VanDerWaalsContact O-N 3.14Å; L470-L473 HydrophobicContact CB-CD1 4.12Å; L470-L473 HydrophobicContact CD2-CD1 3.74Å; L470-L473 HydrophobicContact CG-CD1 4.45Å; L470-L473 VanDerWaalsContact O-CB 3.3Å; L470-L473 WeakPolarHBondContact O-CB 3.45Å; L470-L473 PolarHBondContact O-N 2.95Å; L470-M512 HydrophobicContact CB-CG 4.06Å; L470-M512 HydrophobicContact CD1-CB 3.75Å; L470-M512 HydrophobicContact CD1-CG 3.65Å; L470-M512 HydrophobicContact CD1-SD 4.13Å; L470-M512 HydrophobicContact CG-CG 4.46Å
471A72.6Confident81.5Confident39 Ų3968 Ų6832%0.32236%0.358SS..G310 helixtrans-50.6-34.4176.900000115.2G467 D468 L473 Q474G467-A471 PolarHBondContact O-N 3.46Å; D468-A471 VanDerWaalsContact O-CB 3.23Å; D468-A471 WeakPolarHBondContact O-CB 3.11Å; D468-A471 PolarHBondContact O-N 3.5Å; A471-L473 PolarHBondContact O-N 3.23Å; A471-L473 VanDerWaalsContact O-N 3.08Å; A471-Q474 WeakPolarHBondContact O-CB 3.5Å; A471-Q474 WeakPolarHBondContact O-CG 3.03Å; A471-Q474 PolarHBondContact O-N 3.34Å; A471-Q474 VanDerWaalsContact O-N 3.09Å
472P79.4Confident81.8Confident97 Ų9766.9 Ų66.963%0.6335%0.347SS*.G310 helixtrans-58.9-21.2175.6-26.236.3000114.9L470 Q474L470-P472 VanDerWaalsContact C-N 3.28Å; L470-P472 VanDerWaalsContact O-N 3.14Å; P472-Q474 PolarHBondContact O-N 3.4Å
473L74.1Confident82.3Confident47 Ų4769.2 Ų69.225%0.24636%0.358CS..G310 helixtrans-70.4-14.3177.2-71164.2000113.4L470 A471 K475 I476 M512L470-L473 HydrophobicContact CB-CD1 4.12Å; L470-L473 HydrophobicContact CD2-CD1 3.74Å; L470-L473 HydrophobicContact CG-CD1 4.45Å; L470-L473 VanDerWaalsContact O-CB 3.3Å; L470-L473 WeakPolarHBondContact O-CB 3.45Å; L470-L473 PolarHBondContact O-N 2.95Å; A471-L473 PolarHBondContact O-N 3.23Å; A471-L473 VanDerWaalsContact O-N 3.08Å; L473-K475 PolarHBondContact O-N 3.32Å; L473-I476 HydrophobicContact CD2-CD1 3.68Å; L473-I476 PolarHBondContact O-N 3.13Å; L473-M512 HydrophobicContact CD1-SD 4.18Å
474Q76.9Confident82.8Confident115 Ų11573.9 Ų73.954%0.53738%0.383SS..G310 helixtrans-56.1-21.2176.3-75.9-179.2-100113.6A471 P472 I476 A515 I516A471-Q474 WeakPolarHBondContact O-CB 3.5Å; A471-Q474 WeakPolarHBondContact O-CG 3.03Å; A471-Q474 PolarHBondContact O-N 3.34Å; A471-Q474 VanDerWaalsContact O-N 3.09Å; P472-Q474 PolarHBondContact O-N 3.4Å; Q474-I476 VanDerWaalsContact C-N 3.31Å; Q474-I476 PolarHBondContact O-N 3.36Å; Q474-A515 PolarHBondContact NE2-O 3.41Å; Q474-I516 HydrophobicContact CG-CB 3.7Å; Q474-I516 HydrophobicContact CG-CG2 3.83Å
475K80.2Confident83.4Confident197 Ų19767.4 Ų67.486%0.85736%0.355SS*.G310 helixtrans-78.6-11.9179.1-65.9-179.5-177.8178.70113.9L473L473-K475 PolarHBondContact O-N 3.32Å
476I84.4Confident84Confident66 Ų6660.4 Ų60.434%0.33833%0.329SS..SBendtrans-92.9136.6-177.2-57.1-176000108.8L473 Q474 A480 I481L473-I476 HydrophobicContact CD2-CD1 3.68Å; L473-I476 PolarHBondContact O-N 3.13Å; Q474-I476 VanDerWaalsContact C-N 3.31Å; Q474-I476 PolarHBondContact O-N 3.36Å; I476-A480 HydrophobicContact CG2-CB 3.82Å; I476-I481 HydrophobicContact CB-CD1 4.17Å; I476-I481 HydrophobicContact CB-CG1 3.89Å; I476-I481 HydrophobicContact CG2-CD1 4.47Å; I476-I481 HydrophobicContact CG2-CG1 3.7Å
477P88.1Confident84.7Confident63 Ų6362.8 Ų62.841%0.40934%0.341SS..  trans-62140.917725.6-34.3000111.1F479 A480 I481P477-F479 VanDerWaalsContact C-N 3.29Å; P477-F479 HydrophobicContact CB-CD1 3.78Å; P477-F479 HydrophobicContact CB-CE1 3.56Å; P477-F479 HydrophobicContact CG-CD1 4.17Å; P477-F479 HydrophobicContact CG-CE1 3.58Å; P477-F479 HydrophobicContact CG-CZ 4.07Å; P477-F479 PolarHBondContact O-N 3.4Å; P477-F479 VanDerWaalsContact O-N 3.15Å; P477-A480 HydrophobicContact CG-CB 3.95Å; P477-A480 WeakPolarHBondContact O-CB 3.5Å; P477-A480 PolarHBondContact O-N 2.9Å; P477-I481 PolarHBondContact O-N 2.74Å
478P85.6Confident85.6Confident58 Ų5866.5 Ų66.538%0.37736%0.361SS..Hα-helixtrans-52.7-41.8-173.6-30.435.4000114.3A480 I481 S482 V518 Y522P478-A480 VanDerWaalsContact C-N 3.25Å; P478-A480 PolarHBondContact O-N 2.99Å; P478-I481 WeakPolarHBondContact O-CB 3.28Å; P478-I481 PolarHBondContact O-N 3.08Å; P478-I481 VanDerWaalsContact O-N 3.1Å; P478-S482 PolarHBondContact O-N 3.27Å; P478-V518 HydrophobicContact CG-CG2 4.38Å; P478-Y522 VanDerWaalsContact C-CE1 3.41Å; P478-Y522 HydrophobicContact CB-CD1 4.08Å; P478-Y522 HydrophobicContact CB-CE1 3.54Å; P478-Y522 WeakPolarHBondContact O-CE1 3.21Å
479F89.1Confident86.4Confident106 Ų10661.8 Ų61.847%0.46534%0.336SS..Hα-helixtrans-60.1-35.9-179.780.2-92.4000112.5P477 S482 I483 Y522P477-F479 VanDerWaalsContact C-N 3.29Å; P477-F479 HydrophobicContact CB-CD1 3.78Å; P477-F479 HydrophobicContact CB-CE1 3.56Å; P477-F479 HydrophobicContact CG-CD1 4.17Å; P477-F479 HydrophobicContact CG-CE1 3.58Å; P477-F479 HydrophobicContact CG-CZ 4.07Å; P477-F479 PolarHBondContact O-N 3.4Å; P477-F479 VanDerWaalsContact O-N 3.15Å; F479-S482 PolarHBondContact O-N 3.46Å; F479-I483 HydrophobicContact CD2-CD1 4.22Å; F479-I483 WeakPolarHBondContact O-CG1 3.12Å; F479-I483 PolarHBondContact O-N 3.48Å; F479-I483 VanDerWaalsContact O-N 3.09Å; F479-Y522 VanDerWaalsContact CA-OH 3.23Å; F479-Y522 WeakPolarHBondContact CA-OH 3.41Å; F479-Y522 WeakPolarHBondContact CB-OH 3.39Å; F479-Y522 PolarHBondContact N-OH 3.27Å
480A90.4Very high87Confident30 Ų3058.9 Ų58.925%0.24832%0.315CS..Hα-helixtrans-73.2-34.7179.100000111.2I476 P477 P478 I483 L484I476-A480 HydrophobicContact CG2-CB 3.82Å; P477-A480 HydrophobicContact CG-CB 3.95Å; P477-A480 WeakPolarHBondContact O-CB 3.5Å; P477-A480 PolarHBondContact O-N 2.9Å; P478-A480 VanDerWaalsContact C-N 3.25Å; P478-A480 PolarHBondContact O-N 2.99Å; A480-I483 PolarHBondContact O-N 3.03Å; A480-L484 WeakPolarHBondContact O-CB 3.25Å; A480-L484 PolarHBondContact O-N 3.43Å
481I89.6Confident87.8Confident9 Ų960.2 Ų60.25%0.04633%0.326CS..Hα-helixtrans-61.1-47.6171.8-61.3176.6000109.8I476 P477 P478 I483 L484 L485 M512 I516 V523I476-I481 HydrophobicContact CB-CD1 4.17Å; I476-I481 HydrophobicContact CB-CG1 3.89Å; I476-I481 HydrophobicContact CG2-CD1 4.47Å; I476-I481 HydrophobicContact CG2-CG1 3.7Å; P477-I481 PolarHBondContact O-N 2.74Å; P478-I481 WeakPolarHBondContact O-CB 3.28Å; P478-I481 PolarHBondContact O-N 3.08Å; P478-I481 VanDerWaalsContact O-N 3.1Å; I481-I483 PolarHBondContact O-N 3.33Å; I481-L484 PolarHBondContact O-N 3.32Å; I481-L485 HydrophobicContact CG2-CD1 3.46Å; I481-L485 VanDerWaalsContact CG2-CD1 3.46Å; I481-L485 HydrophobicContact CG2-CG 4.16Å; I481-L485 WeakPolarHBondContact O-CB 3.48Å; I481-L485 VanDerWaalsContact O-CG 3.23Å; I481-L485 WeakPolarHBondContact O-CG 3.48Å; I481-L485 PolarHBondContact O-N 3.4Å; I481-M512 HydrophobicContact CG2-CE 4.22Å; I481-I516 HydrophobicContact CD1-CD1 3.96Å; I481-V523 HydrophobicContact CG2-CG1 4.14Å
482S91.7Very high88.7Confident0 Ų060.9 Ų60.90%032%0.321CS..Hα-helixtrans-56.5-47.5176.4166.20000112.4P478 F479 S486 N574P478-S482 PolarHBondContact O-N 3.27Å; F479-S482 PolarHBondContact O-N 3.46Å; S482-S486 WeakPolarHBondContact O-CB 3.13Å; S482-S486 PolarHBondContact O-N 2.94Å; S482-S486 PolarHBondContact O-OG 3.18Å; S482-N574 WeakPolarHBondContact CB-OD1 3.35Å; S482-N574 PolarHBondContact OG-OD1 2.94Å
483I93.5Very high89.4Confident62 Ų6256.2 Ų56.232%0.31829%0.291SS..Hα-helixtrans-61.3-49.3177.3-68.6170.7000111.1F479 A480 I481 L485 S486 L487 I570 N574F479-I483 HydrophobicContact CD2-CD1 4.22Å; F479-I483 WeakPolarHBondContact O-CG1 3.12Å; F479-I483 PolarHBondContact O-N 3.48Å; F479-I483 VanDerWaalsContact O-N 3.09Å; A480-I483 PolarHBondContact O-N 3.03Å; I481-I483 PolarHBondContact O-N 3.33Å; I483-L485 PolarHBondContact O-N 3.17Å; I483-S486 PolarHBondContact O-N 2.84Å; I483-L487 WeakPolarHBondContact O-CB 3.29Å; I483-L487 PolarHBondContact O-N 2.86Å; I483-I570 HydrophobicContact CG2-CG2 4.41Å; I483-N574 HydrophobicContact CG1-CB 4.24Å; I483-N574 WeakPolarHBondContact CG1-ND2 3.33Å; I483-N574 WeakPolarHBondContact CG1-OD1 3.29Å
484L92.4Very high90.2Very high102 Ų10254.6 Ų54.653%0.53428%0.282SS..Hα-helixtrans-61.9-45.6-176-177.4147.1000111.5A480 I481 L487 L488A480-L484 WeakPolarHBondContact O-CB 3.25Å; A480-L484 PolarHBondContact O-N 3.43Å; I481-L484 PolarHBondContact O-N 3.32Å; L484-L487 PolarHBondContact O-N 3.46Å; L484-L488 WeakPolarHBondContact O-CB 3.44Å; L484-L488 PolarHBondContact O-N 3.05Å
485L92.5Very high90.6Very high21 Ų2153.4 Ų53.411%0.1129%0.286CS..Hα-helixtrans-70.1-39179.2-64.1171000111.9I481 I483 L487 L488 V489 L509 M512 V523 C527I481-L485 HydrophobicContact CG2-CD1 3.46Å; I481-L485 VanDerWaalsContact CG2-CD1 3.46Å; I481-L485 HydrophobicContact CG2-CG 4.16Å; I481-L485 WeakPolarHBondContact O-CB 3.48Å; I481-L485 VanDerWaalsContact O-CG 3.23Å; I481-L485 WeakPolarHBondContact O-CG 3.48Å; I481-L485 PolarHBondContact O-N 3.4Å; I483-L485 PolarHBondContact O-N 3.17Å; L485-L487 VanDerWaalsContact C-N 3.3Å; L485-L487 PolarHBondContact O-N 3.38Å; L485-L488 PolarHBondContact O-N 3.31Å; L485-V489 WeakPolarHBondContact O-CB 3.4Å; L485-V489 WeakPolarHBondContact O-CG2 3.34Å; L485-V489 PolarHBondContact O-N 3.31Å; L485-L509 HydrophobicContact CD1-CD2 3.74Å; L485-L509 HydrophobicContact CD2-CD2 4Å; L485-L509 HydrophobicContact CG-CD2 4.33Å; L485-M512 HydrophobicContact CD1-CE 3.47Å; L485-M512 VanDerWaalsContact CD1-CE 3.47Å; L485-M512 HydrophobicContact CD1-SD 4.27Å; L485-V523 HydrophobicContact CD1-CB 4.26Å; L485-V523 HydrophobicContact CD1-CG1 4.1Å; L485-C527 VanDerWaalsContact CB-SG 3.59Å
486S95.3Very high91Very high0 Ų044.2 Ų44.20%025%0.246CC..Hα-helixtrans-62.7-39.3175.1-60.30000111.4S482 I483 V489 A490S482-S486 WeakPolarHBondContact O-CB 3.13Å; S482-S486 PolarHBondContact O-N 2.94Å; S482-S486 PolarHBondContact O-OG 3.18Å; I483-S486 PolarHBondContact O-N 2.84Å; S486-V489 PolarHBondContact O-N 3.48Å; S486-A490 WeakPolarHBondContact O-CB 3.41Å; S486-A490 PolarHBondContact O-N 3.26Å
487L94.3Very high91.2Very high91 Ų9142.4 Ų42.448%0.47624%0.239SC..Hα-helixtrans-65.8-44.2175-176.466.6000111.9I483 L484 L485 A490 T491 I570I483-L487 WeakPolarHBondContact O-CB 3.29Å; I483-L487 PolarHBondContact O-N 2.86Å; L484-L487 PolarHBondContact O-N 3.46Å; L485-L487 VanDerWaalsContact C-N 3.3Å; L485-L487 PolarHBondContact O-N 3.38Å; L487-A490 PolarHBondContact O-N 2.76Å; L487-T491 HydrophobicContact CD1-CG2 4.35Å; L487-T491 WeakPolarHBondContact O-CB 3.4Å; L487-T491 VanDerWaalsContact O-CG2 3.31Å; L487-T491 WeakPolarHBondContact O-CG2 3.48Å; L487-T491 PolarHBondContact O-N 3.35Å; L487-T491 PolarHBondContact O-OG1 2.91Å; L487-I570 HydrophobicContact CB-CD1 4.19Å; L487-I570 HydrophobicContact CD1-CD1 3.83Å
488L93.1Very high91.3Very high80 Ų8040.1 Ų40.142%0.41922%0.224SC..Hα-helixtrans-58.4-47174.8-176.9117.5000111.5L484 L485 T491 F492 F505L484-L488 WeakPolarHBondContact O-CB 3.44Å; L484-L488 PolarHBondContact O-N 3.05Å; L485-L488 PolarHBondContact O-N 3.31Å; L488-T491 PolarHBondContact O-OG1 3.31Å; L488-F492 VanDerWaalsContact O-CB 3.32Å; L488-F492 WeakPolarHBondContact O-CB 3.3Å; L488-F492 PolarHBondContact O-N 2.71Å; L488-F505 HydrophobicContact CD2-CD1 4.15Å; L488-F505 HydrophobicContact CD2-CE1 3.44Å; L488-F505 VanDerWaalsContact CD2-CE1 3.44Å; L488-F505 HydrophobicContact CD2-CZ 3.78Å
489V94.8Very high91.4Very high3 Ų338 Ų382%0.01821%0.209CC..Hα-helixtrans-68.5-43179.1172.40000111.7L485 S486 T491 F492 T493 T501 F505 C527 A530 A531L485-V489 WeakPolarHBondContact O-CB 3.4Å; L485-V489 WeakPolarHBondContact O-CG2 3.34Å; L485-V489 PolarHBondContact O-N 3.31Å; S486-V489 PolarHBondContact O-N 3.48Å; V489-T491 PolarHBondContact O-N 2.94Å; V489-F492 PolarHBondContact O-N 3.44Å; V489-T493 WeakPolarHBondContact O-CB 3.36Å; V489-T493 PolarHBondContact O-N 3.36Å; V489-T501 HydrophobicContact CG1-CG2 3.9Å; V489-F505 HydrophobicContact CG2-CB 4.27Å; V489-F505 HydrophobicContact CG2-CD1 4.47Å; V489-F505 HydrophobicContact CG2-CD2 4.02Å; V489-F505 HydrophobicContact CG2-CG 4Å; V489-C527 WeakPolarHBondContact CG1-O 3.33Å; V489-C527 HydrophobicContact CG2-CB 4.11Å; V489-A530 HydrophobicContact CB-CB 4.47Å; V489-A530 HydrophobicContact CG1-CB 4.33Å; V489-A531 HydrophobicContact CG1-CB 3.69Å
490A94.1Very high91.3Very high1 Ų133 Ų331%0.00819%0.188CC..Hα-helixtrans-60.2-44.917700000111.6S486 L487 T493 A530 I570S486-A490 WeakPolarHBondContact O-CB 3.41Å; S486-A490 PolarHBondContact O-N 3.26Å; L487-A490 PolarHBondContact O-N 2.76Å; A490-T493 VanDerWaalsContact O-CG2 3.22Å; A490-T493 WeakPolarHBondContact O-CG2 3.28Å; A490-T493 PolarHBondContact O-N 3.14Å; A490-A530 HydrophobicContact CB-CB 4.5Å; A490-I570 HydrophobicContact CB-CD1 4.09Å
491T92.3Very high91.4Very high78 Ų7831.5 Ų31.548%0.47918%0.176SC..Hα-helixtrans-67.5-39.4177.750.80000112.8L487 L488 V489 T493 E494L487-T491 HydrophobicContact CD1-CG2 4.35Å; L487-T491 WeakPolarHBondContact O-CB 3.4Å; L487-T491 VanDerWaalsContact O-CG2 3.31Å; L487-T491 WeakPolarHBondContact O-CG2 3.48Å; L487-T491 PolarHBondContact O-N 3.35Å; L487-T491 PolarHBondContact O-OG1 2.91Å; L488-T491 PolarHBondContact O-OG1 3.31Å; V489-T491 PolarHBondContact O-N 2.94Å; T491-T493 VanDerWaalsContact C-N 3.32Å; T491-T493 PolarHBondContact O-N 2.94Å; T491-E494 PolarHBondContact O-N 3.25Å
492F91.6Very high91.5Very high52 Ų5231.2 Ų31.223%0.22818%0.175CC..Hα-helixtrans-68.2-34177.6-168.6-89.2000112.2C50 L488 V489 E494 C495 S496 T501 L504 F505C50-F492 WeakPolarHBondContact SG-CZ 3.29Å; L488-F492 VanDerWaalsContact O-CB 3.32Å; L488-F492 WeakPolarHBondContact O-CB 3.3Å; L488-F492 PolarHBondContact O-N 2.71Å; V489-F492 PolarHBondContact O-N 3.44Å; F492-E494 PolarHBondContact O-N 3.09Å; F492-C495 PolarHBondContact O-N 2.99Å; F492-C495 PolarHBondContact O-SG 3.39Å; F492-S496 PolarHBondContact O-N 3.15Å; F492-T501 HydrophobicContact CD1-CG2 3.75Å; F492-T501 HydrophobicContact CE1-CG2 4.47Å; F492-L504 HydrophobicContact CE1-CD2 4.19Å; F492-L504 HydrophobicContact CZ-CD2 3.94Å; F492-F505 HydrophobicContact CB-CE2 4.1Å; F492-F505 HydrophobicContact CB-CZ 4.46Å; F492-F505 AromaticContact CD1-CE2 3.64Å; F492-F505 HydrophobicContact CD1-CE2 3.64Å; F492-F505 HydrophobicContact CD1-CZ 4.39Å; F492-F505 HydrophobicContact CD2-CE2 4.28Å; F492-F505 HydrophobicContact CD2-CZ 4.24Å; F492-F505 AromaticContact CE1-CE2 3.95Å; F492-F505 HydrophobicContact CE1-CE2 3.95Å; F492-F505 HydrophobicContact CE2-CZ 4.49Å; F492-F505 AromaticContact CG-CE2 3.76Å; F492-F505 HydrophobicContact CG-CE2 3.76Å; F492-F505 HydrophobicContact CG-CZ 4.13Å; F492-F505 HydrophobicContact CZ-CE2 4.36Å
493T93Very high91.4Very high0 Ų031.3 Ų31.30%018%0.175CC..Hα-helixtrans-72.3-10.3178.9-151.50000114.1V489 A490 T491 C495 S496 N498 A531 A534V489-T493 WeakPolarHBondContact O-CB 3.36Å; V489-T493 PolarHBondContact O-N 3.36Å; A490-T493 VanDerWaalsContact O-CG2 3.22Å; A490-T493 WeakPolarHBondContact O-CG2 3.28Å; A490-T493 PolarHBondContact O-N 3.14Å; T491-T493 VanDerWaalsContact C-N 3.32Å; T491-T493 PolarHBondContact O-N 2.94Å; T493-C495 VanDerWaalsContact C-N 3.29Å; T493-S496 CarbonylContact C-O 3.6Å; T493-N498 WeakPolarHBondContact OG1-CA 3.41Å; T493-N498 PolarHBondContact OG1-OD1 2.86Å; T493-A531 PolarHBondContact OG1-O 2.89Å; T493-A534 HydrophobicContact CG2-CB 3.82Å
494E91.4Very high91Very high12 Ų1229.4 Ų29.46%0.05617%0.165CC..THydrogen-bonded Turntrans-72.9-24.6172.1-66.7-68.9173.600112.3T491 F492 A534 F535 M536 L537 A540 N566T491-E494 PolarHBondContact O-N 3.25Å; F492-E494 PolarHBondContact O-N 3.09Å; E494-A534 WeakPolarHBondContact OE1-CA 3.45Å; E494-F535 PolarHBondContact OE1-N 3.37Å; E494-M536 VanDerWaalsContact CD-N 3.29Å; E494-M536 HydrophobicContact CG-CB 4.3Å; E494-M536 HydrophobicContact CG-CG 4.45Å; E494-M536 HydrophobicContact CG-SD 4.3Å; E494-M536 WeakPolarHBondContact OE1-CG 3.45Å; E494-M536 PolarHBondContact OE1-N 2.81Å; E494-M536 WeakPolarHBondContact OE2-CA 3.22Å; E494-M536 WeakPolarHBondContact OE2-CB 3.34Å; E494-M536 PolarHBondContact OE2-N 2.73Å; E494-L537 HydrophobicContact CB-CD1 4.39Å; E494-L537 PolarHBondContact OE2-N 3.05Å; E494-L537 VanDerWaalsContact OE2-N 3.08Å; E494-A540 WeakPolarHBondContact O-CB 3.25Å; E494-N566 PolarHBondContact OE1-ND2 3.08Å
495C85.6Confident90.9Very high91 Ų9126 Ų2662%0.61515%0.146SC*.THydrogen-bonded Turntrans-112.5-2.1-179.763.40000114.1F492 T493F492-C495 PolarHBondContact O-N 2.99Å; F492-C495 PolarHBondContact O-SG 3.39Å; T493-C495 VanDerWaalsContact C-N 3.29Å
496S88.3Confident90.8Very high4 Ų425 Ų253%0.02814%0.141CC..SBendtrans-137.6149.8-177.5167.10000110.4F492 T493 N498 T501F492-S496 PolarHBondContact O-N 3.15Å; T493-S496 CarbonylContact C-O 3.6Å; S496-N498 PolarHBondContact O-N 3.32Å; S496-T501 PolarHBondContact OG-OG1 3.38Å; S496-T501 VanDerWaalsContact OG-OG1 3.13Å
497S88.3Confident90.4Very high27 Ų2725.3 Ų25.319%0.18914%0.143CC..  trans-56.2133.2174.61740000112T499 A500 T501S497-T499 PolarHBondContact O-N 3.44Å; S497-A500 PolarHBondContact O-N 3.36Å; S497-T501 PolarHBondContact O-N 3.27Å; S497-T501 PolarHBondContact O-OG1 2.88Å; S497-T501 VanDerWaalsContact O-OG1 3.1Å
498N91.1Very high89.9Confident15 Ų1523.2 Ų23.28%0.0813%0.132CC..Hα-helixtrans-46.5-42.2177.5-58.66.6000112.2P251 T493 S496 T501 T502 A531P251-N498 HydrophobicContact CG-CB 3.92Å; T493-N498 WeakPolarHBondContact OG1-CA 3.41Å; T493-N498 PolarHBondContact OG1-OD1 2.86Å; S496-N498 PolarHBondContact O-N 3.32Å; N498-T501 PolarHBondContact O-N 3.09Å; N498-T502 PolarHBondContact O-N 3.29Å; N498-T502 PolarHBondContact O-OG1 3.39Å; N498-A531 WeakPolarHBondContact CB-O 3.39Å; N498-A531 PolarHBondContact ND2-O 3.26Å; N498-A531 PolarHBondContact OD1-O 3.43Å
499T88.1Confident89.7Confident13 Ų1319.8 Ų19.88%0.0811%0.114CC..Hα-helixtrans-69.3-41.8-176.8-52.30000111.6T250 I254 L446 S497 T503T250-T499 WeakPolarHBondContact CB-OG1 3.25Å; T250-T499 HydrophobicContact CG2-CG2 3.5Å; T250-T499 VanDerWaalsContact CG2-CG2 3.5Å; I254-T499 HydrophobicContact CD1-CG2 3.52Å; I254-T499 VanDerWaalsContact CD1-O 3.23Å; I254-T499 WeakPolarHBondContact CD1-O 3.15Å; L446-T499 HydrophobicContact CD1-CG2 3.73Å; L446-T499 HydrophobicContact CD2-CG2 3.44Å; L446-T499 VanDerWaalsContact CD2-CG2 3.44Å; L446-T499 HydrophobicContact CG-CG2 4.1Å; S497-T499 PolarHBondContact O-N 3.44Å; T499-T503 WeakPolarHBondContact O-CB 3.16Å; T499-T503 PolarHBondContact O-N 2.92Å; T499-T503 VanDerWaalsContact O-N 3.1Å; T499-T503 PolarHBondContact O-OG1 2.85Å
500A86.9Confident89.4Confident1 Ų119.7 Ų19.71%0.00811%0.114CC..Hα-helixtrans-67.9-42.8176.900000111.5W49 S497 T503 L504W49-A500 HydrophobicContact CB-CB 3.76Å; W49-A500 HydrophobicContact CD2-CB 4.06Å; W49-A500 HydrophobicContact CE3-CB 4.39Å; W49-A500 HydrophobicContact CG-CB 3.81Å; S497-A500 PolarHBondContact O-N 3.36Å; A500-T503 PolarHBondContact O-N 2.92Å; A500-L504 WeakPolarHBondContact O-CB 3.32Å; A500-L504 PolarHBondContact O-N 2.92Å
501T91.5Very high88.9Confident0 Ų020 Ų200%012%0.116CC..Hα-helixtrans-57-51.9176.9-57.70000111.2V489 F492 S496 S497 N498 T503 L504 F505 A531V489-T501 HydrophobicContact CG1-CG2 3.9Å; F492-T501 HydrophobicContact CD1-CG2 3.75Å; F492-T501 HydrophobicContact CE1-CG2 4.47Å; S496-T501 PolarHBondContact OG-OG1 3.38Å; S496-T501 VanDerWaalsContact OG-OG1 3.13Å; S497-T501 PolarHBondContact O-N 3.27Å; S497-T501 PolarHBondContact O-OG1 2.88Å; S497-T501 VanDerWaalsContact O-OG1 3.1Å; N498-T501 PolarHBondContact O-N 3.09Å; T501-T503 VanDerWaalsContact C-N 3.34Å; T501-T503 PolarHBondContact O-N 3.48Å; T501-L504 PolarHBondContact O-N 2.98Å; T501-F505 HydrophobicContact CG2-CD2 3.74Å; T501-F505 HydrophobicContact CG2-CE2 3.95Å; T501-F505 VanDerWaalsContact O-CD2 3.27Å; T501-F505 WeakPolarHBondContact O-CD2 3.39Å; T501-F505 PolarHBondContact O-N 3.15Å; T501-A531 HydrophobicContact CG2-CB 4.35Å
502T92.9Very high88.6Confident3 Ų316.6 Ų16.62%0.0189%0.094CC..Hα-helixtrans-61.7-42.4178.5-54.30000112P251 I254 N498 L504 F505 L506 T528 A531P251-T502 HydrophobicContact CB-CG2 4.12Å; P251-T502 WeakPolarHBondContact CB-OG1 3.5Å; I254-T502 HydrophobicContact CB-CG2 3.85Å; I254-T502 HydrophobicContact CD1-CG2 4.14Å; I254-T502 HydrophobicContact CG2-CG2 3.85Å; N498-T502 PolarHBondContact O-N 3.29Å; N498-T502 PolarHBondContact O-OG1 3.39Å; T502-L504 VanDerWaalsContact C-N 3.28Å; T502-L504 PolarHBondContact O-N 3.25Å; T502-F505 PolarHBondContact O-N 3.29Å; T502-L506 HydrophobicContact CG2-CD1 3.33Å; T502-L506 HydrophobicContact CG2-CD2 4.49Å; T502-L506 HydrophobicContact CG2-CG 3.62Å; T502-L506 WeakPolarHBondContact O-CB 3.33Å; T502-L506 VanDerWaalsContact O-CG 3.3Å; T502-L506 WeakPolarHBondContact O-CG 3.28Å; T502-L506 PolarHBondContact O-N 3.41Å; T502-T528 HydrophobicContact CG2-CG2 4.42Å; T502-A531 WeakPolarHBondContact OG1-CB 3.28Å
503T88.6Confident88.4Confident1 Ų114.1 Ų14.11%0.0068%0.083CC..Hα-helixtrans-61.8-37.1179.2-60.80000112.6W49 I254 L446 T499 A500 T501 P507W49-T503 HydrophobicContact CH2-CG2 3.39Å; W49-T503 HydrophobicContact CZ2-CG2 4.35Å; W49-T503 HydrophobicContact CZ3-CG2 3.73Å; I254-T503 VanDerWaalsContact CD1-OG1 3.27Å; I254-T503 WeakPolarHBondContact CD1-OG1 3.41Å; L446-T503 WeakPolarHBondContact CD2-OG1 3.35Å; T499-T503 WeakPolarHBondContact O-CB 3.16Å; T499-T503 PolarHBondContact O-N 2.92Å; T499-T503 VanDerWaalsContact O-N 3.1Å; T499-T503 PolarHBondContact O-OG1 2.85Å; A500-T503 PolarHBondContact O-N 2.92Å; T501-T503 VanDerWaalsContact C-N 3.34Å; T501-T503 PolarHBondContact O-N 3.48Å; T503-P507 VanDerWaalsContact O-CD 3.25Å; T503-P507 WeakPolarHBondContact O-CD 3.26Å
504L85.6Confident88.1Confident22 Ų2215.4 Ų15.412%0.1159%0.092CC..Hα-helixtrans-72.8-48.1178.8179.862.9000112.2I42 A46 F492 A500 T501 T502 I508I42-L504 HydrophobicContact CG2-CD1 4.05Å; A46-L504 HydrophobicContact CB-CD1 3.67Å; A46-L504 HydrophobicContact CB-CD2 3.93Å; A46-L504 HydrophobicContact CB-CG 4.46Å; F492-L504 HydrophobicContact CE1-CD2 4.19Å; F492-L504 HydrophobicContact CZ-CD2 3.94Å; A500-L504 WeakPolarHBondContact O-CB 3.32Å; A500-L504 PolarHBondContact O-N 2.92Å; T501-L504 PolarHBondContact O-N 2.98Å; T502-L504 VanDerWaalsContact C-N 3.28Å; T502-L504 PolarHBondContact O-N 3.25Å; L504-I508 WeakPolarHBondContact O-CD1 3.43Å
505F89.4Confident87.6Confident30 Ų3016.2 Ų16.213%0.13210%0.1CC..Hα-helixtrans-82-37.8-170.3-77-70.8000113.6L488 V489 F492 T501 T502 I508 L509L488-F505 HydrophobicContact CD2-CD1 4.15Å; L488-F505 HydrophobicContact CD2-CE1 3.44Å; L488-F505 VanDerWaalsContact CD2-CE1 3.44Å; L488-F505 HydrophobicContact CD2-CZ 3.78Å; V489-F505 HydrophobicContact CG2-CB 4.27Å; V489-F505 HydrophobicContact CG2-CD1 4.47Å; V489-F505 HydrophobicContact CG2-CD2 4.02Å; V489-F505 HydrophobicContact CG2-CG 4Å; F492-F505 HydrophobicContact CB-CE2 4.1Å; F492-F505 HydrophobicContact CB-CZ 4.46Å; F492-F505 AromaticContact CD1-CE2 3.64Å; F492-F505 HydrophobicContact CD1-CE2 3.64Å; F492-F505 HydrophobicContact CD1-CZ 4.39Å; F492-F505 HydrophobicContact CD2-CE2 4.28Å; F492-F505 HydrophobicContact CD2-CZ 4.24Å; F492-F505 AromaticContact CE1-CE2 3.95Å; F492-F505 HydrophobicContact CE1-CE2 3.95Å; F492-F505 HydrophobicContact CE2-CZ 4.49Å; F492-F505 AromaticContact CG-CE2 3.76Å; F492-F505 HydrophobicContact CG-CE2 3.76Å; F492-F505 HydrophobicContact CG-CZ 4.13Å; F492-F505 HydrophobicContact CZ-CE2 4.36Å; T501-F505 HydrophobicContact CG2-CD2 3.74Å; T501-F505 HydrophobicContact CG2-CE2 3.95Å; T501-F505 VanDerWaalsContact O-CD2 3.27Å; T501-F505 WeakPolarHBondContact O-CD2 3.39Å; T501-F505 PolarHBondContact O-N 3.15Å; T502-F505 PolarHBondContact O-N 3.29Å; F505-I508 WeakPolarHBondContact O-CB 3.32Å; F505-I508 PolarHBondContact O-N 3.13Å; F505-I508 VanDerWaalsContact O-N 3.12Å; F505-L509 HydrophobicContact CB-CD1 4.39Å; F505-L509 VanDerWaalsContact O-CG 3.28Å; F505-L509 WeakPolarHBondContact O-CG 3.23Å; F505-L509 PolarHBondContact O-N 2.95Å
506L91.1Very high87.5Confident1 Ų112.4 Ų12.41%0.0057%0.074CC..Hα-helixtrans-59.9-42.6-170.8-72-168.7000115.2I254 L255 Q258 T502 I508 L509 A510 M524I254-L506 HydrophobicContact CG2-CD1 4.16Å; L255-L506 VanDerWaalsContact CA-CD1 3.47Å; L255-L506 HydrophobicContact CB-CD1 3.74Å; L255-L506 HydrophobicContact CD1-CD1 3.73Å; L255-L506 HydrophobicContact CD1-CD2 4.26Å; L255-L506 HydrophobicContact CG-CD1 4.35Å; Q258-L506 HydrophobicContact CG-CB 4.35Å; Q258-L506 HydrophobicContact CG-CD1 4.48Å; T502-L506 HydrophobicContact CG2-CD1 3.33Å; T502-L506 HydrophobicContact CG2-CD2 4.49Å; T502-L506 HydrophobicContact CG2-CG 3.62Å; T502-L506 WeakPolarHBondContact O-CB 3.33Å; T502-L506 VanDerWaalsContact O-CG 3.3Å; T502-L506 WeakPolarHBondContact O-CG 3.28Å; T502-L506 PolarHBondContact O-N 3.41Å; L506-I508 VanDerWaalsContact C-N 3.3Å; L506-I508 PolarHBondContact O-N 3.38Å; L506-L509 HydrophobicContact CD2-CD1 4.27Å; L506-L509 PolarHBondContact O-N 3.17Å; L506-A510 WeakPolarHBondContact O-CB 3.48Å; L506-A510 PolarHBondContact O-N 3.08Å; L506-M524 HydrophobicContact CB-CE 4.14Å; L506-M524 HydrophobicContact CD2-CB 4.15Å; L506-M524 HydrophobicContact CD2-CE 4.45Å; L506-M524 HydrophobicContact CD2-CG 4.43Å
507P86.1Confident87.4Confident7 Ų717.2 Ų17.25%0.04510%0.095CC..Hα-helixtrans-60.9-40.9176-2334.3000112.2A454 T503 A510 S511A454-P507 HydrophobicContact CB-CB 4.18Å; A454-P507 HydrophobicContact CB-CG 3.98Å; T503-P507 VanDerWaalsContact O-CD 3.25Å; T503-P507 WeakPolarHBondContact O-CD 3.26Å; P507-A510 WeakPolarHBondContact O-CB 3.25Å; P507-A510 PolarHBondContact O-N 2.92Å; P507-S511 PolarHBondContact O-N 2.74Å; P507-S511 VanDerWaalsContact O-N 3.09Å; P507-S511 PolarHBondContact O-OG 2.97Å; P507-S511 VanDerWaalsContact O-OG 3.1Å
508I84.1Confident87.4Confident47 Ų4717 Ų1724%0.2419%0.093CC..Hα-helixtrans-64.5-44.2178.2-57172.9000110.2L466 L504 F505 L506 A510 S511 M512L466-I508 HydrophobicContact CD1-CG1 4.32Å; L466-I508 HydrophobicContact CD1-CG2 4.5Å; L504-I508 WeakPolarHBondContact O-CD1 3.43Å; F505-I508 WeakPolarHBondContact O-CB 3.32Å; F505-I508 PolarHBondContact O-N 3.13Å; F505-I508 VanDerWaalsContact O-N 3.12Å; L506-I508 VanDerWaalsContact C-N 3.3Å; L506-I508 PolarHBondContact O-N 3.38Å; I508-A510 VanDerWaalsContact C-N 3.34Å; I508-A510 PolarHBondContact O-N 3.23Å; I508-S511 PolarHBondContact O-N 3.25Å; I508-M512 VanDerWaalsContact O-CB 3.31Å; I508-M512 WeakPolarHBondContact O-CB 3.47Å; I508-M512 PolarHBondContact O-N 3.43Å
509L89.8Confident87.4Confident7 Ų716.7 Ų16.74%0.0379%0.091CC..Hα-helixtrans-65-37.8178.7-67.1-177.5000112.4L485 F505 L506 M512 S513 V523 M524 C527L485-L509 HydrophobicContact CD1-CD2 3.74Å; L485-L509 HydrophobicContact CD2-CD2 4Å; L485-L509 HydrophobicContact CG-CD2 4.33Å; F505-L509 HydrophobicContact CB-CD1 4.39Å; F505-L509 VanDerWaalsContact O-CG 3.28Å; F505-L509 WeakPolarHBondContact O-CG 3.23Å; F505-L509 PolarHBondContact O-N 2.95Å; L506-L509 HydrophobicContact CD2-CD1 4.27Å; L506-L509 PolarHBondContact O-N 3.17Å; L509-M512 HydrophobicContact CD2-CE 4.1Å; L509-S513 WeakPolarHBondContact O-CB 3.29Å; L509-S513 PolarHBondContact O-N 3.15Å; L509-S513 PolarHBondContact O-OG 3Å; L509-V523 HydrophobicContact CB-CG2 4.39Å; L509-M524 HydrophobicContact CB-CG 4.23Å; L509-C527 HydrophobicContact CD1-CB 3.44Å; L509-C527 VanDerWaalsContact CD1-CB 3.44Å; L509-C527 WeakPolarHBondContact CD1-SG 3.26Å
510A88.8Confident87.6Confident2 Ų216.1 Ų16.12%0.0179%0.087CC..Hα-helixtrans-61.3-51.8174.600000111L262 F263 L506 P507 I508 M512 S513 T514 M524L262-A510 HydrophobicContact CD1-CB 3.52Å; F263-A510 HydrophobicContact CE2-CB 3.98Å; F263-A510 HydrophobicContact CZ-CB 4.12Å; L506-A510 WeakPolarHBondContact O-CB 3.48Å; L506-A510 PolarHBondContact O-N 3.08Å; P507-A510 WeakPolarHBondContact O-CB 3.25Å; P507-A510 PolarHBondContact O-N 2.92Å; I508-A510 VanDerWaalsContact C-N 3.34Å; I508-A510 PolarHBondContact O-N 3.23Å; A510-M512 VanDerWaalsContact C-N 3.33Å; A510-M512 PolarHBondContact O-N 3.09Å; A510-S513 PolarHBondContact O-N 3.4Å; A510-S513 VanDerWaalsContact O-N 3.16Å; A510-S513 PolarHBondContact O-OG 3.37Å; A510-T514 PolarHBondContact O-N 3.38Å; A510-T514 VanDerWaalsContact O-N 3.17Å; A510-T514 PolarHBondContact O-OG1 3.23Å; A510-M524 HydrophobicContact CB-CE 4.02Å; A510-M524 HydrophobicContact CB-SD 3.68Å
511S82.6Confident88Confident8 Ų816 Ų166%0.0569%0.087CC..Hα-helixtrans-66.3-34.8179.8-50.60000113.1S463 P507 I508 T514 A515S463-S511 WeakPolarHBondContact CB-OG 3.39Å; S463-S511 VanDerWaalsContact O-CB 3.28Å; S463-S511 WeakPolarHBondContact O-CB 3.48Å; S463-S511 PolarHBondContact OG-OG 3.32Å; P507-S511 PolarHBondContact O-N 2.74Å; P507-S511 VanDerWaalsContact O-N 3.09Å; P507-S511 PolarHBondContact O-OG 2.97Å; P507-S511 VanDerWaalsContact O-OG 3.1Å; I508-S511 PolarHBondContact O-N 3.25Å; S511-T514 PolarHBondContact O-OG1 3.05Å; S511-A515 WeakPolarHBondContact O-CB 3.17Å; S511-A515 PolarHBondContact O-N 2.75Å
512M85.1Confident88Confident5 Ų516.5 Ų16.53%0.0259%0.089CC..Hα-helixtrans-62.1-47.7171.5-179.4-165.374.700110.7L470 L473 I481 L485 I508 L509 A510 T514 A515 I516 V523L470-M512 HydrophobicContact CB-CG 4.06Å; L470-M512 HydrophobicContact CD1-CB 3.75Å; L470-M512 HydrophobicContact CD1-CG 3.65Å; L470-M512 HydrophobicContact CD1-SD 4.13Å; L470-M512 HydrophobicContact CG-CG 4.46Å; L473-M512 HydrophobicContact CD1-SD 4.18Å; I481-M512 HydrophobicContact CG2-CE 4.22Å; L485-M512 HydrophobicContact CD1-CE 3.47Å; L485-M512 VanDerWaalsContact CD1-CE 3.47Å; L485-M512 HydrophobicContact CD1-SD 4.27Å; I508-M512 VanDerWaalsContact O-CB 3.31Å; I508-M512 WeakPolarHBondContact O-CB 3.47Å; I508-M512 PolarHBondContact O-N 3.43Å; L509-M512 HydrophobicContact CD2-CE 4.1Å; A510-M512 VanDerWaalsContact C-N 3.33Å; A510-M512 PolarHBondContact O-N 3.09Å; M512-T514 VanDerWaalsContact C-N 3.32Å; M512-T514 PolarHBondContact O-N 2.85Å; M512-A515 PolarHBondContact O-N 3.15Å; M512-I516 HydrophobicContact CE-CD1 4.3Å; M512-I516 HydrophobicContact CG-CD1 4.41Å; M512-I516 WeakPolarHBondContact O-CG1 3.47Å; M512-I516 PolarHBondContact O-N 3.33Å; M512-V523 HydrophobicContact CE-CB 4.45Å; M512-V523 HydrophobicContact CE-CG1 4.19Å; M512-V523 HydrophobicContact CE-CG2 4.27Å
513S88.3Confident88Confident0 Ų016.4 Ų16.40%09%0.088CC..Hα-helixtrans-60.6-39.1-176.471.10000113L509 A510 Q517 V518 P520L509-S513 WeakPolarHBondContact O-CB 3.29Å; L509-S513 PolarHBondContact O-N 3.15Å; L509-S513 PolarHBondContact O-OG 3Å; A510-S513 PolarHBondContact O-N 3.4Å; A510-S513 VanDerWaalsContact O-N 3.16Å; A510-S513 PolarHBondContact O-OG 3.37Å; S513-Q517 PolarHBondContact O-N 3.44Å; S513-Q517 VanDerWaalsContact O-N 3.07Å; S513-V518 CarbonylContact C-O 3.59Å; S513-V518 WeakPolarHBondContact CB-O 3.46Å; S513-V518 PolarHBondContact O-N 3.05Å; S513-V518 VanDerWaalsContact O-O 3.06Å; S513-P520 VanDerWaalsContact OG-CA 3.31Å; S513-P520 WeakPolarHBondContact OG-CA 3.49Å; S513-P520 WeakPolarHBondContact OG-CB 3.36Å
514T85.8Confident88.3Confident28 Ų2816.4 Ų16.417%0.1729%0.088CC..Hα-helixtrans-68.7-39.7176.154.20000111.9F263 A510 S511 M512 Q517 F590F263-T514 HydrophobicContact CE1-CG2 3.58Å; F263-T514 HydrophobicContact CZ-CG2 3.8Å; A510-T514 PolarHBondContact O-N 3.38Å; A510-T514 VanDerWaalsContact O-N 3.17Å; A510-T514 PolarHBondContact O-OG1 3.23Å; S511-T514 PolarHBondContact O-OG1 3.05Å; M512-T514 VanDerWaalsContact C-N 3.32Å; M512-T514 PolarHBondContact O-N 2.85Å; T514-Q517 PolarHBondContact O-N 3.48Å; T514-Q517 PolarHBondContact O-NE2 2.97Å; T514-F590 HydrophobicContact CG2-CZ 4.41Å
515A81.3Confident88.8Confident28 Ų2815.4 Ų15.423%0.2318%0.083CC..Hα-helixtrans-68.7-37.4178.300000113.2G467 Q474 S511 M512 Q517G467-A515 VanDerWaalsContact C-CB 3.43Å; G467-A515 WeakPolarHBondContact O-CB 3.4Å; Q474-A515 PolarHBondContact NE2-O 3.41Å; S511-A515 WeakPolarHBondContact O-CB 3.17Å; S511-A515 PolarHBondContact O-N 2.75Å; M512-A515 PolarHBondContact O-N 3.15Å; A515-Q517 VanDerWaalsContact C-N 3.3Å
516I83.9Confident89.1Confident12 Ų1214 Ų146%0.0628%0.077CC..THydrogen-bonded Turntrans-87.22.6176.272.3176.9000113.5Q474 I481 M512 V518Q474-I516 HydrophobicContact CG-CB 3.7Å; Q474-I516 HydrophobicContact CG-CG2 3.83Å; I481-I516 HydrophobicContact CD1-CD1 3.96Å; M512-I516 HydrophobicContact CE-CD1 4.3Å; M512-I516 HydrophobicContact CG-CD1 4.41Å; M512-I516 WeakPolarHBondContact O-CG1 3.47Å; M512-I516 PolarHBondContact O-N 3.33Å; I516-V518 VanDerWaalsContact C-N 3.26Å; I516-V518 HydrophobicContact CD1-CB 4.07Å; I516-V518 HydrophobicContact CD1-CG2 3.78Å; I516-V518 HydrophobicContact CG1-CB 3.88Å; I516-V518 HydrophobicContact CG1-CG2 3.72Å; I516-V518 PolarHBondContact O-N 2.99Å
517Q85.9Confident89.3Confident104 Ų10414 Ų1449%0.4868%0.077SC..THydrogen-bonded Turntrans55.238.6-178.7-63.6-73.9-54.400113.2S513 T514 A515 F590S513-Q517 PolarHBondContact O-N 3.44Å; S513-Q517 VanDerWaalsContact O-N 3.07Å; T514-Q517 PolarHBondContact O-N 3.48Å; T514-Q517 PolarHBondContact O-NE2 2.97Å; A515-Q517 VanDerWaalsContact C-N 3.3Å; Q517-F590 VanDerWaalsContact C-CD2 3.42Å; Q517-F590 HydrophobicContact CB-CD2 4.49Å
518V88.8Confident89.8Confident23 Ų2313.7 Ų13.714%0.1398%0.075CC..  trans-104.4141.1172.61710000108.7P478 S513 I516 P520 Y522 F590P478-V518 HydrophobicContact CG-CG2 4.38Å; S513-V518 CarbonylContact C-O 3.59Å; S513-V518 WeakPolarHBondContact CB-O 3.46Å; S513-V518 PolarHBondContact O-N 3.05Å; S513-V518 VanDerWaalsContact O-O 3.06Å; I516-V518 VanDerWaalsContact C-N 3.26Å; I516-V518 HydrophobicContact CD1-CB 4.07Å; I516-V518 HydrophobicContact CD1-CG2 3.78Å; I516-V518 HydrophobicContact CG1-CB 3.88Å; I516-V518 HydrophobicContact CG1-CG2 3.72Å; I516-V518 PolarHBondContact O-N 2.99Å; V518-P520 WeakPolarHBondContact O-CD 3.24Å; V518-Y522 HydrophobicContact CG1-CD1 4.22Å; V518-Y522 HydrophobicContact CG1-CG 4.31Å; V518-F590 WeakPolarHBondContact O-CE2 3.23Å
519H91.6Very high90.4Very high9 Ų911.5 Ų11.54%0.0426%0.064CC..  trans-52123.7178.2-170.7-56.3000110.8L521 Y522 W593H519-L521 VanDerWaalsContact C-N 3.34Å; H519-L521 PolarHBondContact ND1-N 3.45Å; H519-L521 PolarHBondContact O-N 3.2Å; H519-Y522 WeakPolarHBondContact O-CB 3.21Å; H519-Y522 PolarHBondContact O-N 2.94Å; H519-W593 AromaticContact CE1-CH2 3.92Å; H519-W593 AromaticContact CE1-CZ2 3.61Å; H519-W593 AromaticContact NE2-CZ2 3.78Å
520P92.1Very high90.7Very high0 Ų011.1 Ų11.10%06%0.062CC..Hα-helixtrans-56.1-42.8-173-28.434.3000114.6F263 S513 V518 Y522 V523 M524 W593 A594F263-P520 HydrophobicContact CE1-CG 4.02Å; F263-P520 HydrophobicContact CE2-CB 3.7Å; F263-P520 HydrophobicContact CE2-CG 3.93Å; F263-P520 HydrophobicContact CZ-CB 3.77Å; F263-P520 HydrophobicContact CZ-CG 3.54Å; S513-P520 VanDerWaalsContact OG-CA 3.31Å; S513-P520 WeakPolarHBondContact OG-CA 3.49Å; S513-P520 WeakPolarHBondContact OG-CB 3.36Å; V518-P520 WeakPolarHBondContact O-CD 3.24Å; P520-Y522 PolarHBondContact O-N 3.3Å; P520-Y522 VanDerWaalsContact O-N 3.15Å; P520-V523 WeakPolarHBondContact O-CG2 3.43Å; P520-V523 PolarHBondContact O-N 3.5Å; P520-M524 HydrophobicContact CB-SD 4.11Å; P520-M524 WeakPolarHBondContact O-CB 3.4Å; P520-M524 VanDerWaalsContact O-CG 3.31Å; P520-M524 WeakPolarHBondContact O-CG 3.37Å; P520-M524 PolarHBondContact O-N 3.22Å; P520-W593 HydrophobicContact CB-CH2 4.42Å; P520-W593 HydrophobicContact CG-CH2 4.12Å; P520-W593 HydrophobicContact CG-CZ3 4.07Å; P520-A594 HydrophobicContact CG-CB 3.71Å
521L93.8Very high91.1Very high0 Ų011 Ų110%06%0.061CC..Hα-helixtrans-59-25.7175.7-61.9-178000113.9I259 V269 I270 H519 V523 L525 F585 M587I259-L521 HydrophobicContact CD1-CD2 3.66Å; I259-L521 HydrophobicContact CG1-CD2 4.02Å; V269-L521 HydrophobicContact CB-CD1 4.43Å; V269-L521 HydrophobicContact CG1-CD1 3.63Å; I270-L521 HydrophobicContact CD1-CD1 3.91Å; I270-L521 HydrophobicContact CD1-CD2 3.94Å; I270-L521 HydrophobicContact CG1-CD1 4.28Å; I270-L521 HydrophobicContact CG1-CD2 3.76Å; H519-L521 VanDerWaalsContact C-N 3.34Å; H519-L521 PolarHBondContact ND1-N 3.45Å; H519-L521 PolarHBondContact O-N 3.2Å; L521-V523 PolarHBondContact O-N 3.49Å; L521-L525 HydrophobicContact CB-CD1 3.83Å; L521-L525 HydrophobicContact CB-CG 4.12Å; L521-L525 HydrophobicContact CD2-CG 4.26Å; L521-L525 VanDerWaalsContact O-CB 3.24Å; L521-L525 WeakPolarHBondContact O-CB 3.33Å; L521-L525 WeakPolarHBondContact O-CG 3.35Å; L521-L525 PolarHBondContact O-N 2.72Å; L521-L525 VanDerWaalsContact O-N 3.13Å; L521-F585 HydrophobicContact CD1-CB 4.33Å; L521-F585 HydrophobicContact CD1-CD1 3.79Å; L521-F585 HydrophobicContact CD1-CE1 4.13Å; L521-F585 HydrophobicContact CD1-CG 3.99Å; L521-M587 HydrophobicContact CB-CE 3.93Å
522Y93.3Very high91.7Very high10 Ų1010.7 Ų10.74%0.0396%0.058CC..Hα-helixtrans-64.9-27.4-179.5-165.7-82.2000112.3P478 F479 V518 H519 P520 P526 I577 N578 Y582 M587P478-Y522 VanDerWaalsContact C-CE1 3.41Å; P478-Y522 HydrophobicContact CB-CD1 4.08Å; P478-Y522 HydrophobicContact CB-CE1 3.54Å; P478-Y522 WeakPolarHBondContact O-CE1 3.21Å; F479-Y522 VanDerWaalsContact CA-OH 3.23Å; F479-Y522 WeakPolarHBondContact CA-OH 3.41Å; F479-Y522 WeakPolarHBondContact CB-OH 3.39Å; F479-Y522 PolarHBondContact N-OH 3.27Å; V518-Y522 HydrophobicContact CG1-CD1 4.22Å; V518-Y522 HydrophobicContact CG1-CG 4.31Å; H519-Y522 WeakPolarHBondContact O-CB 3.21Å; H519-Y522 PolarHBondContact O-N 2.94Å; P520-Y522 PolarHBondContact O-N 3.3Å; P520-Y522 VanDerWaalsContact O-N 3.15Å; Y522-P526 WeakPolarHBondContact O-CD 3.46Å; Y522-P526 WeakPolarHBondContact O-CG 3.42Å; Y522-I577 HydrophobicContact CD2-CG1 4.36Å; Y522-N578 PolarHBondContact OH-OD1 3.44Å; Y522-Y582 HydrophobicContact CE2-CD2 4.21Å; Y522-M587 HydrophobicContact CD2-CB 4.07Å; Y522-M587 HydrophobicContact CD2-CG 4.43Å; Y522-M587 HydrophobicContact CD2-SD 3.64Å; Y522-M587 HydrophobicContact CE2-SD 4.47Å; Y522-M587 HydrophobicContact CG-SD 4.39Å
523V92.5Very high92.1Very high1 Ų110.4 Ų10.41%0.0066%0.057CC..Hα-helixtrans-108.1-34.4176.5-65.20000112.7I481 L485 L509 M512 P520 L521 P526 C527I481-V523 HydrophobicContact CG2-CG1 4.14Å; L485-V523 HydrophobicContact CD1-CB 4.26Å; L485-V523 HydrophobicContact CD1-CG1 4.1Å; L509-V523 HydrophobicContact CB-CG2 4.39Å; M512-V523 HydrophobicContact CE-CB 4.45Å; M512-V523 HydrophobicContact CE-CG1 4.19Å; M512-V523 HydrophobicContact CE-CG2 4.27Å; P520-V523 WeakPolarHBondContact O-CG2 3.43Å; P520-V523 PolarHBondContact O-N 3.5Å; L521-V523 PolarHBondContact O-N 3.49Å; V523-P526 WeakPolarHBondContact O-CD 3.43Å; V523-P526 WeakPolarHBondContact O-CG 3.32Å; V523-C527 WeakPolarHBondContact O-CB 3.42Å; V523-C527 PolarHBondContact O-N 2.78Å; V523-C527 PolarHBondContact O-SG 2.63Å
524M95.1Very high92.3Very high0 Ų010.4 Ų10.40%06%0.057CC..Hα-helixtrans-74.3-41.2-176-65.2179.173.800112.8L255 Q258 I259 F263 L506 L509 A510 P520 T528L255-M524 HydrophobicContact CD1-CB 3.54Å; L255-M524 HydrophobicContact CD1-CE 3.74Å; Q258-M524 HydrophobicContact CB-CE 4.27Å; I259-M524 HydrophobicContact CD1-CE 3.7Å; I259-M524 HydrophobicContact CD1-SD 3.49Å; I259-M524 WeakPolarHBondContact CD1-SD 3.43Å; I259-M524 HydrophobicContact CG1-CE 4.16Å; F263-M524 HydrophobicContact CE2-SD 4.25Å; L506-M524 HydrophobicContact CB-CE 4.14Å; L506-M524 HydrophobicContact CD2-CB 4.15Å; L506-M524 HydrophobicContact CD2-CE 4.45Å; L506-M524 HydrophobicContact CD2-CG 4.43Å; L509-M524 HydrophobicContact CB-CG 4.23Å; A510-M524 HydrophobicContact CB-CE 4.02Å; A510-M524 HydrophobicContact CB-SD 3.68Å; P520-M524 HydrophobicContact CB-SD 4.11Å; P520-M524 WeakPolarHBondContact O-CB 3.4Å; P520-M524 VanDerWaalsContact O-CG 3.31Å; P520-M524 WeakPolarHBondContact O-CG 3.37Å; P520-M524 PolarHBondContact O-N 3.22Å; M524-T528 WeakPolarHBondContact O-CB 3.41Å; M524-T528 PolarHBondContact O-N 2.94Å; M524-T528 PolarHBondContact O-OG1 2.89Å
525L95.4Very high92.7Very high1 Ų19.1 Ų9.11%0.0055%0.049CC..Hα-helixtrans-58.9-55.1175.7-72.9170.9000112.6L255 I270 W275 F278 L521 C527 T528 I529 I577 F585 M587L255-L525 HydrophobicContact CD2-CD2 3.54Å; L255-L525 HydrophobicContact CD2-CG 4.34Å; I270-L525 HydrophobicContact CD1-CD2 4.09Å; W275-L525 HydrophobicContact CE3-CD2 4.05Å; W275-L525 HydrophobicContact CZ3-CD2 3.62Å; F278-L525 HydrophobicContact CD1-CD1 4.3Å; F278-L525 HydrophobicContact CD1-CD2 4.21Å; F278-L525 HydrophobicContact CE1-CB 3.94Å; F278-L525 HydrophobicContact CE1-CD1 4.19Å; F278-L525 HydrophobicContact CE1-CD2 4.28Å; F278-L525 HydrophobicContact CE1-CG 4.39Å; F278-L525 HydrophobicContact CZ-CB 4.3Å; F278-L525 HydrophobicContact CZ-CD1 4.39Å; L521-L525 HydrophobicContact CB-CD1 3.83Å; L521-L525 HydrophobicContact CB-CG 4.12Å; L521-L525 HydrophobicContact CD2-CG 4.26Å; L521-L525 VanDerWaalsContact O-CB 3.24Å; L521-L525 WeakPolarHBondContact O-CB 3.33Å; L521-L525 WeakPolarHBondContact O-CG 3.35Å; L521-L525 PolarHBondContact O-N 2.72Å; L521-L525 VanDerWaalsContact O-N 3.13Å; L525-C527 VanDerWaalsContact C-N 3.34Å; L525-C527 PolarHBondContact O-N 3.05Å; L525-T528 WeakPolarHBondContact O-CB 3.32Å; L525-T528 PolarHBondContact O-N 3.27Å; L525-I529 PolarHBondContact O-N 3.32Å; L525-I577 HydrophobicContact CB-CD1 4.05Å; L525-I577 HydrophobicContact CD1-CD1 3.89Å; L525-F585 HydrophobicContact CD1-CD2 3.95Å; L525-F585 HydrophobicContact CD1-CE2 3.52Å; L525-F585 HydrophobicContact CD1-CZ 4.2Å; L525-M587 HydrophobicContact CD1-CE 3.84Å
526P95.5Very high93.2Very high0 Ų09.8 Ų9.80%05%0.048CC..Hα-helixtrans-65-38.2-176.126.3-36.4000112.4Y522 V523 T528 I529 A530 I573Y522-P526 WeakPolarHBondContact O-CD 3.46Å; Y522-P526 WeakPolarHBondContact O-CG 3.42Å; V523-P526 WeakPolarHBondContact O-CD 3.43Å; V523-P526 WeakPolarHBondContact O-CG 3.32Å; P526-T528 VanDerWaalsContact C-N 3.33Å; P526-T528 PolarHBondContact O-N 2.88Å; P526-I529 PolarHBondContact O-N 2.96Å; P526-A530 VanDerWaalsContact O-CB 3.27Å; P526-A530 WeakPolarHBondContact O-CB 3.3Å; P526-A530 PolarHBondContact O-N 3.43Å; P526-I573 VanDerWaalsContact CA-CG2 3.4Å; P526-I573 HydrophobicContact CB-CG2 3.21Å
527C96.1Very high93.5Very high2 Ų212.4 Ų12.41%0.0146%0.062CC..Hα-helixtrans-66.3-34.4176.2-67.90000112.7L485 V489 L509 V523 L525 A530 A531L485-C527 VanDerWaalsContact CB-SG 3.59Å; V489-C527 WeakPolarHBondContact CG1-O 3.33Å; V489-C527 HydrophobicContact CG2-CB 4.11Å; L509-C527 HydrophobicContact CD1-CB 3.44Å; L509-C527 VanDerWaalsContact CD1-CB 3.44Å; L509-C527 WeakPolarHBondContact CD1-SG 3.26Å; V523-C527 WeakPolarHBondContact O-CB 3.42Å; V523-C527 PolarHBondContact O-N 2.78Å; V523-C527 PolarHBondContact O-SG 2.63Å; L525-C527 VanDerWaalsContact C-N 3.34Å; L525-C527 PolarHBondContact O-N 3.05Å; C527-A530 PolarHBondContact O-N 3.39Å; C527-A531 PolarHBondContact O-N 3Å
528T96.7Very high93.6Very high1 Ų18.2 Ų8.21%0.0064%0.044CC..Hα-helixtrans-63.2-46.6175.8-600000111.6P251 L255 W275 T502 M524 L525 P526 A531P251-T528 VanDerWaalsContact C-CG2 3.5Å; P251-T528 HydrophobicContact CB-CG2 4Å; P251-T528 VanDerWaalsContact O-CG2 3.22Å; P251-T528 WeakPolarHBondContact O-CG2 3.42Å; L255-T528 HydrophobicContact CB-CG2 3.8Å; L255-T528 HydrophobicContact CD2-CG2 4.29Å; W275-T528 HydrophobicContact CH2-CG2 4.1Å; T502-T528 HydrophobicContact CG2-CG2 4.42Å; M524-T528 WeakPolarHBondContact O-CB 3.41Å; M524-T528 PolarHBondContact O-N 2.94Å; M524-T528 PolarHBondContact O-OG1 2.89Å; L525-T528 WeakPolarHBondContact O-CB 3.32Å; L525-T528 PolarHBondContact O-N 3.27Å; P526-T528 VanDerWaalsContact C-N 3.33Å; P526-T528 PolarHBondContact O-N 2.88Å; T528-A531 PolarHBondContact O-N 2.96Å
529I96.3Very high93.4Very high0 Ų013.7 Ų13.70%08%0.077CC..Hα-helixtrans-68.2-40.2177-57.6179.9000109.8T243 W275 F278 L525 P526 A531 S532 I573T243-I529 HydrophobicContact CG2-CG2 3.95Å; W275-I529 HydrophobicContact CH2-CG1 4.2Å; F278-I529 HydrophobicContact CD1-CD1 4.26Å; F278-I529 HydrophobicContact CE1-CD1 3.64Å; L525-I529 PolarHBondContact O-N 3.32Å; P526-I529 PolarHBondContact O-N 2.96Å; I529-A531 VanDerWaalsContact C-N 3.27Å; I529-A531 PolarHBondContact O-N 3.03Å; I529-S532 WeakPolarHBondContact O-CA 3.47Å; I529-S532 WeakPolarHBondContact O-CB 3.37Å; I529-S532 PolarHBondContact O-N 3.18Å; I529-I573 HydrophobicContact CB-CD1 3.76Å; I529-I573 HydrophobicContact CB-CG1 4.15Å; I529-I573 HydrophobicContact CG2-CD1 3.51Å; I529-I573 HydrophobicContact CG2-CG1 3.82Å
530A96.6Very high93.2Very high0 Ų013.8 Ų13.80%08%0.079CC..Hα-helixtrans-59.1-35.3177.100000113V489 A490 P526 C527 S532 L533V489-A530 HydrophobicContact CB-CB 4.47Å; V489-A530 HydrophobicContact CG1-CB 4.33Å; A490-A530 HydrophobicContact CB-CB 4.5Å; P526-A530 VanDerWaalsContact O-CB 3.27Å; P526-A530 WeakPolarHBondContact O-CB 3.3Å; P526-A530 PolarHBondContact O-N 3.43Å; C527-A530 PolarHBondContact O-N 3.39Å; A530-S532 PolarHBondContact O-N 3.32Å; A530-S532 VanDerWaalsContact O-N 3.16Å; A530-L533 WeakPolarHBondContact O-CB 3.4Å; A530-L533 PolarHBondContact O-N 3.1Å
531A95.9Very high93.1Very high0 Ų014.1 Ų14.10%08%0.081CC..THydrogen-bonded Turntrans-64.6-14.917400000113.4V489 T493 N498 T501 T502 C527 T528 I529V489-A531 HydrophobicContact CG1-CB 3.69Å; T493-A531 PolarHBondContact OG1-O 2.89Å; N498-A531 WeakPolarHBondContact CB-O 3.39Å; N498-A531 PolarHBondContact ND2-O 3.26Å; N498-A531 PolarHBondContact OD1-O 3.43Å; T501-A531 HydrophobicContact CG2-CB 4.35Å; T502-A531 WeakPolarHBondContact OG1-CB 3.28Å; C527-A531 PolarHBondContact O-N 3Å; T528-A531 PolarHBondContact O-N 2.96Å; I529-A531 VanDerWaalsContact C-N 3.27Å; I529-A531 PolarHBondContact O-N 3.03Å
532S94.9Very high92.9Very high0 Ų017.8 Ų17.80%011%0.105CC..THydrogen-bonded Turntrans-94.4-4.2173-60.20000113.3I529 A530 A534I529-S532 WeakPolarHBondContact O-CA 3.47Å; I529-S532 WeakPolarHBondContact O-CB 3.37Å; I529-S532 PolarHBondContact O-N 3.18Å; A530-S532 PolarHBondContact O-N 3.32Å; A530-S532 VanDerWaalsContact O-N 3.16Å; S532-A534 VanDerWaalsContact C-N 3.32Å; S532-A534 PolarHBondContact O-N 3.48Å
533L93.8Very high92.9Very high0 Ų017.4 Ų17.40%010%0.104CC..  trans-92.256.8179.5-52.7-176.4000111.6M286 A530 F535 N566 I573M286-L533 HydrophobicContact CE-CD2 3.88Å; M286-L533 HydrophobicContact SD-CD2 3.58Å; M286-L533 VanDerWaalsContact SD-CD2 3.58Å; A530-L533 WeakPolarHBondContact O-CB 3.4Å; A530-L533 PolarHBondContact O-N 3.1Å; L533-F535 HydrophobicContact CB-CD2 4.34Å; L533-F535 HydrophobicContact CB-CE2 3.9Å; L533-F535 HydrophobicContact CB-CZ 4.3Å; L533-F535 HydrophobicContact CD2-CE2 3.68Å; L533-F535 HydrophobicContact CD2-CZ 3.62Å; L533-F535 HydrophobicContact CG-CE2 4.3Å; L533-N566 PolarHBondContact O-OD1 3.31Å; L533-I573 HydrophobicContact CD1-CD1 3.76Å
534A93Very high92.9Very high0 Ų017.3 Ų17.30%010%0.103CC..  trans-9687.5174.300000109.2T493 E494 S532 A540 T541 N544T493-A534 HydrophobicContact CG2-CB 3.82Å; E494-A534 WeakPolarHBondContact OE1-CA 3.45Å; S532-A534 VanDerWaalsContact C-N 3.32Å; S532-A534 PolarHBondContact O-N 3.48Å; A534-A540 HydrophobicContact CB-CB 3.88Å; A534-T541 HydrophobicContact CB-CG2 3.53Å; A534-N544 PolarHBondContact O-ND2 3.07Å
535F94Very high92.8Very high0 Ų019.6 Ų19.60%012%0.122CC..  trans-112.1-15.6-171.5-59-42000114.3Y236 I240 E494 L533 L565 N566Y236-F535 HydrophobicContact CD1-CB 4.15Å; Y236-F535 AromaticContact CD1-CD1 3.5Å; Y236-F535 HydrophobicContact CD1-CD1 3.5Å; Y236-F535 VanDerWaalsContact CD1-CD1 3.5Å; Y236-F535 HydrophobicContact CD1-CE1 4.21Å; Y236-F535 HydrophobicContact CD1-CG 4.08Å; Y236-F535 HydrophobicContact CE1-CB 3.74Å; Y236-F535 AromaticContact CE1-CD1 3.97Å; Y236-F535 HydrophobicContact CE1-CD1 3.97Å; Y236-F535 HydrophobicContact CE1-CG 4.2Å; Y236-F535 WeakPolarHBondContact CE1-O 3.5Å; Y236-F535 HydrophobicContact CG-CD1 4.21Å; Y236-F535 PolarHBondContact OH-O 2.86Å; I240-F535 HydrophobicContact CD1-CZ 4.35Å; I240-F535 HydrophobicContact CG1-CE1 4.38Å; I240-F535 HydrophobicContact CG1-CZ 3.82Å; E494-F535 PolarHBondContact OE1-N 3.37Å; L533-F535 HydrophobicContact CB-CD2 4.34Å; L533-F535 HydrophobicContact CB-CE2 3.9Å; L533-F535 HydrophobicContact CB-CZ 4.3Å; L533-F535 HydrophobicContact CD2-CE2 3.68Å; L533-F535 HydrophobicContact CD2-CZ 3.62Å; L533-F535 HydrophobicContact CG-CE2 4.3Å; F535-L565 HydrophobicContact CB-CB 4.38Å; F535-L565 HydrophobicContact CD2-CB 3.4Å; F535-L565 HydrophobicContact CE2-CB 3.91Å; F535-L565 HydrophobicContact CG-CB 4.13Å; F535-N566 WeakPolarHBondContact CD2-OD1 3.42Å
536M92.1Very high92.7Very high42 Ų4221.1 Ų21.121%0.20713%0.13CC..SBendtrans-85-40.3-169-61.2175.165.400113.3E494 M558 V559 F563E494-M536 VanDerWaalsContact CD-N 3.29Å; E494-M536 HydrophobicContact CG-CB 4.3Å; E494-M536 HydrophobicContact CG-CG 4.45Å; E494-M536 HydrophobicContact CG-SD 4.3Å; E494-M536 WeakPolarHBondContact OE1-CG 3.45Å; E494-M536 PolarHBondContact OE1-N 2.81Å; E494-M536 WeakPolarHBondContact OE2-CA 3.22Å; E494-M536 WeakPolarHBondContact OE2-CB 3.34Å; E494-M536 PolarHBondContact OE2-N 2.73Å; M536-M558 CarbonylContact O-C 3.52Å; M536-V559 HydrophobicContact CE-CG1 3.95Å; M536-V559 WeakPolarHBondContact O-CG2 3.4Å; M536-V559 PolarHBondContact O-N 2.97Å; M536-F563 HydrophobicContact CE-CB 4.07Å; M536-F563 HydrophobicContact CE-CD2 3.94Å; M536-F563 HydrophobicContact CE-CG 4.48Å; M536-F563 HydrophobicContact SD-CB 4.36Å; M536-F563 HydrophobicContact SD-CD2 4.22Å
537L91.1Very high92.6Very high67 Ų6721.1 Ų21.135%0.35113%0.13SC..  trans-109.3142.7-171.9-62.3178000113.2E494 V539 A540 N544 V555 V559E494-L537 HydrophobicContact CB-CD1 4.39Å; E494-L537 PolarHBondContact OE2-N 3.05Å; E494-L537 VanDerWaalsContact OE2-N 3.08Å; L537-V539 VanDerWaalsContact C-N 3.28Å; L537-V539 PolarHBondContact O-N 3.13Å; L537-A540 HydrophobicContact CB-CB 4.2Å; L537-A540 WeakPolarHBondContact O-CB 3.43Å; L537-A540 PolarHBondContact O-N 2.78Å; L537-N544 PolarHBondContact O-ND2 3.25Å; L537-V555 HydrophobicContact CD2-CG1 4.48Å; L537-V559 HydrophobicContact CD2-CG2 4.05Å
538P87.6Confident92.3Very high17 Ų1724 Ų2411%0.1114%0.142CC..THydrogen-bonded Turntrans-61.5-35.6176-24.434.2000113.3A540 A545 F548 V555 M558P538-A540 VanDerWaalsContact C-N 3.31Å; P538-A545 WeakPolarHBondContact O-CA 3.02Å; P538-A545 WeakPolarHBondContact O-CB 3.44Å; P538-A545 PolarHBondContact O-N 3.16Å; P538-F548 HydrophobicContact CB-CB 4.02Å; P538-F548 HydrophobicContact CB-CD1 4.45Å; P538-F548 HydrophobicContact CB-CD2 3.95Å; P538-F548 HydrophobicContact CB-CG 3.89Å; P538-F548 HydrophobicContact CG-CB 4.44Å; P538-F548 HydrophobicContact CG-CD2 3.44Å; P538-F548 VanDerWaalsContact CG-CD2 3.44Å; P538-F548 HydrophobicContact CG-CE2 3.7Å; P538-F548 HydrophobicContact CG-CG 3.91Å; P538-F548 HydrophobicContact CG-CZ 4.37Å; P538-V555 HydrophobicContact CG-CG2 4.37Å; P538-M558 HydrophobicContact CB-SD 4.38Å; P538-M558 HydrophobicContact CG-SD 3.98Å
539V85.1Confident91.9Very high138 Ų13827.8 Ų27.884%0.83617%0.168SC*.THydrogen-bonded Turntrans-78.6-19.1-176.1-176.50000111.8L537 T541L537-V539 VanDerWaalsContact C-N 3.28Å; L537-V539 PolarHBondContact O-N 3.13Å; V539-T541 VanDerWaalsContact C-N 3.3Å; V539-T541 PolarHBondContact O-N 2.59Å
540A86.9Confident91.4Very high11 Ų1130.8 Ų30.89%0.09118%0.182CC..THydrogen-bonded Turntrans-61.5-37.7-173.100000112.8E494 A534 L537 P538E494-A540 WeakPolarHBondContact O-CB 3.25Å; A534-A540 HydrophobicContact CB-CB 3.88Å; L537-A540 HydrophobicContact CB-CB 4.2Å; L537-A540 WeakPolarHBondContact O-CB 3.43Å; L537-A540 PolarHBondContact O-N 2.78Å; P538-A540 VanDerWaalsContact C-N 3.31Å
541T90.3Very high90.6Very high7 Ų730.9 Ų30.94%0.04318%0.182CC..  trans-141150.3176.269.50000112.1A534 V539 N544 A545A534-T541 HydrophobicContact CB-CG2 3.53Å; V539-T541 VanDerWaalsContact C-N 3.3Å; V539-T541 PolarHBondContact O-N 2.59Å; T541-N544 WeakPolarHBondContact O-CB 3.48Å; T541-N544 PolarHBondContact O-N 2.84Å; T541-N544 PolarHBondContact OG1-N 3.43Å; T541-N544 PolarHBondContact OG1-ND2 2.98Å; T541-N544 PolarHBondContact OG1-OD1 2.99Å; T541-A545 PolarHBondContact O-N 3.32Å; T541-A545 VanDerWaalsContact O-N 3.14Å
542P89.6Confident90.1Very high76 Ų7637 Ų3749%0.49422%0.215SC..Hα-helixtrans-57.8-40.1175.2-21.931.3000114.4T142 N544 A545 I546T142-P542 HydrophobicContact CG2-CB 3.67Å; T142-P542 WeakPolarHBondContact OG1-CB 3.43Å; P542-N544 VanDerWaalsContact C-N 3.27Å; P542-N544 PolarHBondContact O-N 3.41Å; P542-A545 PolarHBondContact O-N 2.97Å; P542-I546 VanDerWaalsContact O-CG1 3.25Å; P542-I546 WeakPolarHBondContact O-CG1 3.42Å; P542-I546 PolarHBondContact O-N 3.46Å
543P92.1Very high89.8Confident2 Ų237.5 Ų37.51%0.01322%0.218CC..Hα-helixtrans-50.1-45169.4-31.537.4000113.8N141 T145 C235 I546 A547N141-P543 HydrophobicContact CB-CG 3.66Å; T145-P543 HydrophobicContact CG2-CB 4.23Å; T145-P543 WeakPolarHBondContact OG1-CB 3.38Å; C235-P543 HydrophobicContact CB-CB 4.12Å; P543-I546 PolarHBondContact O-N 2.94Å; P543-A547 PolarHBondContact O-N 2.91Å
544N93.9Very high89.7Confident0 Ų044.1 Ų44.10%025%0.246CC..Hα-helixtrans-64.8-44.3-179.7-70.40.4000111.4A534 L537 T541 P542 I546 A547 F548 M558A534-N544 PolarHBondContact O-ND2 3.07Å; L537-N544 PolarHBondContact O-ND2 3.25Å; T541-N544 WeakPolarHBondContact O-CB 3.48Å; T541-N544 PolarHBondContact O-N 2.84Å; T541-N544 PolarHBondContact OG1-N 3.43Å; T541-N544 PolarHBondContact OG1-ND2 2.98Å; T541-N544 PolarHBondContact OG1-OD1 2.99Å; P542-N544 VanDerWaalsContact C-N 3.27Å; P542-N544 PolarHBondContact O-N 3.41Å; N544-I546 VanDerWaalsContact C-N 3.33Å; N544-I546 PolarHBondContact O-N 3.34Å; N544-A547 PolarHBondContact O-N 3.46Å; N544-F548 VanDerWaalsContact O-CB 3.29Å; N544-F548 WeakPolarHBondContact O-CB 3.03Å; N544-F548 PolarHBondContact O-N 2.84Å; N544-M558 HydrophobicContact CB-CE 3.32Å; N544-M558 HydrophobicContact CB-SD 4.25Å; N544-M558 WeakPolarHBondContact OD1-CE 3.28Å
545A91.8Very high89.5Confident47 Ų4747.5 Ų47.539%0.38827%0.267SS..Hα-helixtrans-62.4-39.9178.100000112.3P538 T541 P542 F548 S549P538-A545 WeakPolarHBondContact O-CA 3.02Å; P538-A545 WeakPolarHBondContact O-CB 3.44Å; P538-A545 PolarHBondContact O-N 3.16Å; T541-A545 PolarHBondContact O-N 3.32Å; T541-A545 VanDerWaalsContact O-N 3.14Å; P542-A545 PolarHBondContact O-N 2.97Å; A545-F548 PolarHBondContact O-N 3.18Å; A545-S549 PolarHBondContact O-N 2.77Å; A545-S549 VanDerWaalsContact O-N 3.12Å
546I92.5Very high89.3Confident34 Ų3452.8 Ų52.817%0.17429%0.294CS..Hα-helixtrans-68.8-46.1177.1-59.1164.1000110.1T142 T145 A146 L149 P542 P543 N544 F548 S549 F550T142-I546 HydrophobicContact CG2-CD1 3.75Å; T145-I546 HydrophobicContact CG2-CB 4.25Å; T145-I546 HydrophobicContact CG2-CG2 4.37Å; A146-I546 HydrophobicContact CB-CD1 4.11Å; L149-I546 HydrophobicContact CD1-CB 4.25Å; L149-I546 HydrophobicContact CD1-CG2 3.56Å; P542-I546 VanDerWaalsContact O-CG1 3.25Å; P542-I546 WeakPolarHBondContact O-CG1 3.42Å; P542-I546 PolarHBondContact O-N 3.46Å; P543-I546 PolarHBondContact O-N 2.94Å; N544-I546 VanDerWaalsContact C-N 3.33Å; N544-I546 PolarHBondContact O-N 3.34Å; I546-F548 PolarHBondContact O-N 3.4Å; I546-S549 PolarHBondContact O-N 3.44Å; I546-S549 PolarHBondContact O-OG 3.39Å; I546-F550 HydrophobicContact CG2-CD2 3.79Å; I546-F550 HydrophobicContact CG2-CE2 3.9Å; I546-F550 VanDerWaalsContact O-CD2 3.3Å; I546-F550 WeakPolarHBondContact O-CD2 3.26Å; I546-F550 PolarHBondContact O-N 3.38Å
547A93.4Very high89.2Confident0 Ų052.4 Ų52.40%029%0.293CS..Hα-helixtrans-61.5-35.5175.500000112.3L149 C235 P543 N544 F550 G551L149-A547 HydrophobicContact CD1-CB 4.08Å; C235-A547 HydrophobicContact CB-CB 3.61Å; C235-A547 VanDerWaalsContact SG-CB 3.57Å; P543-A547 PolarHBondContact O-N 2.91Å; N544-A547 PolarHBondContact O-N 3.46Å; A547-F550 PolarHBondContact O-N 2.83Å; A547-G551 WeakPolarHBondContact O-CA 3.42Å; A547-G551 PolarHBondContact O-N 3.2Å
548F91.6Very high89.3Confident63 Ų6349.2 Ų49.228%0.27628%0.276SS..Hα-helixtrans-63-41.3176.5-167.2-93.7000112.6P538 N544 A545 I546 L553 V555P538-F548 HydrophobicContact CB-CB 4.02Å; P538-F548 HydrophobicContact CB-CD1 4.45Å; P538-F548 HydrophobicContact CB-CD2 3.95Å; P538-F548 HydrophobicContact CB-CG 3.89Å; P538-F548 HydrophobicContact CG-CB 4.44Å; P538-F548 HydrophobicContact CG-CD2 3.44Å; P538-F548 VanDerWaalsContact CG-CD2 3.44Å; P538-F548 HydrophobicContact CG-CE2 3.7Å; P538-F548 HydrophobicContact CG-CG 3.91Å; P538-F548 HydrophobicContact CG-CZ 4.37Å; N544-F548 VanDerWaalsContact O-CB 3.29Å; N544-F548 WeakPolarHBondContact O-CB 3.03Å; N544-F548 PolarHBondContact O-N 2.84Å; A545-F548 PolarHBondContact O-N 3.18Å; I546-F548 PolarHBondContact O-N 3.4Å; F548-L553 HydrophobicContact CD2-CB 3.79Å; F548-L553 HydrophobicContact CE2-CB 4.12Å; F548-L553 WeakPolarHBondContact CE2-O 3.15Å; F548-L553 VanDerWaalsContact CZ-O 3.24Å; F548-L553 WeakPolarHBondContact CZ-O 3.36Å; F548-V555 HydrophobicContact CE2-CG2 3.95Å; F548-V555 HydrophobicContact CZ-CG2 3.91Å
549S88.3Confident89.6Confident79 Ų7950.2 Ų50.255%0.55228%0.282SS*.Hα-helixtrans-74.2-34.4179.266.80000113.3A545 I546A545-S549 PolarHBondContact O-N 2.77Å; A545-S549 VanDerWaalsContact O-N 3.12Å; I546-S549 PolarHBondContact O-N 3.44Å; I546-S549 PolarHBondContact O-OG 3.39Å
550F86Confident89.9Confident64 Ų6451.9 Ų51.928%0.28127%0.273SS..Hα-helixtrans-81.8-37.9178.3-82.6-102.4000112.6L149 P150 Q153 I546 A547 N552L149-F550 HydrophobicContact CB-CB 4.37Å; L149-F550 HydrophobicContact CB-CD1 4.16Å; L149-F550 HydrophobicContact CB-CG 4.17Å; L149-F550 HydrophobicContact CD1-CB 4.25Å; L149-F550 HydrophobicContact CD1-CD2 4.45Å; L149-F550 HydrophobicContact CD1-CG 4.38Å; P150-F550 HydrophobicContact CB-CE1 4.4Å; P150-F550 HydrophobicContact CG-CE1 3.74Å; P150-F550 HydrophobicContact CG-CZ 4.05Å; Q153-F550 VanDerWaalsContact CD-CD1 3.5Å; Q153-F550 PolarHBondContact NE2-O 2.98Å; Q153-F550 VanDerWaalsContact OE1-CD1 3.23Å; I546-F550 HydrophobicContact CG2-CD2 3.79Å; I546-F550 HydrophobicContact CG2-CE2 3.9Å; I546-F550 VanDerWaalsContact O-CD2 3.3Å; I546-F550 WeakPolarHBondContact O-CD2 3.26Å; I546-F550 PolarHBondContact O-N 3.38Å; A547-F550 PolarHBondContact O-N 2.83Å; F550-N552 PolarHBondContact O-N 3.21Å
551G79.9Confident90.2Very high1 Ų151.3 Ų51.31%0.0127%0.269CS..THydrogen-bonded Turntrans-863.4-167.100000116.4K228 S231 A547 L553K228-G551 WeakPolarHBondContact CG-O 3.26Å; S231-G551 WeakPolarHBondContact OG-CA 3.41Å; A547-G551 WeakPolarHBondContact O-CA 3.42Å; A547-G551 PolarHBondContact O-N 3.2Å; G551-L553 PolarHBondContact O-N 2.94Å; G551-L553 VanDerWaalsContact O-N 3.13Å
552N84.6Confident90.3Very high129 Ų12951 Ų5169%0.6927%0.267SS*.THydrogen-bonded Turntrans46.539.9-169.6-70.4-15.6000112.3K228 F550K228-N552 WeakPolarHBondContact CE-O 3.42Å; F550-N552 PolarHBondContact O-N 3.21Å
553L88.2Confident90.5Very high10 Ų1052.3 Ų52.35%0.05227%0.265CS..  trans-78145.5-174.3-71.2167000110.7K228 L232 F548 G551 D557K228-L553 HydrophobicContact CB-CD2 3.64Å; K228-L553 HydrophobicContact CD-CD2 4.31Å; K228-L553 HydrophobicContact CG-CD2 3.77Å; L232-L553 HydrophobicContact CD1-CD2 4.03Å; L232-L553 HydrophobicContact CD2-CD1 3.52Å; L232-L553 HydrophobicContact CD2-CD2 4.26Å; L232-L553 HydrophobicContact CG-CD1 3.89Å; L232-L553 HydrophobicContact CG-CD2 3.92Å; F548-L553 HydrophobicContact CD2-CB 3.79Å; F548-L553 HydrophobicContact CE2-CB 4.12Å; F548-L553 WeakPolarHBondContact CE2-O 3.15Å; F548-L553 VanDerWaalsContact CZ-O 3.24Å; F548-L553 WeakPolarHBondContact CZ-O 3.36Å; G551-L553 PolarHBondContact O-N 2.94Å; G551-L553 VanDerWaalsContact O-N 3.13Å; L553-D557 HydrophobicContact CD2-CB 4.24Å
554K91.3Very high90.6Very high139 Ų13955.6 Ų55.660%0.60428%0.281SS*.  trans-93.4151.3162.7-63.5-178.6179.8178.60109I556 D557 M558K554-I556 HydrophobicContact CB-CG2 4Å; K554-I556 PolarHBondContact O-N 3.18Å; K554-I556 VanDerWaalsContact O-N 3.15Å; K554-D557 PolarHBondContact N-OD2 3.34Å; K554-D557 VanDerWaalsContact N-OD2 3.08Å; K554-D557 WeakPolarHBondContact O-CB 3.29Å; K554-D557 PolarHBondContact O-N 3.04Å; K554-M558 PolarHBondContact O-N 3.29Å
555V89.9Confident90.5Very high71 Ų7155.6 Ų55.643%0.4328%0.281SS..Hα-helixtrans-55.2-38.1178.9178.90000111L537 P538 F548 D557 M558 V559L537-V555 HydrophobicContact CD2-CG1 4.48Å; P538-V555 HydrophobicContact CG-CG2 4.37Å; F548-V555 HydrophobicContact CE2-CG2 3.95Å; F548-V555 HydrophobicContact CZ-CG2 3.91Å; V555-D557 VanDerWaalsContact C-N 3.32Å; V555-D557 PolarHBondContact O-N 2.98Å; V555-M558 PolarHBondContact O-N 2.93Å; V555-V559 HydrophobicContact CG1-CG2 4.06Å; V555-V559 WeakPolarHBondContact O-CG2 3.38Å; V555-V559 PolarHBondContact O-N 2.72Å
556I90.3Very high90.7Very high111 Ų11153.8 Ų53.857%0.56927%0.265SS*.Hα-helixtrans-64.5-33177.8-167.260.1000113.6K554 M558 R560K554-I556 HydrophobicContact CB-CG2 4Å; K554-I556 PolarHBondContact O-N 3.18Å; K554-I556 VanDerWaalsContact O-N 3.15Å; I556-M558 VanDerWaalsContact C-N 3.28Å; I556-M558 PolarHBondContact O-N 3.38Å; I556-R560 WeakPolarHBondContact O-CB 3.38Å; I556-R560 PolarHBondContact O-N 3.32Å
557D89.9Confident90.8Very high34 Ų3455.2 Ų55.218%0.18227%0.272CS..Hα-helixtrans-63.8-42177.4-60.5-28.2000109.2K228 L553 K554 V555 A561K228-D557 IonicContact NZ-OD2 2.72Å; K228-D557 PolarHBondContact NZ-OD2 2.92Å; L553-D557 HydrophobicContact CD2-CB 4.24Å; K554-D557 PolarHBondContact N-OD2 3.34Å; K554-D557 VanDerWaalsContact N-OD2 3.08Å; K554-D557 WeakPolarHBondContact O-CB 3.29Å; K554-D557 PolarHBondContact O-N 3.04Å; V555-D557 VanDerWaalsContact C-N 3.32Å; V555-D557 PolarHBondContact O-N 2.98Å; D557-A561 WeakPolarHBondContact O-CB 3.37Å; D557-A561 PolarHBondContact O-N 2.92Å
558M93.3Very high90.8Very high0 Ų056.5 Ų56.50%028%0.279CS..Hα-helixtrans-71.7-48.3179.5-163.4161.9-160.400112.3L232 Y236 M536 P538 N544 K554 V555 I556 R560 A561 G562L232-M558 HydrophobicContact CD2-CE 4.17Å; L232-M558 HydrophobicContact CD2-CG 4.14Å; Y236-M558 HydrophobicContact CE1-CE 3.78Å; Y236-M558 WeakPolarHBondContact OH-CG 3.39Å; Y236-M558 PolarHBondContact OH-O 3.45Å; M536-M558 CarbonylContact O-C 3.52Å; P538-M558 HydrophobicContact CB-SD 4.38Å; P538-M558 HydrophobicContact CG-SD 3.98Å; N544-M558 HydrophobicContact CB-CE 3.32Å; N544-M558 HydrophobicContact CB-SD 4.25Å; N544-M558 WeakPolarHBondContact OD1-CE 3.28Å; K554-M558 PolarHBondContact O-N 3.29Å; V555-M558 PolarHBondContact O-N 2.93Å; I556-M558 VanDerWaalsContact C-N 3.28Å; I556-M558 PolarHBondContact O-N 3.38Å; M558-R560 VanDerWaalsContact C-N 3.33Å; M558-R560 PolarHBondContact O-N 3.49Å; M558-A561 PolarHBondContact O-N 2.98Å; M558-G562 PolarHBondContact O-N 3.29Å
559V93.6Very high91Very high39 Ų3953.5 Ų53.524%0.23627%0.266CS..Hα-helixtrans-57.9-44.8178.6169.70000111.3M536 L537 V555 F563M536-V559 HydrophobicContact CE-CG1 3.95Å; M536-V559 WeakPolarHBondContact O-CG2 3.4Å; M536-V559 PolarHBondContact O-N 2.97Å; L537-V559 HydrophobicContact CD2-CG2 4.05Å; V555-V559 HydrophobicContact CG1-CG2 4.06Å; V555-V559 WeakPolarHBondContact O-CG2 3.38Å; V555-V559 PolarHBondContact O-N 2.72Å; V559-F563 VanDerWaalsContact O-CB 3.23Å; V559-F563 WeakPolarHBondContact O-CB 3.5Å; V559-F563 PolarHBondContact O-N 3.46Å
560R90.9Very high91.3Very high172 Ų17250.2 Ų50.265%0.64924%0.242SC*.Hα-helixtrans-65.2-44179.8-176179.1179.2179.80.1112I556 M558I556-R560 WeakPolarHBondContact O-CB 3.38Å; I556-R560 PolarHBondContact O-N 3.32Å; M558-R560 VanDerWaalsContact C-N 3.33Å; M558-R560 PolarHBondContact O-N 3.49Å
561A92.1Very high91.7Very high0 Ų052 Ų520%025%0.254CS..Hα-helixtrans-67.1-4717800000111.3L232 Y236 W293 L294 M297 D557 M558 L565L232-A561 HydrophobicContact CD1-CB 4Å; Y236-A561 HydrophobicContact CE2-CB 4.06Å; W293-A561 PolarHBondContact NE1-O 2.95Å; W293-A561 VanDerWaalsContact NE1-O 3.15Å; L294-A561 HydrophobicContact CD2-CB 4.39Å; M297-A561 HydrophobicContact CE-CB 4.07Å; M297-A561 HydrophobicContact SD-CB 3.73Å; D557-A561 WeakPolarHBondContact O-CB 3.37Å; D557-A561 PolarHBondContact O-N 2.92Å; M558-A561 PolarHBondContact O-N 2.98Å; A561-L565 WeakPolarHBondContact O-CG 3.36Å; A561-L565 PolarHBondContact O-N 3.46Å
562G93.3Very high92.5Very high0 Ų052.2 Ų52.20%026%0.255CS..Hα-helixtrans-69-38.4-175.100000113.8M558 M564 L565 N566M558-G562 PolarHBondContact O-N 3.29Å; G562-M564 VanDerWaalsContact C-N 3.3Å; G562-M564 PolarHBondContact O-N 3.25Å; G562-L565 CarbonylContact O-C 3.54Å; G562-L565 WeakPolarHBondContact O-CB 3.47Å; G562-L565 PolarHBondContact O-N 2.91Å; G562-L565 VanDerWaalsContact O-N 3.08Å; G562-N566 PolarHBondContact O-N 3.38Å; G562-N566 PolarHBondContact O-OD1 3.48Å
563F94.1Very high93Very high103 Ų10346.1 Ų46.145%0.45222%0.222SC..Hα-helixtrans-57.4-44.8178178.8-103.5000112M536 V559 N566 I567M536-F563 HydrophobicContact CE-CB 4.07Å; M536-F563 HydrophobicContact CE-CD2 3.94Å; M536-F563 HydrophobicContact CE-CG 4.48Å; M536-F563 HydrophobicContact SD-CB 4.36Å; M536-F563 HydrophobicContact SD-CD2 4.22Å; V559-F563 VanDerWaalsContact O-CB 3.23Å; V559-F563 WeakPolarHBondContact O-CB 3.5Å; V559-F563 PolarHBondContact O-N 3.46Å; F563-N566 PolarHBondContact O-N 3.21Å; F563-I567 HydrophobicContact CD1-CD1 4.12Å; F563-I567 HydrophobicContact CE1-CD1 3.57Å; F563-I567 HydrophobicContact CZ-CD1 3.83Å; F563-I567 PolarHBondContact O-N 3.33Å
564M93.4Very high93.3Very high71 Ų7146.1 Ų46.135%0.3522%0.222SC..Hα-helixtrans-68.8-36.7176.3-77.3-69147.200112.2W293 G562 I567 I568W293-M564 HydrophobicContact CD2-CB 4.09Å; W293-M564 VanDerWaalsContact CE2-CB 3.44Å; W293-M564 HydrophobicContact CH2-CB 4.12Å; W293-M564 HydrophobicContact CH2-CG 3.68Å; W293-M564 HydrophobicContact CZ2-CB 3.48Å; W293-M564 VanDerWaalsContact CZ2-CB 3.48Å; W293-M564 HydrophobicContact CZ2-CG 3.45Å; W293-M564 VanDerWaalsContact CZ2-CG 3.45Å; W293-M564 HydrophobicContact CZ3-CG 4.35Å; G562-M564 VanDerWaalsContact C-N 3.3Å; G562-M564 PolarHBondContact O-N 3.25Å; M564-I567 HydrophobicContact CE-CD1 4.25Å; M564-I567 PolarHBondContact O-N 3.01Å; M564-I567 HydrophobicContact SD-CD1 4.41Å; M564-I568 WeakPolarHBondContact O-CB 3.41Å; M564-I568 WeakPolarHBondContact O-CD1 3.35Å; M564-I568 VanDerWaalsContact O-CG1 3.25Å; M564-I568 WeakPolarHBondContact O-CG1 3.31Å; M564-I568 PolarHBondContact O-N 2.94Å
565L93.4Very high93.4Very high0 Ų043.8 Ų43.80%022%0.216CC..Hα-helixtrans-65.3-36.6175.2-72.7166.6000112.8Y236 S290 F535 A561 G562 I568 G569Y236-L565 HydrophobicContact CD1-CD1 4.41Å; Y236-L565 HydrophobicContact CD2-CD1 3.11Å; Y236-L565 HydrophobicContact CE2-CD1 3.24Å; Y236-L565 HydrophobicContact CG-CD1 3.73Å; S290-L565 WeakPolarHBondContact OG-CD2 3.42Å; F535-L565 HydrophobicContact CB-CB 4.38Å; F535-L565 HydrophobicContact CD2-CB 3.4Å; F535-L565 HydrophobicContact CE2-CB 3.91Å; F535-L565 HydrophobicContact CG-CB 4.13Å; A561-L565 WeakPolarHBondContact O-CG 3.36Å; A561-L565 PolarHBondContact O-N 3.46Å; G562-L565 CarbonylContact O-C 3.54Å; G562-L565 WeakPolarHBondContact O-CB 3.47Å; G562-L565 PolarHBondContact O-N 2.91Å; G562-L565 VanDerWaalsContact O-N 3.08Å; L565-I568 PolarHBondContact O-N 3.28Å; L565-G569 PolarHBondContact O-N 3.39Å
566N94.4Very high93.6Very high10 Ų1040.4 Ų40.45%0.05320%0.195CC..Hα-helixtrans-62.6-44.6174.3-73.40.4000110.6E494 L533 F535 G562 F563 G569 I570E494-N566 PolarHBondContact OE1-ND2 3.08Å; L533-N566 PolarHBondContact O-OD1 3.31Å; F535-N566 WeakPolarHBondContact CD2-OD1 3.42Å; G562-N566 PolarHBondContact O-N 3.38Å; G562-N566 PolarHBondContact O-OD1 3.48Å; F563-N566 PolarHBondContact O-N 3.21Å; N566-G569 PolarHBondContact O-N 3.45Å; N566-I570 WeakPolarHBondContact O-CD1 3.42Å; N566-I570 VanDerWaalsContact O-CG1 3.25Å; N566-I570 WeakPolarHBondContact O-CG1 3.29Å; N566-I570 PolarHBondContact O-N 3.1Å
567I94.4Very high93.8Very high64 Ų6435.1 Ų35.133%0.32817%0.168SC..Hα-helixtrans-60.9-49.8175-65.7171.9000110.7F563 M564 G569 I570 L571F563-I567 HydrophobicContact CD1-CD1 4.12Å; F563-I567 HydrophobicContact CE1-CD1 3.57Å; F563-I567 HydrophobicContact CZ-CD1 3.83Å; F563-I567 PolarHBondContact O-N 3.33Å; M564-I567 HydrophobicContact CE-CD1 4.25Å; M564-I567 PolarHBondContact O-N 3.01Å; M564-I567 HydrophobicContact SD-CD1 4.41Å; I567-G569 VanDerWaalsContact C-N 3.32Å; I567-G569 PolarHBondContact O-N 3.33Å; I567-I570 PolarHBondContact O-N 3.12Å; I567-L571 HydrophobicContact CG2-CD1 3.91Å; I567-L571 HydrophobicContact CG2-CG 4.42Å; I567-L571 WeakPolarHBondContact O-CB 3.4Å; I567-L571 VanDerWaalsContact O-CG 3.29Å; I567-L571 WeakPolarHBondContact O-CG 3.48Å; I567-L571 PolarHBondContact O-N 3.45Å
568I94.1Very high94Very high27 Ų2736.5 Ų36.514%0.13818%0.176CC..Hα-helixtrans-56.4-47.7177.9-72160.7000110.4I289 W293 M564 L565 L571 C572I289-I568 HydrophobicContact CB-CG2 3.88Å; I289-I568 HydrophobicContact CG2-CB 4.42Å; I289-I568 HydrophobicContact CG2-CD1 3.99Å; I289-I568 HydrophobicContact CG2-CG1 4.03Å; I289-I568 HydrophobicContact CG2-CG2 3.49Å; I289-I568 VanDerWaalsContact CG2-CG2 3.49Å; W293-I568 HydrophobicContact CB-CD1 4.01Å; W293-I568 HydrophobicContact CG-CD1 4.16Å; M564-I568 WeakPolarHBondContact O-CB 3.41Å; M564-I568 WeakPolarHBondContact O-CD1 3.35Å; M564-I568 VanDerWaalsContact O-CG1 3.25Å; M564-I568 WeakPolarHBondContact O-CG1 3.31Å; M564-I568 PolarHBondContact O-N 2.94Å; L565-I568 PolarHBondContact O-N 3.28Å; I568-L571 PolarHBondContact O-N 3.01Å; I568-C572 WeakPolarHBondContact O-CB 3.38Å; I568-C572 PolarHBondContact O-N 2.78Å; I568-C572 PolarHBondContact O-SG 2.85Å
569G95.1Very high94Very high0 Ų039.2 Ų39.20%019%0.193CC..Hα-helixtrans-63.5-45.9-178.500000112.3L565 N566 I567 L571 C572 I573L565-G569 PolarHBondContact O-N 3.39Å; N566-G569 PolarHBondContact O-N 3.45Å; I567-G569 VanDerWaalsContact C-N 3.32Å; I567-G569 PolarHBondContact O-N 3.33Å; G569-L571 VanDerWaalsContact C-N 3.3Å; G569-L571 PolarHBondContact O-N 2.86Å; G569-C572 PolarHBondContact O-N 2.93Å; G569-I573 WeakPolarHBondContact O-CB 3.4Å; G569-I573 WeakPolarHBondContact O-CD1 3.36Å; G569-I573 WeakPolarHBondContact O-CG1 3.41Å; G569-I573 PolarHBondContact O-N 3.46Å
570I95.6Very high94Very high9 Ų941 Ų415%0.04620%0.195CC..Hα-helixtrans-61-40.5176.7-67.5164.6000111.1I483 L487 A490 N566 I567 N574I483-I570 HydrophobicContact CG2-CG2 4.41Å; L487-I570 HydrophobicContact CB-CD1 4.19Å; L487-I570 HydrophobicContact CD1-CD1 3.83Å; A490-I570 HydrophobicContact CB-CD1 4.09Å; N566-I570 WeakPolarHBondContact O-CD1 3.42Å; N566-I570 VanDerWaalsContact O-CG1 3.25Å; N566-I570 WeakPolarHBondContact O-CG1 3.29Å; N566-I570 PolarHBondContact O-N 3.1Å; I567-I570 PolarHBondContact O-N 3.12Å; I570-N574 WeakPolarHBondContact O-CB 3.34Å; I570-N574 PolarHBondContact O-N 2.68Å; I570-N574 PolarHBondContact O-ND2 3.36Å
571L94.9Very high94.1Very high103 Ų10332.8 Ų32.854%0.53916%0.164SC..Hα-helixtrans-67.9-41.9176.9-69.4175.6000112.2I567 I568 G569 N574 L575I567-L571 HydrophobicContact CG2-CD1 3.91Å; I567-L571 HydrophobicContact CG2-CG 4.42Å; I567-L571 WeakPolarHBondContact O-CB 3.4Å; I567-L571 VanDerWaalsContact O-CG 3.29Å; I567-L571 WeakPolarHBondContact O-CG 3.48Å; I567-L571 PolarHBondContact O-N 3.45Å; I568-L571 PolarHBondContact O-N 3.01Å; G569-L571 VanDerWaalsContact C-N 3.3Å; G569-L571 PolarHBondContact O-N 2.86Å; L571-N574 PolarHBondContact O-N 2.98Å; L571-L575 WeakPolarHBondContact O-CB 3.46Å; L571-L575 PolarHBondContact O-N 2.91Å
572C95.3Very high94Very high5 Ų537.5 Ų37.53%0.03418%0.182CC..Hα-helixtrans-62.4-46.1176.3-67.30000111.4N282 L285 M286 I568 G569 N574 L575 G576N282-C572 PolarHBondContact OD1-O 2.98Å; N282-C572 VanDerWaalsContact OD1-O 3.12Å; L285-C572 HydrophobicContact CD2-CB 4.06Å; L285-C572 HydrophobicContact CG-CB 4.47Å; M286-C572 HydrophobicContact CB-CB 4.48Å; I568-C572 WeakPolarHBondContact O-CB 3.38Å; I568-C572 PolarHBondContact O-N 2.78Å; I568-C572 PolarHBondContact O-SG 2.85Å; G569-C572 PolarHBondContact O-N 2.93Å; C572-N574 VanDerWaalsContact C-N 3.33Å; C572-N574 PolarHBondContact O-N 3.05Å; C572-L575 WeakPolarHBondContact O-CB 3.48Å; C572-L575 PolarHBondContact O-N 3.39Å; C572-G576 PolarHBondContact O-N 3.32Å
573I94.9Very high93.9Very high0 Ų043.2 Ų43.20%022%0.217CC..Hα-helixtrans-59.3-46.1176.5-70.7163.9000110.4N282 P526 I529 L533 G569 L575 G576 I577N282-I573 WeakPolarHBondContact ND2-CG1 3.41Å; N282-I573 PolarHBondContact OD1-N 3.1Å; P526-I573 VanDerWaalsContact CA-CG2 3.4Å; P526-I573 HydrophobicContact CB-CG2 3.21Å; I529-I573 HydrophobicContact CB-CD1 3.76Å; I529-I573 HydrophobicContact CB-CG1 4.15Å; I529-I573 HydrophobicContact CG2-CD1 3.51Å; I529-I573 HydrophobicContact CG2-CG1 3.82Å; L533-I573 HydrophobicContact CD1-CD1 3.76Å; G569-I573 WeakPolarHBondContact O-CB 3.4Å; G569-I573 WeakPolarHBondContact O-CD1 3.36Å; G569-I573 WeakPolarHBondContact O-CG1 3.41Å; G569-I573 PolarHBondContact O-N 3.46Å; I573-L575 VanDerWaalsContact C-N 3.34Å; I573-L575 PolarHBondContact O-N 3.07Å; I573-G576 PolarHBondContact O-N 3.04Å; I573-I577 PolarHBondContact O-N 3.43Å
574N94.1Very high93.7Very high11 Ų1142 Ų426%0.05921%0.214CC..Hα-helixtrans-67.8-34.4179.1-88-80.7000112.7S482 I483 I570 L571 C572 I577 N578S482-N574 WeakPolarHBondContact CB-OD1 3.35Å; S482-N574 PolarHBondContact OG-OD1 2.94Å; I483-N574 HydrophobicContact CG1-CB 4.24Å; I483-N574 WeakPolarHBondContact CG1-ND2 3.33Å; I483-N574 WeakPolarHBondContact CG1-OD1 3.29Å; I570-N574 WeakPolarHBondContact O-CB 3.34Å; I570-N574 PolarHBondContact O-N 2.68Å; I570-N574 PolarHBondContact O-ND2 3.36Å; L571-N574 PolarHBondContact O-N 2.98Å; C572-N574 VanDerWaalsContact C-N 3.33Å; C572-N574 PolarHBondContact O-N 3.05Å; N574-I577 WeakPolarHBondContact O-CG2 3.48Å; N574-N578 WeakPolarHBondContact O-CB 3.38Å; N574-N578 PolarHBondContact O-N 2.96Å; N574-N578 VanDerWaalsContact O-N 3.17Å; N574-N578 PolarHBondContact O-ND2 2.9Å
575L94.8Very high93.6Very high89 Ų8939.4 Ų39.447%0.46620%0.2SC..Hα-helixtrans-62.2-47.1170.5-178.265.4000110.1L285 L571 C572 I573 N578 T579L285-L575 HydrophobicContact CD2-CD2 3.9Å; L571-L575 WeakPolarHBondContact O-CB 3.46Å; L571-L575 PolarHBondContact O-N 2.91Å; C572-L575 WeakPolarHBondContact O-CB 3.48Å; C572-L575 PolarHBondContact O-N 3.39Å; I573-L575 VanDerWaalsContact C-N 3.34Å; I573-L575 PolarHBondContact O-N 3.07Å; L575-N578 PolarHBondContact O-N 3.15Å; L575-T579 HydrophobicContact CD1-CG2 3.87Å; L575-T579 HydrophobicContact CG-CG2 4.48Å; L575-T579 WeakPolarHBondContact O-CB 3.49Å; L575-T579 VanDerWaalsContact O-CG2 3.3Å; L575-T579 WeakPolarHBondContact O-CG2 3.1Å; L575-T579 PolarHBondContact O-N 3.01Å; L575-T579 PolarHBondContact O-OG1 3.4Å
576G94.3Very high93.3Very high0 Ų044.3 Ų44.30%023%0.227CC..Hα-helixtrans-62.5-46.2-179.900000113.9C572 I573 N578 T579 W580 G581C572-G576 PolarHBondContact O-N 3.32Å; I573-G576 PolarHBondContact O-N 3.04Å; G576-N578 VanDerWaalsContact C-N 3.33Å; G576-N578 PolarHBondContact O-N 3.37Å; G576-T579 PolarHBondContact O-N 2.99Å; G576-W580 PolarHBondContact O-N 3.14Å; G576-G581 WeakPolarHBondContact O-CA 3.28Å; G576-G581 PolarHBondContact O-N 3.27Å
577I94.4Very high92.9Very high0 Ų044.4 Ų44.40%023%0.227CC..Hα-helixtrans-66.1-34.8179.8-156.471.4000112.1F278 Y522 L525 I573 N574 Y582 M587F278-I577 HydrophobicContact CE2-CB 4.46Å; F278-I577 HydrophobicContact CE2-CD1 3.83Å; F278-I577 HydrophobicContact CZ-CB 4.43Å; F278-I577 HydrophobicContact CZ-CD1 3.71Å; Y522-I577 HydrophobicContact CD2-CG1 4.36Å; L525-I577 HydrophobicContact CB-CD1 4.05Å; L525-I577 HydrophobicContact CD1-CD1 3.89Å; I573-I577 PolarHBondContact O-N 3.43Å; N574-I577 WeakPolarHBondContact O-CG2 3.48Å; I577-Y582 WeakPolarHBondContact O-CB 3.4Å; I577-Y582 PolarHBondContact O-N 3.06Å; I577-M587 HydrophobicContact CD1-CE 3.33Å; I577-M587 HydrophobicContact CD1-SD 3.78Å; I577-M587 HydrophobicContact CG1-CE 4.13Å; I577-M587 HydrophobicContact CG1-SD 3.89Å
578N93.4Very high92.2Very high63 Ų6343.3 Ų43.334%0.33723%0.232SC..Hα-helixtrans-89-2.4-179.5-73.2-76.1000114.3Y522 N574 L575 G576Y522-N578 PolarHBondContact OH-OD1 3.44Å; N574-N578 WeakPolarHBondContact O-CB 3.38Å; N574-N578 PolarHBondContact O-N 2.96Å; N574-N578 VanDerWaalsContact O-N 3.17Å; N574-N578 PolarHBondContact O-ND2 2.9Å; L575-N578 PolarHBondContact O-N 3.15Å; G576-N578 VanDerWaalsContact C-N 3.33Å; G576-N578 PolarHBondContact O-N 3.37Å
579T93.8Very high91.7Very high58 Ų5845.9 Ų45.936%0.35625%0.249SC..THydrogen-bonded Turntrans-118-94.917956.70000110.9L575 G576 Y582 V583L575-T579 HydrophobicContact CD1-CG2 3.87Å; L575-T579 HydrophobicContact CG-CG2 4.48Å; L575-T579 WeakPolarHBondContact O-CB 3.49Å; L575-T579 VanDerWaalsContact O-CG2 3.3Å; L575-T579 WeakPolarHBondContact O-CG2 3.1Å; L575-T579 PolarHBondContact O-N 3.01Å; L575-T579 PolarHBondContact O-OG1 3.4Å; G576-T579 PolarHBondContact O-N 2.99Å; T579-Y582 PolarHBondContact O-N 3.06Å; T579-V583 PolarHBondContact O-N 3.24Å
580W94.3Very high91.3Very high75 Ų7548 Ų4828%0.28426%0.258SS..Hα-helixtrans-71.5-34.3-17763.789.8000112.5F278 P281 N282 L285 G576 Y582 V583 M584F278-W580 AromaticContact CD2-NE1 3.76Å; F278-W580 PolarHBondContact O-NE1 3.3Å; F278-W580 VanDerWaalsContact O-NE1 3.1Å; P281-W580 HydrophobicContact CB-CZ2 4.1Å; N282-W580 HydrophobicContact CB-CZ2 4.03Å; L285-W580 HydrophobicContact CD2-CH2 4.45Å; G576-W580 PolarHBondContact O-N 3.14Å; W580-Y582 VanDerWaalsContact C-N 3.32Å; W580-Y582 PolarHBondContact O-N 2.91Å; W580-V583 PolarHBondContact O-N 3.47Å; W580-M584 WeakPolarHBondContact O-CB 3.45Å; W580-M584 PolarHBondContact O-N 3.45Å
581G91.8Very high90.9Very high0 Ų048.2 Ų48.20%026%0.26CS..Hα-helixtrans-62.2-40.4175.600000112.2G576 V583 M584 F585G576-G581 WeakPolarHBondContact O-CA 3.28Å; G576-G581 PolarHBondContact O-N 3.27Å; G581-V583 VanDerWaalsContact C-N 3.34Å; G581-V583 PolarHBondContact O-N 3.48Å; G581-M584 PolarHBondContact O-N 3Å; G581-F585 WeakPolarHBondContact O-CD2 3.3Å; G581-F585 PolarHBondContact O-N 3.49Å; G581-F585 VanDerWaalsContact O-N 3.09Å
582Y90.7Very high90.4Very high99 Ų9952 Ų5239%0.38828%0.275SS..Hα-helixtrans-59.6-45178.4-167-90.6000111.9Y522 I577 T579 W580 D586 M587 G588Y522-Y582 HydrophobicContact CE2-CD2 4.21Å; I577-Y582 WeakPolarHBondContact O-CB 3.4Å; I577-Y582 PolarHBondContact O-N 3.06Å; T579-Y582 PolarHBondContact O-N 3.06Å; W580-Y582 VanDerWaalsContact C-N 3.32Å; W580-Y582 PolarHBondContact O-N 2.91Å; Y582-D586 WeakPolarHBondContact O-CA 3.47Å; Y582-D586 PolarHBondContact O-N 3.2Å; Y582-M587 HydrophobicContact CD2-CB 3.66Å; Y582-M587 HydrophobicContact CE2-CB 4Å; Y582-M587 HydrophobicContact CG-CB 4.19Å; Y582-M587 PolarHBondContact O-N 3.41Å; Y582-G588 VanDerWaalsContact CZ-CA 3.46Å; Y582-G588 WeakPolarHBondContact OH-CA 3.27Å
583V90.9Very high89.9Confident120 Ų12054 Ų5473%0.72728%0.282SS*.Hα-helixtrans-73.6-42.4178.9178.10000111.4T579 W580 G581 F585 D586T579-V583 PolarHBondContact O-N 3.24Å; W580-V583 PolarHBondContact O-N 3.47Å; G581-V583 VanDerWaalsContact C-N 3.34Å; G581-V583 PolarHBondContact O-N 3.48Å; V583-F585 VanDerWaalsContact C-N 3.3Å; V583-F585 PolarHBondContact O-N 3.49Å; V583-D586 PolarHBondContact O-N 3.16Å
584M90.3Very high89.4Confident77 Ų7754 Ų5438%0.37928%0.282SS..Hα-helixtrans-67.2-31.6-174.3-167.6175.479.900113S274 F278 W580 G581S274-M584 VanDerWaalsContact O-CE 3.22Å; S274-M584 WeakPolarHBondContact O-CE 3.32Å; F278-M584 HydrophobicContact CB-CE 3.65Å; W580-M584 WeakPolarHBondContact O-CB 3.45Å; W580-M584 PolarHBondContact O-N 3.45Å; G581-M584 PolarHBondContact O-N 3Å
585F90.3Very high88.6Confident17 Ų1756.2 Ų56.28%0.07529%0.294CS..THydrogen-bonded Turntrans-111.110.4-178.5-62.8-63.4000113.5V269 I270 F278 L521 L525 G581 V583 M587V269-F585 HydrophobicContact CG1-CD1 3.57Å; V269-F585 HydrophobicContact CG1-CE1 3.88Å; I270-F585 HydrophobicContact CD1-CE1 3.64Å; I270-F585 HydrophobicContact CD1-CZ 3.57Å; F278-F585 HydrophobicContact CB-CE2 4.08Å; F278-F585 HydrophobicContact CB-CZ 4.42Å; F278-F585 HydrophobicContact CD2-CE2 4.28Å; F278-F585 HydrophobicContact CG-CE2 4.21Å; L521-F585 HydrophobicContact CD1-CB 4.33Å; L521-F585 HydrophobicContact CD1-CD1 3.79Å; L521-F585 HydrophobicContact CD1-CE1 4.13Å; L521-F585 HydrophobicContact CD1-CG 3.99Å; L525-F585 HydrophobicContact CD1-CD2 3.95Å; L525-F585 HydrophobicContact CD1-CE2 3.52Å; L525-F585 HydrophobicContact CD1-CZ 4.2Å; G581-F585 WeakPolarHBondContact O-CD2 3.3Å; G581-F585 PolarHBondContact O-N 3.49Å; G581-F585 VanDerWaalsContact O-N 3.09Å; V583-F585 VanDerWaalsContact C-N 3.3Å; V583-F585 PolarHBondContact O-N 3.49Å; F585-M587 VanDerWaalsContact C-N 3.3Å; F585-M587 HydrophobicContact CB-CE 3.81Å; F585-M587 HydrophobicContact CB-CG 3.9Å; F585-M587 HydrophobicContact CD2-CE 3.5Å; F585-M587 HydrophobicContact CE2-CE 4.41Å; F585-M587 HydrophobicContact CG-CE 4.03Å; F585-M587 PolarHBondContact O-N 2.71Å
586D87.2Confident87.1Confident103 Ų10355 Ų5555%0.55129%0.288SS*.THydrogen-bonded Turntrans46.749.7-176.8-166.929.3000113.6Y582 V583 G588 T589Y582-D586 WeakPolarHBondContact O-CA 3.47Å; Y582-D586 PolarHBondContact O-N 3.2Å; V583-D586 PolarHBondContact O-N 3.16Å; D586-G588 PolarHBondContact O-N 3.47Å; D586-T589 PolarHBondContact O-N 3.42Å
587M85.9Confident84.9Confident12 Ų1260.2 Ų60.26%0.05932%0.32CS..THydrogen-bonded Turntrans-71.20.9-170.8-62.2-176.1168.600114.5L521 Y522 L525 I577 Y582 F585 T589L521-M587 HydrophobicContact CB-CE 3.93Å; Y522-M587 HydrophobicContact CD2-CB 4.07Å; Y522-M587 HydrophobicContact CD2-CG 4.43Å; Y522-M587 HydrophobicContact CD2-SD 3.64Å; Y522-M587 HydrophobicContact CE2-SD 4.47Å; Y522-M587 HydrophobicContact CG-SD 4.39Å; L525-M587 HydrophobicContact CD1-CE 3.84Å; I577-M587 HydrophobicContact CD1-CE 3.33Å; I577-M587 HydrophobicContact CD1-SD 3.78Å; I577-M587 HydrophobicContact CG1-CE 4.13Å; I577-M587 HydrophobicContact CG1-SD 3.89Å; Y582-M587 HydrophobicContact CD2-CB 3.66Å; Y582-M587 HydrophobicContact CE2-CB 4Å; Y582-M587 HydrophobicContact CG-CB 4.19Å; Y582-M587 PolarHBondContact O-N 3.41Å; F585-M587 VanDerWaalsContact C-N 3.3Å; F585-M587 HydrophobicContact CB-CE 3.81Å; F585-M587 HydrophobicContact CB-CG 3.9Å; F585-M587 HydrophobicContact CD2-CE 3.5Å; F585-M587 HydrophobicContact CE2-CE 4.41Å; F585-M587 HydrophobicContact CG-CE 4.03Å; F585-M587 PolarHBondContact O-N 2.71Å; M587-T589 VanDerWaalsContact C-N 3.33Å
588G79.4Confident82.1Confident42 Ų4267.8 Ų67.843%0.43336%0.355SS..THydrogen-bonded Turntrans-78.4-16.8178.100000114.3Y582 D586Y582-G588 VanDerWaalsContact CZ-CA 3.46Å; Y582-G588 WeakPolarHBondContact OH-CA 3.27Å; D586-G588 PolarHBondContact O-N 3.47Å
589T84.1Confident79.3Confident81 Ų8169.8 Ų69.850%0.49737%0.374SS..SBendtrans-118147.817665.90000110.7D586 M587 P591D586-T589 PolarHBondContact O-N 3.42Å; M587-T589 VanDerWaalsContact C-N 3.33Å; T589-P591 WeakPolarHBondContact O-CD 3.37Å
590F86.8Confident76.1Confident45 Ų4576.2 Ų76.220%0.19740%0.397CS..  trans-74.4120.9170.3-173.8-101.8000108.2T514 Q517 V518 A594 N595T514-F590 HydrophobicContact CG2-CZ 4.41Å; Q517-F590 VanDerWaalsContact C-CD2 3.42Å; Q517-F590 HydrophobicContact CB-CD2 4.49Å; V518-F590 WeakPolarHBondContact O-CE2 3.23Å; F590-A594 HydrophobicContact CE1-CB 4.03Å; F590-A594 HydrophobicContact CE2-CB 4.09Å; F590-A594 HydrophobicContact CZ-CB 3.59Å; F590-A594 WeakPolarHBondContact CZ-O 3.46Å; F590-N595 HydrophobicContact CE1-CB 4Å
591P87.7Confident73.1Confident13 Ų1382.3 Ų82.38%0.08445%0.446CS..  trans-73143.9-170.826.7-31.6000111.5T589 W593 A594T589-P591 WeakPolarHBondContact O-CD 3.37Å; P591-W593 VanDerWaalsContact C-N 3.27Å; P591-W593 HydrophobicContact CB-CD2 3.94Å; P591-W593 VanDerWaalsContact CB-CE2 3.42Å; P591-W593 HydrophobicContact CB-CG 4.11Å; P591-W593 HydrophobicContact CB-CZ2 3.86Å; P591-W593 VanDerWaalsContact CB-NE1 3.28Å; P591-W593 HydrophobicContact CG-CD2 4.05Å; P591-W593 HydrophobicContact CG-CE3 4.44Å; P591-W593 HydrophobicContact CG-CH2 3.96Å; P591-W593 HydrophobicContact CG-CZ2 3.5Å; P591-W593 VanDerWaalsContact CG-CZ2 3.5Å; P591-W593 HydrophobicContact CG-CZ3 4.4Å; P591-W593 PolarHBondContact O-N 3.15Å; P591-A594 HydrophobicContact CG-CB 3.76Å; P591-A594 PolarHBondContact O-N 2.71Å; P591-A594 VanDerWaalsContact O-N 3.07Å
592Q84.4Confident72.2Confident183 Ų18386.5 Ų86.586%0.85547%0.469SS*.G310 helixtrans-60.8-36.6-179.6-67.7-178.6-4.600112.4A594 N595Q592-A594 PolarHBondContact O-N 3.27Å; Q592-N595 WeakPolarHBondContact O-CB 3.3Å; Q592-N595 PolarHBondContact O-N 3.37Å
593W85.4Confident71.2Confident45 Ų4585.8 Ų85.817%0.1747%0.473CS..G310 helixtrans-66.7-16.1178.157.7-108.3000114F263 E265 N266 V269 H519 P520 P591F263-W593 HydrophobicContact CB-CE3 3.68Å; F263-W593 HydrophobicContact CB-CZ3 3.71Å; F263-W593 AromaticContact CD1-CE3 3.99Å; F263-W593 HydrophobicContact CD1-CE3 3.99Å; F263-W593 AromaticContact CD1-CZ3 3.85Å; F263-W593 HydrophobicContact CD1-CZ3 3.85Å; F263-W593 AromaticContact CD2-CZ3 3.9Å; F263-W593 HydrophobicContact CD2-CZ3 3.9Å; F263-W593 HydrophobicContact CE1-CZ3 4.44Å; F263-W593 HydrophobicContact CE2-CZ3 4.49Å; F263-W593 AromaticContact CG-CE3 3.87Å; F263-W593 HydrophobicContact CG-CE3 3.87Å; F263-W593 AromaticContact CG-CZ3 3.54Å; F263-W593 HydrophobicContact CG-CZ3 3.54Å; E265-W593 HydrophobicContact CB-CB 4.15Å; E265-W593 WeakPolarHBondContact O-CB 3.39Å; N266-W593 HydrophobicContact CB-CD2 3.91Å; N266-W593 HydrophobicContact CB-CE3 3.89Å; N266-W593 HydrophobicContact CB-CG 4.3Å; N266-W593 HydrophobicContact CB-CZ3 4.32Å; V269-W593 HydrophobicContact CG2-CZ2 4.23Å; H519-W593 AromaticContact CE1-CH2 3.92Å; H519-W593 AromaticContact CE1-CZ2 3.61Å; H519-W593 AromaticContact NE2-CZ2 3.78Å; P520-W593 HydrophobicContact CB-CH2 4.42Å; P520-W593 HydrophobicContact CG-CH2 4.12Å; P520-W593 HydrophobicContact CG-CZ3 4.07Å; P591-W593 VanDerWaalsContact C-N 3.27Å; P591-W593 HydrophobicContact CB-CD2 3.94Å; P591-W593 VanDerWaalsContact CB-CE2 3.42Å; P591-W593 HydrophobicContact CB-CG 4.11Å; P591-W593 HydrophobicContact CB-CZ2 3.86Å; P591-W593 VanDerWaalsContact CB-NE1 3.28Å; P591-W593 HydrophobicContact CG-CD2 4.05Å; P591-W593 HydrophobicContact CG-CE3 4.44Å; P591-W593 HydrophobicContact CG-CH2 3.96Å; P591-W593 HydrophobicContact CG-CZ2 3.5Å; P591-W593 VanDerWaalsContact CG-CZ2 3.5Å; P591-W593 HydrophobicContact CG-CZ3 4.4Å; P591-W593 PolarHBondContact O-N 3.15Å
594A83.7Confident70.1Confident1 Ų183.9 Ų83.91%0.00846%0.459CS..G310 helixtrans-94.6-3.8174.800000112.7F263 P520 F590 P591 Q592 N596F263-A594 HydrophobicContact CD1-CB 4.14Å; F263-A594 HydrophobicContact CE1-CB 3.96Å; P520-A594 HydrophobicContact CG-CB 3.71Å; F590-A594 HydrophobicContact CE1-CB 4.03Å; F590-A594 HydrophobicContact CE2-CB 4.09Å; F590-A594 HydrophobicContact CZ-CB 3.59Å; F590-A594 WeakPolarHBondContact CZ-O 3.46Å; P591-A594 HydrophobicContact CG-CB 3.76Å; P591-A594 PolarHBondContact O-N 2.71Å; P591-A594 VanDerWaalsContact O-N 3.07Å; Q592-A594 PolarHBondContact O-N 3.27Å; A594-N596 PolarHBondContact O-N 3.04Å; A594-N596 VanDerWaalsContact O-N 3.08Å
595N77.1Confident68.9Low58 Ų5884.3 Ų84.331%0.3146%0.463SS..  trans-84.882.2-177-166.411000110.9F590 Q592 T597F590-N595 HydrophobicContact CE1-CB 4Å; Q592-N595 WeakPolarHBondContact O-CB 3.3Å; Q592-N595 PolarHBondContact O-N 3.37Å; N595-T597 VanDerWaalsContact CG-OG1 3.24Å; N595-T597 PolarHBondContact ND2-OG1 3.5Å; N595-T597 PolarHBondContact O-N 3.17Å; N595-T597 PolarHBondContact OD1-OG1 3.41Å
596N62.6Low67.6Low63 Ų6388.5 Ų88.534%0.33749%0.488SS..G310 helixtrans-70.914.7-178.8-66.30000114.2A594 H598A594-N596 PolarHBondContact O-N 3.04Å; A594-N596 VanDerWaalsContact O-N 3.08Å; N596-H598 PolarHBondContact O-N 3Å; N596-H598 VanDerWaalsContact O-N 3.16Å
597T48.6Very low66.3Low109 Ų10987.5 Ų87.567%0.66948%0.483SS*.G310 helixtrans-69.1-2.9170.737.70000113.6N595N595-T597 VanDerWaalsContact CG-OG1 3.24Å; N595-T597 PolarHBondContact ND2-OG1 3.5Å; N595-T597 PolarHBondContact O-N 3.17Å; N595-T597 PolarHBondContact OD1-OG1 3.41Å
598H36.7Very low64.9Low160 Ų16092.9 Ų92.974%0.74151%0.514SS*.G310 helixtrans-105.122176.6-74.7-58.5000115.3N596 K600N596-H598 PolarHBondContact O-N 3Å; N596-H598 VanDerWaalsContact O-N 3.16Å; H598-K600 VanDerWaalsContact C-N 3.28Å; H598-K600 PolarHBondContact O-N 3.4Å
599S34.3Very low63.7Low104 Ų10496.8 Ų96.873%0.72752%0.52SS*.  trans-61.297.2162.647.70000108.8
600K25.6Very low62Low194 Ų19498.2 Ų98.284%0.84352%0.522SS*.  trans-53.8138.1173.1-80.4177.2177.6170.70108.2H598H598-K600 VanDerWaalsContact C-N 3.28Å; H598-K600 PolarHBondContact O-N 3.4Å
601P31.5Very low59.8Low203 Ų203103 Ų103100%1.31855%0.551SS**  trans-60.40-176.726.4-35.4000113.4

Retrieved 601 of 601 residues in 583 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).