A0A087WZB5_HUMAN Loading...

Parvin beta

AlphaFold DB , UniProt , Accession A0A087WZB5, Species HUMAN (Homo sapiens, Human), Gene PARVB, Length 289 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
1M36.1Very low40.1Very low246 Ų246129.2 Ų129.2100%1.21274%0.739SS**  0118.70-64.8-157-132.600106.7
2S29.5Very low40.7Very low117 Ų117122.8 Ų122.882%0.81870%0.701SS**PPolyproline II helixtrans-70.3144179.6-53.10000109.8A4S2-A4 PolarHBondContact O-N 3.38Å
3P41.4Very low41.4Very low122 Ų122118.2 Ų118.279%0.79268%0.676SS**PPolyproline II helixtrans-64.6134.3174.3-7.422.9000108.4L5P3-L5 PolarHBondContact O-N 3.41Å
4A36.2Very low42.6Very low98 Ų98120.8 Ų120.881%0.8168%0.68SS**PPolyproline II helixtrans-58.1122.6173.200000108.6S2 V6S2-A4 PolarHBondContact O-N 3.38Å; A4-V6 PolarHBondContact O-N 3.24Å; A4-V6 VanDerWaalsContact O-N 3.14Å
5L37.1Very low44Very low171 Ų171113.1 Ų113.190%0.89564%0.637SS**  trans-61.3115.1170-79.6152.8000106.8P3 D7P3-L5 PolarHBondContact O-N 3.41Å; L5-D7 PolarHBondContact O-N 3.03Å
6V45.8Very low45.8Very low95 Ų95115.7 Ų115.758%0.57664%0.642SS**  trans-54.9124.1164.7-176.30000105.8A4 V8A4-V6 PolarHBondContact O-N 3.24Å; A4-V6 VanDerWaalsContact O-N 3.14Å; V6-V8 HydrophobicContact CB-CG2 4.04Å; V6-V8 HydrophobicContact CG1-CG2 3.85Å; V6-V8 PolarHBondContact O-N 3.23Å
7D40.9Very low47.3Very low171 Ų171114.4 Ų114.491%0.91463%0.63SS**  trans-73.276.7179-135.5-4.1000107.5L5 H9L5-D7 PolarHBondContact O-N 3.03Å; D7-H9 PolarHBondContact O-N 3.35Å
8V43.3Very low48.4Very low54 Ų54114.3 Ų114.333%0.32763%0.628SS.*  trans-79.7116.2177.2-173.50000106.6V6 D12 T13V6-V8 HydrophobicContact CB-CG2 4.04Å; V6-V8 HydrophobicContact CG1-CG2 3.85Å; V6-V8 PolarHBondContact O-N 3.23Å; V8-D12 HydrophobicContact CG1-CB 3.6Å; V8-T13 HydrophobicContact CB-CG2 4.12Å; V8-T13 HydrophobicContact CG1-CG2 3.5Å
9H42.1Very low49.7Very low113 Ų113112.6 Ų112.652%0.52362%0.615SS.*  trans-56.5143.7177.5-158-99000109.2D7 E11 D12D7-H9 PolarHBondContact O-N 3.35Å; H9-E11 PolarHBondContact O-N 3.48Å; H9-D12 HydrophobicContact CB-CB 4.49Å; H9-D12 WeakPolarHBondContact CB-OD2 3.43Å; H9-D12 WeakPolarHBondContact O-CA 3.17Å; H9-D12 WeakPolarHBondContact O-CB 3.29Å; H9-D12 PolarHBondContact O-N 3.44Å
10P41.8Very low51Low92 Ų92111.4 Ų111.460%0.59761%0.605SS**G310 helixtrans-55.8-30-175.6-25.833000114D12 T13P10-D12 VanDerWaalsContact C-N 3.31Å; P10-T13 PolarHBondContact O-N 3.39Å; P10-T13 PolarHBondContact O-OG1 3.37Å
11E47.7Very low52.2Low142 Ų142110.6 Ų110.666%0.66459%0.593SS**G310 helixtrans-75.3-17175.6-62.9-177.9162.100113.4H9 R21H9-E11 PolarHBondContact O-N 3.48Å; E11-R21 PolarHBondContact O-NH1 2.82Å
12D46.9Very low54.4Low52 Ų52100.8 Ų100.828%0.27855%0.547SS..G310 helixtrans-86.6-6.5175.8-65.1-34.2000113.4V8 H9 P10 R21V8-D12 HydrophobicContact CG1-CB 3.6Å; H9-D12 HydrophobicContact CB-CB 4.49Å; H9-D12 WeakPolarHBondContact CB-OD2 3.43Å; H9-D12 WeakPolarHBondContact O-CA 3.17Å; H9-D12 WeakPolarHBondContact O-CB 3.29Å; H9-D12 PolarHBondContact O-N 3.44Å; P10-D12 VanDerWaalsContact C-N 3.31Å; D12-R21 IonicContact OD1-CZ 3.23Å; D12-R21 IonicContact OD1-NH1 3.63Å; D12-R21 PolarHBondContact OD1-NH1 3.05Å; D12-R21 IonicContact OD1-NH2 2.62Å; D12-R21 PolarHBondContact OD1-NH2 3.12Å
13T49.8Very low57Low63 Ų6397.5 Ų97.539%0.38752%0.52SS..SBendtrans-100.1-6.8178.357.80000114.7V8 P10 L15V8-T13 HydrophobicContact CB-CG2 4.12Å; V8-T13 HydrophobicContact CG1-CG2 3.5Å; P10-T13 PolarHBondContact O-N 3.39Å; P10-T13 PolarHBondContact O-OG1 3.37Å; T13-L15 PolarHBondContact O-N 2.86Å; T13-L15 VanDerWaalsContact O-N 3.09Å
14Q58.1Low59.2Low155 Ų15592.2 Ų92.272%0.72449%0.485SS*.  trans-84.383.2177.5-65.3-172.810.600109.9
15L63.1Low61.7Low6 Ų689 Ų893%0.03145%0.454CS..PPolyproline II helixtrans-102.3136.9170.5-65.8175000110.5T13 E19 R21 V158 K160 L165T13-L15 PolarHBondContact O-N 2.86Å; T13-L15 VanDerWaalsContact O-N 3.09Å; L15-E19 WeakPolarHBondContact CA-OE2 3.5Å; L15-E19 HydrophobicContact CB-CB 4.23Å; L15-E19 HydrophobicContact CD2-CB 4.27Å; L15-E19 HydrophobicContact CD2-CG 3.97Å; L15-R21 HydrophobicContact CD1-CB 4.43Å; L15-R21 HydrophobicContact CD2-CB 3.71Å; L15-V158 HydrophobicContact CD1-CB 4.23Å; L15-V158 HydrophobicContact CD1-CG1 3.81Å; L15-K160 HydrophobicContact CB-CB 4.08Å; L15-K160 HydrophobicContact CB-CD 4.29Å; L15-K160 WeakPolarHBondContact O-CD 3.29Å; L15-K160 PolarHBondContact O-NZ 2.79Å; L15-L165 HydrophobicContact CD1-CD2 4.07Å
16E72.6Confident64.1Low154 Ų15484.8 Ų84.872%0.7244%0.437SS*.PPolyproline II helixtrans-68.8162.8165.1-64.5-168.2172.600110.8N18 E19E16-N18 PolarHBondContact O-N 2.84Å; E16-E19 HydrophobicContact CB-CB 4.18Å; E16-E19 PolarHBondContact N-OE2 2.92Å; E16-E19 WeakPolarHBondContact O-CB 3.49Å; E16-E19 PolarHBondContact O-N 3.46Å
17E72.1Confident66.2Low93 Ų9385.2 Ų85.244%0.43544%0.44SS..THydrogen-bonded Turntrans-67.6125.7-176.6-168.664.3-157.100110.6E19 E162 G163E17-E19 VanDerWaalsContact C-N 3.25Å; E17-E162 WeakPolarHBondContact OE1-CA 3.14Å; E17-E162 PolarHBondContact OE1-N 3Å; E17-G163 PolarHBondContact OE1-N 3.35Å; E17-G163 PolarHBondContact OE2-N 3.13Å
18N67.4Low68.6Low113 Ų11377.7 Ų77.760%0.60440%0.401SS*.THydrogen-bonded Turntrans70.95.3-168.6-50.8-69.9000116.1E16 K160E16-N18 PolarHBondContact O-N 2.84Å; N18-K160 WeakPolarHBondContact CA-O 3.41Å; N18-K160 PolarHBondContact N-O 3.34Å
19E72.4Confident70.8Confident82 Ų8279.6 Ų79.638%0.38341%0.405SS..  trans-70.3143.6172.4-163.7-178.317700110.6L15 E16 E17 R159 K160L15-E19 WeakPolarHBondContact CA-OE2 3.5Å; L15-E19 HydrophobicContact CB-CB 4.23Å; L15-E19 HydrophobicContact CD2-CB 4.27Å; L15-E19 HydrophobicContact CD2-CG 3.97Å; E16-E19 HydrophobicContact CB-CB 4.18Å; E16-E19 PolarHBondContact N-OE2 2.92Å; E16-E19 WeakPolarHBondContact O-CB 3.49Å; E16-E19 PolarHBondContact O-N 3.46Å; E17-E19 VanDerWaalsContact C-N 3.25Å; E19-R159 WeakPolarHBondContact O-CA 3.43Å; E19-K160 PolarHBondContact O-N 2.84Å
20E75.8Confident73.2Confident89 Ų8980.2 Ų80.242%0.41641%0.408SS..EExtended strand (participates in β ladder)trans-123.6127.8179.2-179.3174.5140.300109.6V157 V158 R159E20-V157 VanDerWaalsContact CD-CG1 3.46Å; E20-V157 HydrophobicContact CG-CG1 3.46Å; E20-V157 VanDerWaalsContact CG-CG1 3.46Å; E20-V157 WeakPolarHBondContact OE1-CG1 3.14Å; E20-V158 WeakPolarHBondContact CA-O 3.18Å; E20-R159 IonicContact OE2-CZ 3.86Å; E20-R159 VanDerWaalsContact OE2-CZ 3.23Å; E20-R159 IonicContact OE2-NE 2.8Å; E20-R159 PolarHBondContact OE2-NE 3.24Å; E20-R159 VanDerWaalsContact OE2-NE 3.11Å; E20-R159 IonicContact OE2-NH2 2.74Å; E20-R159 PolarHBondContact OE2-NH2 3.49Å
21R76.9Confident75.8Confident94 Ų9478.8 Ų78.836%0.35540%0.395SS..EExtended strand (participates in β ladder)trans-121.9136.2175.2-164.6163.3-177.9-169.4-11.8110.5E11 D12 L15 V157 V158E11-R21 PolarHBondContact O-NH1 2.82Å; D12-R21 IonicContact OD1-CZ 3.23Å; D12-R21 IonicContact OD1-NH1 3.63Å; D12-R21 PolarHBondContact OD1-NH1 3.05Å; D12-R21 IonicContact OD1-NH2 2.62Å; D12-R21 PolarHBondContact OD1-NH2 3.12Å; L15-R21 HydrophobicContact CD1-CB 4.43Å; L15-R21 HydrophobicContact CD2-CB 3.71Å; R21-V157 WeakPolarHBondContact O-CA 3.48Å; R21-V158 PolarHBondContact N-O 2.97Å; R21-V158 PolarHBondContact O-N 3.01Å
22T81Confident78.1Confident40 Ų4076.8 Ų76.825%0.24539%0.394CS..EExtended strand (participates in β ladder)trans-114.3121.7-174-58.90000107.8V155T22-V155 HydrophobicContact CG2-CG1 3.07Å
23M83.9Confident80.4Confident48 Ų4878.6 Ų78.624%0.23640%0.4CS..EExtended strand (participates in β ladder)trans-130.3137.8179.360.8-175.675.200110.3D25 V155 V156 V158M23-D25 PolarHBondContact O-N 3.44Å; M23-V155 CarbonylContact O-C 3.57Å; M23-V155 WeakPolarHBondContact O-CA 3.35Å; M23-V156 HydrophobicContact CG-CB 3.78Å; M23-V156 PolarHBondContact N-O 3.48Å; M23-V156 PolarHBondContact O-N 3.46Å; M23-V158 HydrophobicContact CE-CG2 4Å
24I89.3Confident82.6Confident11 Ų1176 Ų766%0.05638%0.383CS..EExtended strand (participates in β ladder)trans-72.2131.2175.4-58.6177.5000108.3K29 F34 L127 V128 V153I24-K29 HydrophobicContact CB-CG 4.05Å; I24-K29 HydrophobicContact CG2-CG 3.71Å; I24-F34 HydrophobicContact CD1-CE2 3.83Å; I24-F34 HydrophobicContact CD1-CZ 3.53Å; I24-L127 HydrophobicContact CD1-CB 4.23Å; I24-L127 HydrophobicContact CD1-CD2 3.96Å; I24-L127 HydrophobicContact CD1-CG 4.19Å; I24-V128 HydrophobicContact CD1-CG2 3.71Å; I24-V128 HydrophobicContact CG1-CG2 3.52Å; I24-V153 HydrophobicContact CG2-CB 4.15Å; I24-V153 HydrophobicContact CG2-CG1 4.4Å
25D88.4Confident84.5Confident30 Ų3073.2 Ų73.216%0.1637%0.369CS..  trans-55.1132.7174.5-173.8-76.9000110M23 T27 S28 K29 Q154 V156M23-D25 PolarHBondContact O-N 3.44Å; D25-T27 PolarHBondContact O-N 3.18Å; D25-T27 VanDerWaalsContact O-N 3.09Å; D25-T27 VanDerWaalsContact OD1-CB 3.3Å; D25-T27 WeakPolarHBondContact OD1-CB 3.31Å; D25-T27 PolarHBondContact OD1-N 3.05Å; D25-T27 PolarHBondContact OD1-OG1 3.1Å; D25-S28 WeakPolarHBondContact O-CA 3.41Å; D25-S28 WeakPolarHBondContact O-CB 3.42Å; D25-S28 PolarHBondContact O-N 3.15Å; D25-K29 PolarHBondContact O-N 3.33Å; D25-K29 VanDerWaalsContact O-N 3.14Å; D25-Q154 HydrophobicContact CB-CB 3.82Å; D25-Q154 WeakPolarHBondContact CB-O 3.42Å; D25-Q154 PolarHBondContact N-O 2.96Å; D25-V156 HydrophobicContact CB-CG2 4.48Å
26P87.7Confident86.2Confident83 Ų8377.8 Ų77.854%0.53939%0.39SS..Hα-helixtrans-52.9-35-178-27.634.9000113.8S28 K29 E30P26-S28 VanDerWaalsContact C-N 3.31Å; P26-S28 PolarHBondContact O-N 3.26Å; P26-K29 WeakPolarHBondContact O-CB 3.37Å; P26-K29 PolarHBondContact O-N 3.27Å; P26-E30 PolarHBondContact O-N 3.3Å
27T89Confident87.4Confident105 Ų10570.5 Ų70.564%0.64436%0.356SS*.Hα-helixtrans-66.2-35177.9650000112.2D25 E30 D31D25-T27 PolarHBondContact O-N 3.18Å; D25-T27 VanDerWaalsContact O-N 3.09Å; D25-T27 VanDerWaalsContact OD1-CB 3.3Å; D25-T27 WeakPolarHBondContact OD1-CB 3.31Å; D25-T27 PolarHBondContact OD1-N 3.05Å; D25-T27 PolarHBondContact OD1-OG1 3.1Å; T27-E30 PolarHBondContact O-N 3.06Å; T27-D31 PolarHBondContact O-N 2.94Å
28S90.6Very high88.6Confident13 Ų1367.6 Ų67.69%0.09134%0.344CS..Hα-helixtrans-72.3-30.2175.2-640000112.3D25 P26 E30 D31 Q154D25-S28 WeakPolarHBondContact O-CA 3.41Å; D25-S28 WeakPolarHBondContact O-CB 3.42Å; D25-S28 PolarHBondContact O-N 3.15Å; P26-S28 VanDerWaalsContact C-N 3.31Å; P26-S28 PolarHBondContact O-N 3.26Å; S28-E30 VanDerWaalsContact C-N 3.25Å; S28-E30 PolarHBondContact O-N 3.47Å; S28-D31 VanDerWaalsContact O-CB 3.31Å; S28-D31 WeakPolarHBondContact O-CB 3.43Å; S28-D31 PolarHBondContact O-N 2.99Å; S28-Q154 PolarHBondContact OG-N 2.71Å
29K89.8Confident90.1Very high94 Ų9468.6 Ų68.641%0.40934%0.343SS..Hα-helixtrans-66.6-29.9172.4-66.3-170.2178.5-173.80112.5I24 D25 P26 D31 F34 K35I24-K29 HydrophobicContact CB-CG 4.05Å; I24-K29 HydrophobicContact CG2-CG 3.71Å; D25-K29 PolarHBondContact O-N 3.33Å; D25-K29 VanDerWaalsContact O-N 3.14Å; P26-K29 WeakPolarHBondContact O-CB 3.37Å; P26-K29 PolarHBondContact O-N 3.27Å; K29-D31 VanDerWaalsContact C-N 3.3Å; K29-F34 HydrophobicContact CB-CE1 4.47Å; K29-F34 HydrophobicContact CG-CE1 4.4Å; K29-K35 VanDerWaalsContact O-CE 3.29Å; K29-K35 WeakPolarHBondContact O-CE 3.44Å
30E92.9Very high91.3Very high126 Ų12666.1 Ų66.159%0.58933%0.333SS*.THydrogen-bonded Turntrans-79.1-13.6178.4-67.5-55.1130.100113.7P26 T27 S28 K35P26-E30 PolarHBondContact O-N 3.3Å; T27-E30 PolarHBondContact O-N 3.06Å; S28-E30 VanDerWaalsContact C-N 3.25Å; S28-E30 PolarHBondContact O-N 3.47Å; E30-K35 PolarHBondContact O-NZ 2.91Å; E30-K35 IonicContact OE2-NZ 3.83Å; E30-K35 PolarHBondContact OE2-NZ 2.74Å
31D95.8Very high92.4Very high62 Ų6261.9 Ų61.933%0.33231%0.314SS..  trans-58128.3-179.4-175.8-77.5000111.7T27 S28 K29 K33 F34 K35T27-D31 PolarHBondContact O-N 2.94Å; S28-D31 VanDerWaalsContact O-CB 3.31Å; S28-D31 WeakPolarHBondContact O-CB 3.43Å; S28-D31 PolarHBondContact O-N 2.99Å; K29-D31 VanDerWaalsContact C-N 3.3Å; D31-K33 VanDerWaalsContact C-N 3.34Å; D31-K33 PolarHBondContact O-N 3.43Å; D31-K33 WeakPolarHBondContact OD1-CA 3.49Å; D31-K33 VanDerWaalsContact OD1-CB 3.3Å; D31-K33 WeakPolarHBondContact OD1-CB 3.47Å; D31-K33 PolarHBondContact OD1-N 3.42Å; D31-F34 HydrophobicContact CB-CB 3.99Å; D31-F34 PolarHBondContact O-N 3.24Å; D31-F34 PolarHBondContact OD1-N 3.01Å; D31-F34 VanDerWaalsContact OD1-N 3.1Å; D31-K35 PolarHBondContact O-N 3.46Å
32P96.4Very high93.4Very high99 Ų9958.8 Ų58.864%0.64330%0.304SS*.Hα-helixtrans-59.4-38.9-178.5-25.234000114.2K35 E36P32-K35 PolarHBondContact O-N 3.41Å; P32-E36 WeakPolarHBondContact O-CB 3.46Å; P32-E36 PolarHBondContact O-N 3.07Å
33K95.4Very high94.2Very high90 Ų9060.3 Ų60.339%0.39131%0.311SS..Hα-helixtrans-71.7-36.1179.5-64.9-174.3166.1-167.40111.4D31 E36 L37 E149 V151D31-K33 VanDerWaalsContact C-N 3.34Å; D31-K33 PolarHBondContact O-N 3.43Å; D31-K33 WeakPolarHBondContact OD1-CA 3.49Å; D31-K33 VanDerWaalsContact OD1-CB 3.3Å; D31-K33 WeakPolarHBondContact OD1-CB 3.47Å; D31-K33 PolarHBondContact OD1-N 3.42Å; K33-E36 PolarHBondContact O-N 3.17Å; K33-L37 WeakPolarHBondContact O-CB 3.4Å; K33-L37 PolarHBondContact O-N 3.28Å; K33-E149 PolarHBondContact NZ-O 2.92Å; K33-V151 HydrophobicContact CB-CG2 4.01Å
34F97Very high94.9Very high10 Ų1058.3 Ų58.34%0.04430%0.301CS..Hα-helixtrans-62.3-47.6173.4177.3-101.9000111.2I24 K29 D31 E36 L37 V38 L127 L131 V151 V153 L174I24-F34 HydrophobicContact CD1-CE2 3.83Å; I24-F34 HydrophobicContact CD1-CZ 3.53Å; K29-F34 HydrophobicContact CB-CE1 4.47Å; K29-F34 HydrophobicContact CG-CE1 4.4Å; D31-F34 HydrophobicContact CB-CB 3.99Å; D31-F34 PolarHBondContact O-N 3.24Å; D31-F34 PolarHBondContact OD1-N 3.01Å; D31-F34 VanDerWaalsContact OD1-N 3.1Å; F34-E36 VanDerWaalsContact C-N 3.31Å; F34-E36 PolarHBondContact O-N 3.31Å; F34-L37 WeakPolarHBondContact O-CB 3.4Å; F34-L37 PolarHBondContact O-N 3.32Å; F34-V38 HydrophobicContact CD1-CG2 4.44Å; F34-V38 HydrophobicContact CE1-CG2 3.99Å; F34-V38 HydrophobicContact CE2-CG2 4.26Å; F34-V38 HydrophobicContact CZ-CG2 3.9Å; F34-V38 WeakPolarHBondContact O-CG2 3.28Å; F34-V38 PolarHBondContact O-N 3.08Å; F34-L127 HydrophobicContact CE1-CD2 4.45Å; F34-L127 HydrophobicContact CZ-CD2 3.73Å; F34-L131 HydrophobicContact CE2-CD1 3.52Å; F34-L131 HydrophobicContact CZ-CD1 4.01Å; F34-V151 HydrophobicContact CB-CG1 4.31Å; F34-V151 HydrophobicContact CD2-CG1 4.37Å; F34-V153 HydrophobicContact CB-CG1 4.49Å; F34-V153 HydrophobicContact CD2-CG1 3.38Å; F34-V153 HydrophobicContact CE2-CG1 3.78Å; F34-V153 HydrophobicContact CG-CG1 4.08Å; F34-L174 HydrophobicContact CD2-CD1 3.81Å; F34-L174 HydrophobicContact CE2-CD1 3.79Å
35K97.6Very high95.4Very high96 Ų9657.8 Ų57.842%0.41730%0.298SS..Hα-helixtrans-60-41.2175.2-73173.5174.4163.30112.3K29 E30 D31 P32 K39K29-K35 VanDerWaalsContact O-CE 3.29Å; K29-K35 WeakPolarHBondContact O-CE 3.44Å; E30-K35 PolarHBondContact O-NZ 2.91Å; E30-K35 IonicContact OE2-NZ 3.83Å; E30-K35 PolarHBondContact OE2-NZ 2.74Å; D31-K35 PolarHBondContact O-N 3.46Å; P32-K35 PolarHBondContact O-N 3.41Å; K35-K39 VanDerWaalsContact O-CB 3.31Å; K35-K39 WeakPolarHBondContact O-CB 3.34Å; K35-K39 PolarHBondContact O-N 3.4Å
36E97.6Very high95.8Very high102 Ų10257.9 Ų57.948%0.47730%0.298SS..Hα-helixtrans-61.6-45.4174.8-176.5177.9-167.600111.6P32 K33 F34 V38 K39 V40 P148P32-E36 WeakPolarHBondContact O-CB 3.46Å; P32-E36 PolarHBondContact O-N 3.07Å; K33-E36 PolarHBondContact O-N 3.17Å; F34-E36 VanDerWaalsContact C-N 3.31Å; F34-E36 PolarHBondContact O-N 3.31Å; E36-V38 PolarHBondContact O-N 3.12Å; E36-K39 PolarHBondContact O-N 2.86Å; E36-V40 HydrophobicContact CG-CG2 4.25Å; E36-V40 WeakPolarHBondContact O-CB 3.45Å; E36-V40 WeakPolarHBondContact O-CG2 3.38Å; E36-V40 PolarHBondContact O-N 2.88Å; E36-P148 HydrophobicContact CG-CG 4.33Å
37L98.3Very high96.3Very high0 Ų059.8 Ų59.80%030%0.304CS..Hα-helixtrans-58.3-50.1177.517862.3000111.6K33 F34 K39 V40 L41 V135 L147 P148 V151 L174 T175K33-L37 WeakPolarHBondContact O-CB 3.4Å; K33-L37 PolarHBondContact O-N 3.28Å; F34-L37 WeakPolarHBondContact O-CB 3.4Å; F34-L37 PolarHBondContact O-N 3.32Å; L37-K39 VanDerWaalsContact C-N 3.31Å; L37-K39 PolarHBondContact O-N 3.38Å; L37-V40 PolarHBondContact O-N 3.35Å; L37-L41 HydrophobicContact CD1-CD1 3.88Å; L37-L41 HydrophobicContact CD1-CG 4.24Å; L37-L41 HydrophobicContact CG-CD1 4.07Å; L37-L41 WeakPolarHBondContact O-CG 3.35Å; L37-L41 PolarHBondContact O-N 3.12Å; L37-V135 HydrophobicContact CD1-CG2 4.12Å; L37-L147 HydrophobicContact CD1-CD2 3.97Å; L37-P148 HydrophobicContact CB-CG 3.74Å; L37-P148 HydrophobicContact CD1-CG 4.19Å; L37-V151 HydrophobicContact CB-CG2 4.39Å; L37-V151 HydrophobicContact CD2-CB 4.16Å; L37-V151 HydrophobicContact CD2-CG1 3.92Å; L37-V151 HydrophobicContact CD2-CG2 4.33Å; L37-L174 HydrophobicContact CD2-CB 3.88Å; L37-L174 HydrophobicContact CD2-CD1 3.92Å; L37-T175 HydrophobicContact CD1-CG2 3.89Å; L37-T175 HydrophobicContact CD2-CG2 4.05Å
38V98.3Very high96.7Very high32 Ų3256.1 Ų56.119%0.19428%0.282CS..Hα-helixtrans-58.5-46.5178.1173.20000110.2F34 E36 L41 L42 L59 L131F34-V38 HydrophobicContact CD1-CG2 4.44Å; F34-V38 HydrophobicContact CE1-CG2 3.99Å; F34-V38 HydrophobicContact CE2-CG2 4.26Å; F34-V38 HydrophobicContact CZ-CG2 3.9Å; F34-V38 WeakPolarHBondContact O-CG2 3.28Å; F34-V38 PolarHBondContact O-N 3.08Å; E36-V38 PolarHBondContact O-N 3.12Å; V38-L41 PolarHBondContact O-N 3.18Å; V38-L42 VanDerWaalsContact O-CB 3.27Å; V38-L42 WeakPolarHBondContact O-CB 3.41Å; V38-L42 PolarHBondContact O-N 3.29Å; V38-L59 HydrophobicContact CG1-CD1 4.07Å; V38-L131 HydrophobicContact CG2-CD1 4.26Å; V38-L131 HydrophobicContact CG2-CD2 4.15Å
39K98.1Very high97Very high134 Ų13455.5 Ų55.558%0.58328%0.277SS*.Hα-helixtrans-61.6-50179.5-179.5178.3177.3179.80112.2K35 E36 L37 L41 L42 D43K35-K39 VanDerWaalsContact O-CB 3.31Å; K35-K39 WeakPolarHBondContact O-CB 3.34Å; K35-K39 PolarHBondContact O-N 3.4Å; E36-K39 PolarHBondContact O-N 2.86Å; L37-K39 VanDerWaalsContact C-N 3.31Å; L37-K39 PolarHBondContact O-N 3.38Å; K39-L41 VanDerWaalsContact C-N 3.3Å; K39-L41 PolarHBondContact O-N 3.12Å; K39-L42 PolarHBondContact O-N 3.45Å; K39-D43 WeakPolarHBondContact CE-OD2 3.14Å; K39-D43 WeakPolarHBondContact CG-OD2 3.44Å; K39-D43 WeakPolarHBondContact O-CB 3.43Å; K39-D43 VanDerWaalsContact O-CG 3.29Å; K39-D43 PolarHBondContact O-N 3.45Å
40V98.1Very high97.3Very high30 Ų3055.6 Ų55.618%0.18229%0.285CS..Hα-helixtrans-60.5-41.2-178.6166.40000111.3E36 L37 W44 I145 L147E36-V40 HydrophobicContact CG-CG2 4.25Å; E36-V40 WeakPolarHBondContact O-CB 3.45Å; E36-V40 WeakPolarHBondContact O-CG2 3.38Å; E36-V40 PolarHBondContact O-N 2.88Å; L37-V40 PolarHBondContact O-N 3.35Å; V40-W44 VanDerWaalsContact O-CB 3.27Å; V40-W44 WeakPolarHBondContact O-CB 3.23Å; V40-W44 PolarHBondContact O-N 2.91Å; V40-I145 HydrophobicContact CG1-CB 3.9Å; V40-I145 HydrophobicContact CG1-CD1 3.98Å; V40-I145 HydrophobicContact CG1-CG1 4.19Å; V40-L147 HydrophobicContact CG1-CD2 4.2Å
41L98.6Very high97.3Very high0 Ų056.8 Ų56.80%029%0.291CS..Hα-helixtrans-69.2-39.5176.7-69.2171.9000112.2L37 V38 K39 W44 I45 L131 L134 V135 A138 I145 L147L37-L41 HydrophobicContact CD1-CD1 3.88Å; L37-L41 HydrophobicContact CD1-CG 4.24Å; L37-L41 HydrophobicContact CG-CD1 4.07Å; L37-L41 WeakPolarHBondContact O-CG 3.35Å; L37-L41 PolarHBondContact O-N 3.12Å; V38-L41 PolarHBondContact O-N 3.18Å; K39-L41 VanDerWaalsContact C-N 3.3Å; K39-L41 PolarHBondContact O-N 3.12Å; L41-W44 HydrophobicContact CD2-CE3 4.15Å; L41-W44 PolarHBondContact O-N 3.4Å; L41-I45 WeakPolarHBondContact O-CD1 3.31Å; L41-I45 VanDerWaalsContact O-CG1 3.23Å; L41-I45 WeakPolarHBondContact O-CG1 3.32Å; L41-I45 PolarHBondContact O-N 3.24Å; L41-L131 HydrophobicContact CD1-CD2 3.6Å; L41-L134 HydrophobicContact CB-CD1 4.48Å; L41-L134 HydrophobicContact CD1-CB 4.05Å; L41-L134 HydrophobicContact CD2-CB 4.16Å; L41-V135 HydrophobicContact CD1-CG2 4.07Å; L41-A138 HydrophobicContact CD2-CB 4.3Å; L41-I145 HydrophobicContact CD2-CD1 4.36Å; L41-L147 HydrophobicContact CD2-CD2 3.81Å; L41-L147 HydrophobicContact CG-CD2 4.29Å
42L98.5Very high97.2Very high30 Ų3058 Ų5816%0.15729%0.294CS..Hα-helixtrans-64.4-48176.6-176.5151.4000111.5V38 K39 W44 I45 N46 V56 K57 L59V38-L42 VanDerWaalsContact O-CB 3.27Å; V38-L42 WeakPolarHBondContact O-CB 3.41Å; V38-L42 PolarHBondContact O-N 3.29Å; K39-L42 PolarHBondContact O-N 3.45Å; L42-W44 VanDerWaalsContact C-N 3.3Å; L42-W44 PolarHBondContact O-N 3.39Å; L42-I45 PolarHBondContact O-N 3.3Å; L42-N46 VanDerWaalsContact CD2-ND2 3.27Å; L42-N46 WeakPolarHBondContact CD2-ND2 3.46Å; L42-N46 WeakPolarHBondContact O-CB 3.28Å; L42-N46 PolarHBondContact O-N 3.27Å; L42-N46 PolarHBondContact O-ND2 2.97Å; L42-V56 HydrophobicContact CG-CG1 4.48Å; L42-K57 VanDerWaalsContact CD1-O 3.29Å; L42-K57 WeakPolarHBondContact CD1-O 3.47Å; L42-L59 HydrophobicContact CB-CD2 4.4Å
43D97.8Very high97.2Very high71 Ų7164.2 Ų64.238%0.3831%0.305SS..Hα-helixtrans-59.8-43.9177.5-70-16.4000109.9K39 I45 N46 D47K39-D43 WeakPolarHBondContact CE-OD2 3.14Å; K39-D43 WeakPolarHBondContact CG-OD2 3.44Å; K39-D43 WeakPolarHBondContact O-CB 3.43Å; K39-D43 VanDerWaalsContact O-CG 3.29Å; K39-D43 PolarHBondContact O-N 3.45Å; D43-I45 PolarHBondContact O-N 3.18Å; D43-N46 PolarHBondContact O-N 2.91Å; D43-D47 PolarHBondContact O-N 3.49Å
44W98.3Very high97.3Very high7 Ų761.7 Ų61.73%0.02730%0.296CS..Hα-helixtrans-58.5-49.4175.6172.850.7000113.7V40 L41 L42 N46 D47 V48 L72 L76 L137 A138 A143 I145V40-W44 VanDerWaalsContact O-CB 3.27Å; V40-W44 WeakPolarHBondContact O-CB 3.23Å; V40-W44 PolarHBondContact O-N 2.91Å; L41-W44 HydrophobicContact CD2-CE3 4.15Å; L41-W44 PolarHBondContact O-N 3.4Å; L42-W44 VanDerWaalsContact C-N 3.3Å; L42-W44 PolarHBondContact O-N 3.39Å; W44-N46 VanDerWaalsContact C-N 3.29Å; W44-N46 PolarHBondContact O-N 3Å; W44-D47 PolarHBondContact O-N 3.33Å; W44-V48 WeakPolarHBondContact O-CG2 3.4Å; W44-V48 PolarHBondContact O-N 3.12Å; W44-L72 HydrophobicContact CH2-CD2 4.42Å; W44-L72 HydrophobicContact CZ3-CD2 4.43Å; W44-L76 HydrophobicContact CH2-CD1 3.94Å; W44-L76 HydrophobicContact CZ2-CD1 3.77Å; W44-L76 HydrophobicContact CZ2-CD2 4.07Å; W44-L137 HydrophobicContact CH2-CB 4.08Å; W44-A138 HydrophobicContact CE3-CB 4.16Å; W44-A138 HydrophobicContact CH2-CB 3.9Å; W44-A138 HydrophobicContact CZ2-CB 4.34Å; W44-A138 HydrophobicContact CZ3-CB 3.8Å; W44-A143 HydrophobicContact CD2-CB 4.2Å; W44-A143 HydrophobicContact CG-CB 4.45Å; W44-A143 HydrophobicContact CZ2-CB 3.86Å; W44-I145 HydrophobicContact CB-CD1 3.73Å; W44-I145 HydrophobicContact CB-CG2 3.89Å; W44-I145 HydrophobicContact CD2-CD1 3.93Å; W44-I145 HydrophobicContact CE3-CD1 4.26Å; W44-I145 HydrophobicContact CG-CD1 3.67Å; W44-I145 HydrophobicContact CG-CG2 4.13Å
45I98.5Very high97.3Very high0 Ų067.2 Ų67.20%032%0.324CS..Hα-helixtrans-61.6-42.9-179.6-66.5163.4000110.1L41 L42 D43 V48 L49 V56 L59 L63 V68 L72 L134L41-I45 WeakPolarHBondContact O-CD1 3.31Å; L41-I45 VanDerWaalsContact O-CG1 3.23Å; L41-I45 WeakPolarHBondContact O-CG1 3.32Å; L41-I45 PolarHBondContact O-N 3.24Å; L42-I45 PolarHBondContact O-N 3.3Å; D43-I45 PolarHBondContact O-N 3.18Å; I45-V48 PolarHBondContact O-N 3.49Å; I45-L49 HydrophobicContact CG2-CD1 3.77Å; I45-L49 HydrophobicContact CG2-CG 4.4Å; I45-L49 WeakPolarHBondContact O-CB 3.39Å; I45-L49 WeakPolarHBondContact O-CG 3.19Å; I45-L49 PolarHBondContact O-N 3.04Å; I45-V56 HydrophobicContact CG2-CG2 3.76Å; I45-L59 HydrophobicContact CD1-CD2 3.91Å; I45-L63 HydrophobicContact CD1-CD2 4.42Å; I45-V68 HydrophobicContact CG2-CG1 4.03Å; I45-L72 HydrophobicContact CG1-CD1 4.47Å; I45-L72 HydrophobicContact CG1-CD2 4.04Å; I45-L134 HydrophobicContact CD1-CD1 3.75Å; I45-L134 HydrophobicContact CD1-CD2 3.66Å; I45-L134 HydrophobicContact CD1-CG 4.33Å; I45-L134 HydrophobicContact CG1-CD2 4.36Å
46N98.4Very high97.3Very high32 Ų3262.8 Ų62.817%0.17131%0.305CS..Hα-helixtrans-62.2-43.9177.5-79.4-34.8000112.2L42 D43 W44 V48 L49 V50 V56L42-N46 VanDerWaalsContact CD2-ND2 3.27Å; L42-N46 WeakPolarHBondContact CD2-ND2 3.46Å; L42-N46 WeakPolarHBondContact O-CB 3.28Å; L42-N46 PolarHBondContact O-N 3.27Å; L42-N46 PolarHBondContact O-ND2 2.97Å; D43-N46 PolarHBondContact O-N 2.91Å; W44-N46 VanDerWaalsContact C-N 3.29Å; W44-N46 PolarHBondContact O-N 3Å; N46-V48 VanDerWaalsContact C-N 3.34Å; N46-V48 PolarHBondContact O-N 3.31Å; N46-L49 PolarHBondContact O-N 3.48Å; N46-V50 WeakPolarHBondContact O-CB 3.05Å; N46-V50 PolarHBondContact O-N 2.93Å; N46-V56 PolarHBondContact ND2-O 2.8Å; N46-V56 PolarHBondContact OD1-N 3.3Å
47D97.8Very high97.3Very high122 Ų12265.8 Ų65.865%0.65232%0.317SS*.Hα-helixtrans-62.6-40.3176.7-75.4-15.8000112D43 W44 V50D43-D47 PolarHBondContact O-N 3.49Å; W44-D47 PolarHBondContact O-N 3.33Å; D47-V50 WeakPolarHBondContact O-CG1 3.4Å
48V97.1Very high97.2Very high29 Ų2971.5 Ų71.518%0.17634%0.343CS..Hα-helixtrans-67.8-36.2177.9173.30000111.8W44 I45 N46 L72 K75 L76W44-V48 WeakPolarHBondContact O-CG2 3.4Å; W44-V48 PolarHBondContact O-N 3.12Å; I45-V48 PolarHBondContact O-N 3.49Å; N46-V48 VanDerWaalsContact C-N 3.34Å; N46-V48 PolarHBondContact O-N 3.31Å; V48-L72 HydrophobicContact CB-CD1 4.09Å; V48-L72 HydrophobicContact CG1-CD1 3.77Å; V48-K75 HydrophobicContact CG1-CB 4.01Å; V48-K75 HydrophobicContact CG1-CG 3.61Å; V48-L76 HydrophobicContact CG1-CD2 4.24Å; V48-L76 HydrophobicContact CG1-CG 4.47Å; V48-L76 HydrophobicContact CG2-CD2 4.38Å
49L97.6Very high97.2Very high0 Ų070 Ų700%033%0.334CS..Hα-helixtrans-101.83.9-171.8-61.8-177.8000114.9I45 N46 E51 E52 R53 I54 V68 K71 L72 K75I45-L49 HydrophobicContact CG2-CD1 3.77Å; I45-L49 HydrophobicContact CG2-CG 4.4Å; I45-L49 WeakPolarHBondContact O-CB 3.39Å; I45-L49 WeakPolarHBondContact O-CG 3.19Å; I45-L49 PolarHBondContact O-N 3.04Å; N46-L49 PolarHBondContact O-N 3.48Å; L49-E51 PolarHBondContact O-N 3.29Å; L49-E52 PolarHBondContact O-N 3.04Å; L49-R53 PolarHBondContact O-N 3.27Å; L49-I54 HydrophobicContact CB-CB 4.02Å; L49-I54 HydrophobicContact CB-CG2 4.49Å; L49-I54 HydrophobicContact CD1-CB 4.37Å; L49-I54 HydrophobicContact CD1-CD1 4.28Å; L49-I54 HydrophobicContact CD1-CG2 4.07Å; L49-I54 PolarHBondContact O-N 2.91Å; L49-V68 HydrophobicContact CD1-CG1 3.93Å; L49-K71 HydrophobicContact CD1-CB 4.46Å; L49-K71 HydrophobicContact CD2-CB 4.07Å; L49-L72 HydrophobicContact CD1-CB 4.37Å; L49-K75 HydrophobicContact CD2-CB 4.36Å
50V95.9Very high97.1Very high96 Ų9665.9 Ų65.958%0.58232%0.317SS*.G310 helixtrans-56.1-37.9-178.968.80000112.9N46 D47 E52 R53N46-V50 WeakPolarHBondContact O-CB 3.05Å; N46-V50 PolarHBondContact O-N 2.93Å; D47-V50 WeakPolarHBondContact O-CG1 3.4Å; V50-E52 VanDerWaalsContact C-N 3.28Å; V50-E52 PolarHBondContact O-N 3.37Å; V50-R53 PolarHBondContact O-N 3.37Å
51E93.3Very high97.1Very high150 Ų15068.6 Ų68.670%0.70133%0.328SS*.G310 helixtrans-67.4-28.1179-65.7-175.716500112.8L49 R53 K75L49-E51 PolarHBondContact O-N 3.29Å; E51-R53 VanDerWaalsContact C-N 3.26Å; E51-K75 IonicContact OE2-NZ 3.91Å; E51-K75 PolarHBondContact OE2-NZ 2.89Å
52E93.1Very high97Very high87 Ų8771 Ų7141%0.40734%0.34SS..G310 helixtrans-85.40.8175.3-67.6-86.8151.300111.9L49 V50 I54 K71L49-E52 PolarHBondContact O-N 3.04Å; V50-E52 VanDerWaalsContact C-N 3.28Å; V50-E52 PolarHBondContact O-N 3.37Å; E52-I54 HydrophobicContact CB-CD1 3.89Å; E52-I54 HydrophobicContact CB-CG1 4.09Å; E52-I54 PolarHBondContact O-N 3.02Å; E52-K71 IonicContact OE2-NZ 3.11Å; E52-K71 PolarHBondContact OE2-NZ 3.12Å
53R96.4Very high97Very high230 Ų23069.5 Ų69.587%0.86833%0.333SS*.THydrogen-bonded Turntrans58.432.2-177.9-53.6179.1177.2-178.1-1.5113.5L49 V50 E51L49-R53 PolarHBondContact O-N 3.27Å; V50-R53 PolarHBondContact O-N 3.37Å; E51-R53 VanDerWaalsContact C-N 3.26Å
54I96.4Very high96.9Very high37 Ų3769 Ų6919%0.1933%0.326CS..  trans-94.2135.1175.4-61.7169.3000108L49 E52 V56 V68 K71L49-I54 HydrophobicContact CB-CB 4.02Å; L49-I54 HydrophobicContact CB-CG2 4.49Å; L49-I54 HydrophobicContact CD1-CB 4.37Å; L49-I54 HydrophobicContact CD1-CD1 4.28Å; L49-I54 HydrophobicContact CD1-CG2 4.07Å; L49-I54 PolarHBondContact O-N 2.91Å; E52-I54 HydrophobicContact CB-CD1 3.89Å; E52-I54 HydrophobicContact CB-CG1 4.09Å; E52-I54 PolarHBondContact O-N 3.02Å; I54-V56 HydrophobicContact CG2-CG2 4.43Å; I54-V68 HydrophobicContact CG2-CG2 4.15Å; I54-K71 HydrophobicContact CD1-CB 3.73Å; I54-K71 HydrophobicContact CD1-CD 4.33Å; I54-K71 HydrophobicContact CD1-CG 3.68Å
55I97.3Very high96.8Very high127 Ų12770.6 Ų70.665%0.65134%0.335SS*.  trans-127.7118.5176.9-57.8174.6000107.9K57I55-K57 HydrophobicContact CG2-CG 4.39Å
56V97.9Very high96.6Very high2 Ų270.6 Ų70.61%0.01234%0.335CS..  trans-97.3130.2174.6-179.70000108.9L42 I45 N46 I54 L59 D62 L63 V68L42-V56 HydrophobicContact CG-CG1 4.48Å; I45-V56 HydrophobicContact CG2-CG2 3.76Å; N46-V56 PolarHBondContact ND2-O 2.8Å; N46-V56 PolarHBondContact OD1-N 3.3Å; I54-V56 HydrophobicContact CG2-CG2 4.43Å; V56-L59 HydrophobicContact CG1-CD2 4.08Å; V56-D62 WeakPolarHBondContact CA-OD2 3.44Å; V56-D62 HydrophobicContact CG1-CB 3.97Å; V56-L63 HydrophobicContact CG1-CD1 3.97Å; V56-L63 HydrophobicContact CG2-CD1 4.48Å; V56-V68 HydrophobicContact CG2-CG1 3.65Å; V56-V68 HydrophobicContact CG2-CG2 4.31Å
57K97.5Very high96.5Very high165 Ų16571.1 Ų71.172%0.71734%0.337SS*.SBendtrans-117.7-33.8179-65.2-178179.61770112.4L42 I55 D62L42-K57 VanDerWaalsContact CD1-O 3.29Å; L42-K57 WeakPolarHBondContact CD1-O 3.47Å; I55-K57 HydrophobicContact CG2-CG 4.39Å; K57-D62 PolarHBondContact N-OD2 3.08Å
58Q97.3Very high96.5Very high120 Ų12066 Ų6656%0.56131%0.309SS*.  trans-141.4118.4-178.2-67.2-177.2-64.700108.8E60 E61 D62Q58-E60 VanDerWaalsContact C-N 3.29Å; Q58-E60 PolarHBondContact O-N 2.99Å; Q58-E61 HydrophobicContact CB-CB 4.03Å; Q58-E61 HydrophobicContact CB-CG 4.14Å; Q58-E61 PolarHBondContact O-N 3.47Å; Q58-D62 PolarHBondContact N-OD2 3.09Å; Q58-D62 WeakPolarHBondContact O-CB 3.49Å; Q58-D62 PolarHBondContact O-N 3.4Å; Q58-D62 VanDerWaalsContact O-OD2 3.09Å
59L97.9Very high96.5Very high1 Ų164.8 Ų64.81%0.00530%0.302CS..Hα-helixtrans-59.8-41.8-172.2-63.9179.4000111.5V38 L42 I45 V56 L63 L127 I130 L131 L134V38-L59 HydrophobicContact CG1-CD1 4.07Å; L42-L59 HydrophobicContact CB-CD2 4.4Å; I45-L59 HydrophobicContact CD1-CD2 3.91Å; V56-L59 HydrophobicContact CG1-CD2 4.08Å; L59-L63 HydrophobicContact CD2-CD1 4.36Å; L59-L63 HydrophobicContact CD2-CD2 4.37Å; L59-L63 VanDerWaalsContact O-CB 3.26Å; L59-L63 WeakPolarHBondContact O-CB 3.27Å; L59-L63 PolarHBondContact O-N 3.45Å; L59-L63 VanDerWaalsContact O-N 3.15Å; L59-L127 HydrophobicContact CB-CD1 4.04Å; L59-L127 HydrophobicContact CD1-CD1 4.24Å; L59-I130 HydrophobicContact CB-CG2 4.13Å; L59-L131 HydrophobicContact CD1-CD2 3.77Å; L59-L134 HydrophobicContact CD1-CD1 3.99Å; L59-L134 HydrophobicContact CD2-CD1 3.96Å
60E95.7Very high96.5Very high48 Ų4865.1 Ų65.122%0.22430%0.304CS..Hα-helixtrans-64.6-41.1178.6-57.499.6122.300113Q58 Y64 K125 L127Q58-E60 VanDerWaalsContact C-N 3.29Å; Q58-E60 PolarHBondContact O-N 2.99Å; E60-Y64 WeakPolarHBondContact O-CB 3.33Å; E60-K125 HydrophobicContact CB-CB 4.17Å; E60-L127 HydrophobicContact CG-CB 3.72Å; E60-L127 HydrophobicContact CG-CD1 3.99Å; E60-L127 HydrophobicContact CG-CG 4.27Å; E60-L127 WeakPolarHBondContact OE1-CD2 3.46Å
61E96.9Very high96.5Very high86 Ų8662.5 Ų62.540%0.40228%0.284SS..Hα-helixtrans-82.9-28.6-174.1-63.9-59.813300112.8Q58 Y64 K125Q58-E61 HydrophobicContact CB-CB 4.03Å; Q58-E61 HydrophobicContact CB-CG 4.14Å; Q58-E61 PolarHBondContact O-N 3.47Å; E61-Y64 WeakPolarHBondContact O-CD1 3.28Å; E61-Y64 VanDerWaalsContact O-CE1 3.24Å; E61-Y64 WeakPolarHBondContact O-CE1 3.42Å; E61-K125 WeakPolarHBondContact OE1-CD 3.34Å; E61-K125 IonicContact OE1-NZ 2.76Å; E61-K125 PolarHBondContact OE1-NZ 3.27Å; E61-K125 IonicContact OE2-NZ 3.66Å; E61-K125 PolarHBondContact OE2-NZ 2.89Å
62D97.8Very high96.7Very high50 Ų5055.4 Ų55.427%0.26725%0.251SS..Hα-helixtrans-98.4-20.3-173.6-62.2-43.3000113V56 K57 Q58 V68V56-D62 WeakPolarHBondContact CA-OD2 3.44Å; V56-D62 HydrophobicContact CG1-CB 3.97Å; K57-D62 PolarHBondContact N-OD2 3.08Å; Q58-D62 PolarHBondContact N-OD2 3.09Å; Q58-D62 WeakPolarHBondContact O-CB 3.49Å; Q58-D62 PolarHBondContact O-N 3.4Å; Q58-D62 VanDerWaalsContact O-OD2 3.09Å; D62-V68 HydrophobicContact CB-CG2 4.49Å; D62-V68 WeakPolarHBondContact O-CG2 3.45Å
63L97.8Very high96.9Very high0 Ų051.3 Ų51.30%023%0.232CC..Hα-helixtrans-103.5-16-176.8-75.856.7000114I45 V56 L59 D65 G66 V68 L69 I130 L134I45-L63 HydrophobicContact CD1-CD2 4.42Å; V56-L63 HydrophobicContact CG1-CD1 3.97Å; V56-L63 HydrophobicContact CG2-CD1 4.48Å; L59-L63 HydrophobicContact CD2-CD1 4.36Å; L59-L63 HydrophobicContact CD2-CD2 4.37Å; L59-L63 VanDerWaalsContact O-CB 3.26Å; L59-L63 WeakPolarHBondContact O-CB 3.27Å; L59-L63 PolarHBondContact O-N 3.45Å; L59-L63 VanDerWaalsContact O-N 3.15Å; L63-D65 VanDerWaalsContact C-N 3.26Å; L63-D65 PolarHBondContact O-N 3.15Å; L63-G66 PolarHBondContact O-N 3Å; L63-G66 VanDerWaalsContact O-N 3.09Å; L63-V68 HydrophobicContact CD1-CB 4.13Å; L63-V68 HydrophobicContact CD1-CG1 3.82Å; L63-V68 HydrophobicContact CG-CB 4.31Å; L63-V68 HydrophobicContact CG-CG1 4.2Å; L63-L69 HydrophobicContact CB-CD1 4.33Å; L63-L69 HydrophobicContact CB-CG 4.1Å; L63-L69 HydrophobicContact CD2-CD2 3.81Å; L63-L69 HydrophobicContact CD2-CG 4.3Å; L63-L69 HydrophobicContact CG-CD2 4.11Å; L63-L69 HydrophobicContact CG-CG 4.08Å; L63-I130 HydrophobicContact CD2-CG2 3.66Å; L63-L134 HydrophobicContact CD2-CD1 3.85Å; L63-L134 HydrophobicContact CD2-CD2 4.06Å; L63-L134 HydrophobicContact CD2-CG 4.24Å
64Y96.9Very high96.9Very high60 Ų6041 Ų4124%0.23519%0.194CC..THydrogen-bonded Turntrans-62.7-27.1-170.382.3-75.8000114.6E60 E61 G66 L97 I122 H123 K125E60-Y64 WeakPolarHBondContact O-CB 3.33Å; E61-Y64 WeakPolarHBondContact O-CD1 3.28Å; E61-Y64 VanDerWaalsContact O-CE1 3.24Å; E61-Y64 WeakPolarHBondContact O-CE1 3.42Å; Y64-G66 VanDerWaalsContact C-N 3.33Å; Y64-L97 VanDerWaalsContact O-CD1 3.29Å; Y64-L97 WeakPolarHBondContact O-CD1 3.43Å; Y64-I122 WeakPolarHBondContact CA-O 3.48Å; Y64-I122 WeakPolarHBondContact CB-O 3.43Å; Y64-H123 WeakPolarHBondContact O-CA 3.32Å; Y64-K125 HydrophobicContact CG-CG 4.16Å
65D94.8Very high96.8Very high40 Ų4043.6 Ų43.621%0.21420%0.204CC..THydrogen-bonded Turntrans-88-5.5-178.871.33.2000113.1L63 Q67 Q93L63-D65 VanDerWaalsContact C-N 3.26Å; L63-D65 PolarHBondContact O-N 3.15Å; D65-Q67 VanDerWaalsContact C-N 3.33Å; D65-Q67 PolarHBondContact O-N 2.93Å; D65-Q67 VanDerWaalsContact OD1-CB 3.23Å; D65-Q67 WeakPolarHBondContact OD1-CB 3.45Å; D65-Q67 PolarHBondContact OD1-N 3.32Å; D65-Q93 HydrophobicContact CB-CB 4.5Å; D65-Q93 HydrophobicContact CB-CG 3.97Å
66G95.8Very high96.5Very high0 Ų039.5 Ų39.50%018%0.183CC..SBendtrans81.1-2.1-179.700000115.6L63 Y64 Q70 L97L63-G66 PolarHBondContact O-N 3Å; L63-G66 VanDerWaalsContact O-N 3.09Å; Y64-G66 VanDerWaalsContact C-N 3.33Å; G66-Q70 VanDerWaalsContact O-CB 3.32Å; G66-Q70 WeakPolarHBondContact O-CB 3.5Å; G66-Q70 PolarHBondContact O-N 3.08Å; G66-L97 VanDerWaalsContact CA-CD2 3.45Å
67Q95.8Very high96.1Very high44 Ų4441.1 Ų41.121%0.20620%0.197CC..Hα-helixtrans-67-50.2-177.1-17760.349.200112.4D65 Q70 K71 E85D65-Q67 VanDerWaalsContact C-N 3.33Å; D65-Q67 PolarHBondContact O-N 2.93Å; D65-Q67 VanDerWaalsContact OD1-CB 3.23Å; D65-Q67 WeakPolarHBondContact OD1-CB 3.45Å; D65-Q67 PolarHBondContact OD1-N 3.32Å; Q67-Q70 WeakPolarHBondContact O-CB 3.4Å; Q67-Q70 PolarHBondContact O-N 3.23Å; Q67-K71 WeakPolarHBondContact O-CG 3.3Å; Q67-K71 PolarHBondContact O-N 3.38Å; Q67-E85 PolarHBondContact OE1-O 2.96Å
68V97.3Very high95.7Very high13 Ų1336.7 Ų36.78%0.07920%0.197CC..Hα-helixtrans-66.2-41.7179.1173.80000110.3I45 L49 I54 V56 D62 L63 Q70 K71 L72I45-V68 HydrophobicContact CG2-CG1 4.03Å; L49-V68 HydrophobicContact CD1-CG1 3.93Å; I54-V68 HydrophobicContact CG2-CG2 4.15Å; V56-V68 HydrophobicContact CG2-CG1 3.65Å; V56-V68 HydrophobicContact CG2-CG2 4.31Å; D62-V68 HydrophobicContact CB-CG2 4.49Å; D62-V68 WeakPolarHBondContact O-CG2 3.45Å; L63-V68 HydrophobicContact CD1-CB 4.13Å; L63-V68 HydrophobicContact CD1-CG1 3.82Å; L63-V68 HydrophobicContact CG-CB 4.31Å; L63-V68 HydrophobicContact CG-CG1 4.2Å; V68-Q70 PolarHBondContact O-N 3.3Å; V68-K71 PolarHBondContact O-N 3.45Å; V68-L72 WeakPolarHBondContact O-CB 3.33Å; V68-L72 PolarHBondContact O-N 3.21Å
69L97.6Very high95.3Very high4 Ų433.9 Ų33.92%0.02119%0.191CC..Hα-helixtrans-61.6-41.7177.3-70.1175.1000112.4L63 L73 L97 V100 I122 L133 L134L63-L69 HydrophobicContact CB-CD1 4.33Å; L63-L69 HydrophobicContact CB-CG 4.1Å; L63-L69 HydrophobicContact CD2-CD2 3.81Å; L63-L69 HydrophobicContact CD2-CG 4.3Å; L63-L69 HydrophobicContact CG-CD2 4.11Å; L63-L69 HydrophobicContact CG-CG 4.08Å; L69-L73 WeakPolarHBondContact O-CB 3.5Å; L69-L73 PolarHBondContact O-N 3.1Å; L69-L97 HydrophobicContact CD1-CD2 4.04Å; L69-V100 HydrophobicContact CB-CG1 3.95Å; L69-I122 HydrophobicContact CD1-CG2 3.91Å; L69-L133 HydrophobicContact CD1-CD2 3.89Å; L69-L133 HydrophobicContact CD2-CD2 3.96Å; L69-L134 HydrophobicContact CD2-CD2 4.24Å
70Q96.6Very high94.9Very high7 Ų740.9 Ų40.93%0.03322%0.221CC..Hα-helixtrans-55.8-55.1172.9177.7-159.1-19.800110.4G66 Q67 V68 L72 L73 E74 L81 V83 K96 V100G66-Q70 VanDerWaalsContact O-CB 3.32Å; G66-Q70 WeakPolarHBondContact O-CB 3.5Å; G66-Q70 PolarHBondContact O-N 3.08Å; Q67-Q70 WeakPolarHBondContact O-CB 3.4Å; Q67-Q70 PolarHBondContact O-N 3.23Å; V68-Q70 PolarHBondContact O-N 3.3Å; Q70-L72 VanDerWaalsContact C-N 3.32Å; Q70-L72 PolarHBondContact O-N 3.43Å; Q70-L73 PolarHBondContact O-N 2.77Å; Q70-E74 HydrophobicContact CG-CG 4.4Å; Q70-E74 PolarHBondContact NE2-OE1 2.99Å; Q70-E74 WeakPolarHBondContact O-CG 3.3Å; Q70-E74 PolarHBondContact O-N 2.7Å; Q70-L81 HydrophobicContact CB-CD1 4.49Å; Q70-L81 HydrophobicContact CG-CB 4.33Å; Q70-L81 HydrophobicContact CG-CD1 3.99Å; Q70-V83 HydrophobicContact CG-CG2 3.66Å; Q70-V83 VanDerWaalsContact NE2-CG2 3.26Å; Q70-K96 VanDerWaalsContact OE1-NZ 3.1Å; Q70-V100 HydrophobicContact CB-CG2 3.84Å; Q70-V100 HydrophobicContact CG-CG2 4.47Å
71K97.1Very high94.7Very high41 Ų4139.8 Ų39.818%0.17822%0.217CC..Hα-helixtrans-62.7-40.1-176.1-71.8-71.2-171.1163.10112.4L49 E52 I54 Q67 V68 E74 K75L49-K71 HydrophobicContact CD1-CB 4.46Å; L49-K71 HydrophobicContact CD2-CB 4.07Å; E52-K71 IonicContact OE2-NZ 3.11Å; E52-K71 PolarHBondContact OE2-NZ 3.12Å; I54-K71 HydrophobicContact CD1-CB 3.73Å; I54-K71 HydrophobicContact CD1-CD 4.33Å; I54-K71 HydrophobicContact CD1-CG 3.68Å; Q67-K71 WeakPolarHBondContact O-CG 3.3Å; Q67-K71 PolarHBondContact O-N 3.38Å; V68-K71 PolarHBondContact O-N 3.45Å; K71-E74 PolarHBondContact O-N 2.84Å; K71-K75 WeakPolarHBondContact O-CB 3.38Å; K71-K75 PolarHBondContact O-N 3.03Å
72L97.8Very high94.4Very high1 Ų143.2 Ų43.21%0.00524%0.238CC..Hα-helixtrans-58.8-50173.8-177.764.2000110.8W44 I45 V48 L49 V68 Q70 K75 L76 L134 L137W44-L72 HydrophobicContact CH2-CD2 4.42Å; W44-L72 HydrophobicContact CZ3-CD2 4.43Å; I45-L72 HydrophobicContact CG1-CD1 4.47Å; I45-L72 HydrophobicContact CG1-CD2 4.04Å; V48-L72 HydrophobicContact CB-CD1 4.09Å; V48-L72 HydrophobicContact CG1-CD1 3.77Å; L49-L72 HydrophobicContact CD1-CB 4.37Å; V68-L72 WeakPolarHBondContact O-CB 3.33Å; V68-L72 PolarHBondContact O-N 3.21Å; Q70-L72 VanDerWaalsContact C-N 3.32Å; Q70-L72 PolarHBondContact O-N 3.43Å; L72-K75 PolarHBondContact O-N 2.91Å; L72-L76 HydrophobicContact CD1-CD1 3.87Å; L72-L76 HydrophobicContact CD1-CG 4.22Å; L72-L76 HydrophobicContact CG-CD1 3.83Å; L72-L76 HydrophobicContact CG-CG 4.48Å; L72-L76 WeakPolarHBondContact O-CB 3.39Å; L72-L76 VanDerWaalsContact O-CG 3.25Å; L72-L76 WeakPolarHBondContact O-CG 3.42Å; L72-L76 PolarHBondContact O-N 2.95Å; L72-L134 HydrophobicContact CD2-CD2 3.99Å; L72-L137 HydrophobicContact CD2-CD1 4.44Å
73L96.6Very high94Very high2 Ų242 Ų421%0.0123%0.232CC..Hα-helixtrans-65.2-42.6-178.7-161.865.8000112.1L69 Q70 K75 L76 A77 L81 A103 V104 L107 L137 F141L69-L73 WeakPolarHBondContact O-CB 3.5Å; L69-L73 PolarHBondContact O-N 3.1Å; Q70-L73 PolarHBondContact O-N 2.77Å; L73-K75 VanDerWaalsContact C-N 3.3Å; L73-K75 PolarHBondContact O-N 3.36Å; L73-L76 PolarHBondContact O-N 3.41Å; L73-A77 VanDerWaalsContact O-CB 3.23Å; L73-A77 WeakPolarHBondContact O-CB 3.39Å; L73-A77 PolarHBondContact O-N 2.78Å; L73-L81 HydrophobicContact CB-CD1 4.41Å; L73-L81 HydrophobicContact CD2-CD1 4.04Å; L73-A103 HydrophobicContact CD2-CB 3.68Å; L73-V104 HydrophobicContact CD1-CG2 3.97Å; L73-V104 HydrophobicContact CD2-CG2 3.75Å; L73-V104 HydrophobicContact CG-CG2 4.49Å; L73-L107 HydrophobicContact CD1-CD1 3.59Å; L73-L107 HydrophobicContact CD2-CD1 4.11Å; L73-L107 HydrophobicContact CG-CD1 4Å; L73-L137 HydrophobicContact CD1-CD2 3.91Å; L73-F141 HydrophobicContact CD1-CE2 4.22Å
74E95.2Very high93.3Very high14 Ų1445 Ų457%0.06526%0.256CS..Hα-helixtrans-59-42.1176.6-70.9-176.7169.500111.8Q70 K71 G78 C79 K80 L81Q70-E74 HydrophobicContact CG-CG 4.4Å; Q70-E74 PolarHBondContact NE2-OE1 2.99Å; Q70-E74 WeakPolarHBondContact O-CG 3.3Å; Q70-E74 PolarHBondContact O-N 2.7Å; K71-E74 PolarHBondContact O-N 2.84Å; E74-G78 WeakPolarHBondContact O-CA 3.48Å; E74-G78 PolarHBondContact O-N 3.19Å; E74-C79 WeakPolarHBondContact CA-O 3.44Å; E74-C79 WeakPolarHBondContact CB-O 3.29Å; E74-C79 VanDerWaalsContact CG-O 3.27Å; E74-C79 WeakPolarHBondContact CG-O 3.42Å; E74-C79 PolarHBondContact O-N 2.77Å; E74-K80 WeakPolarHBondContact OE2-CD 3.43Å; E74-K80 IonicContact OE2-NZ 3.96Å; E74-K80 PolarHBondContact OE2-NZ 2.84Å; E74-L81 HydrophobicContact CG-CB 4.39Å; E74-L81 HydrophobicContact CG-CD1 4.47Å; E74-L81 HydrophobicContact CG-CG 4.08Å; E74-L81 PolarHBondContact OE1-N 3.45Å
75K94.6Very high92.5Very high90 Ų9049.9 Ų49.939%0.39128%0.281SS..Hα-helixtrans-69.1-43.7179.2-170.964.7169.7-173.70112.2V48 L49 E51 K71 L72 L73V48-K75 HydrophobicContact CG1-CB 4.01Å; V48-K75 HydrophobicContact CG1-CG 3.61Å; L49-K75 HydrophobicContact CD2-CB 4.36Å; E51-K75 IonicContact OE2-NZ 3.91Å; E51-K75 PolarHBondContact OE2-NZ 2.89Å; K71-K75 WeakPolarHBondContact O-CB 3.38Å; K71-K75 PolarHBondContact O-N 3.03Å; L72-K75 PolarHBondContact O-N 2.91Å; L73-K75 VanDerWaalsContact C-N 3.3Å; L73-K75 PolarHBondContact O-N 3.36Å
76L92.4Very high91.8Very high42 Ų4253.3 Ų53.322%0.2230%0.303CS..Hα-helixtrans-70.7-41.7-179.1-68.7173.9000112.5W44 V48 L72 L73 F141W44-L76 HydrophobicContact CH2-CD1 3.94Å; W44-L76 HydrophobicContact CZ2-CD1 3.77Å; W44-L76 HydrophobicContact CZ2-CD2 4.07Å; V48-L76 HydrophobicContact CG1-CD2 4.24Å; V48-L76 HydrophobicContact CG1-CG 4.47Å; V48-L76 HydrophobicContact CG2-CD2 4.38Å; L72-L76 HydrophobicContact CD1-CD1 3.87Å; L72-L76 HydrophobicContact CD1-CG 4.22Å; L72-L76 HydrophobicContact CG-CD1 3.83Å; L72-L76 HydrophobicContact CG-CG 4.48Å; L72-L76 WeakPolarHBondContact O-CB 3.39Å; L72-L76 VanDerWaalsContact O-CG 3.25Å; L72-L76 WeakPolarHBondContact O-CG 3.42Å; L72-L76 PolarHBondContact O-N 2.95Å; L73-L76 PolarHBondContact O-N 3.41Å; L76-F141 HydrophobicContact CB-CD1 3.91Å; L76-F141 HydrophobicContact CB-CD2 3.97Å; L76-F141 HydrophobicContact CB-CE1 3.89Å; L76-F141 HydrophobicContact CB-CE2 3.95Å; L76-F141 HydrophobicContact CB-CG 3.95Å; L76-F141 HydrophobicContact CB-CZ 3.91Å; L76-F141 HydrophobicContact CD1-CD2 3.81Å; L76-F141 HydrophobicContact CD1-CE2 4.2Å; L76-F141 HydrophobicContact CD1-CG 4.24Å; L76-F141 HydrophobicContact CD2-CB 4.34Å; L76-F141 HydrophobicContact CD2-CG 4.42Å; L76-F141 HydrophobicContact CG-CD2 4.4Å; L76-F141 HydrophobicContact CG-CG 4.44Å; L76-F141 WeakPolarHBondContact O-CE1 3.35Å
77A89.1Confident91.3Very high36 Ų3654.6 Ų54.630%0.29831%0.312SS..Hα-helixtrans-86.9-13.4-178.100000113.6L73 C79 L107 F141L73-A77 VanDerWaalsContact O-CB 3.23Å; L73-A77 WeakPolarHBondContact O-CB 3.39Å; L73-A77 PolarHBondContact O-N 2.78Å; A77-C79 PolarHBondContact O-N 3.39Å; A77-L107 HydrophobicContact CB-CD1 4.31Å; A77-F141 HydrophobicContact CB-CE1 4.45Å; A77-F141 HydrophobicContact CB-CZ 4.2Å
78G89.3Confident90.8Very high71 Ų7161.1 Ų61.173%0.73234%0.342SS*.THydrogen-bonded Turntrans65.325.9-176.400000113.4E74E74-G78 WeakPolarHBondContact O-CA 3.48Å; E74-G78 PolarHBondContact O-N 3.19Å
79C87.4Confident90.7Very high62 Ų6263.8 Ų63.842%0.41936%0.361SS..  trans-127.7161-18071.30000111.2E74 A77E74-C79 WeakPolarHBondContact CA-O 3.44Å; E74-C79 WeakPolarHBondContact CB-O 3.29Å; E74-C79 VanDerWaalsContact CG-O 3.27Å; E74-C79 WeakPolarHBondContact CG-O 3.42Å; E74-C79 PolarHBondContact O-N 2.77Å; A77-C79 PolarHBondContact O-N 3.39Å
80K91.3Very high90.5Very high147 Ų14768.8 Ų68.864%0.63938%0.384SS*.  trans-100.1134.9175-79.7-77.3169.8-167.80109.9E74E74-K80 WeakPolarHBondContact OE2-CD 3.43Å; E74-K80 IonicContact OE2-NZ 3.96Å; E74-K80 PolarHBondContact OE2-NZ 2.84Å
81L91.4Very high90.4Very high26 Ų2674.9 Ų74.914%0.13642%0.416CS..  trans-88.8142.3174.4-65.9177.4000110Q70 L73 E74 V83 V100 A103Q70-L81 HydrophobicContact CB-CD1 4.49Å; Q70-L81 HydrophobicContact CG-CB 4.33Å; Q70-L81 HydrophobicContact CG-CD1 3.99Å; L73-L81 HydrophobicContact CB-CD1 4.41Å; L73-L81 HydrophobicContact CD2-CD1 4.04Å; E74-L81 HydrophobicContact CG-CB 4.39Å; E74-L81 HydrophobicContact CG-CD1 4.47Å; E74-L81 HydrophobicContact CG-CG 4.08Å; E74-L81 PolarHBondContact OE1-N 3.45Å; L81-V83 VanDerWaalsContact C-N 3.29Å; L81-V83 HydrophobicContact CB-CG2 4.28Å; L81-V83 PolarHBondContact O-N 3Å; L81-V100 HydrophobicContact CD1-CG2 3.96Å; L81-A103 HydrophobicContact CD2-CB 3.6Å
82N90.9Very high90.3Very high158 Ų15873.5 Ų73.585%0.84541%0.413SS*.  trans-83.973.7177-173.523.8000110.7
83V89.3Confident90.2Very high25 Ų2574.2 Ų74.215%0.15242%0.417CS..SBendtrans-133.4155.4176.4-62.60000110.2Q70 L81 K96 T99Q70-V83 HydrophobicContact CG-CG2 3.66Å; Q70-V83 VanDerWaalsContact NE2-CG2 3.26Å; L81-V83 VanDerWaalsContact C-N 3.29Å; L81-V83 HydrophobicContact CB-CG2 4.28Å; L81-V83 PolarHBondContact O-N 3Å; V83-K96 HydrophobicContact CB-CG 4.28Å; V83-K96 HydrophobicContact CG1-CG 4.42Å; V83-K96 HydrophobicContact CG2-CG 4.37Å; V83-T99 HydrophobicContact CG1-CG2 3.47Å; V83-T99 VanDerWaalsContact CG1-CG2 3.47Å
84A83.2Confident90.2Very high61 Ų6177 Ų7750%0.50443%0.429SS..  trans-60.5139.1175.800000110.9V86 K96A84-V86 VanDerWaalsContact C-N 3.31Å; A84-V86 PolarHBondContact O-N 3.39Å; A84-K96 WeakPolarHBondContact O-CE 3.43Å; A84-K96 PolarHBondContact O-NZ 3.43Å
85E78.1Confident90.3Very high163 Ų16382.7 Ų82.776%0.76246%0.455SS*.SBendtrans-65.1-33.8-176.5-68.4-168.9159.900113.4Q67Q67-E85 PolarHBondContact OE1-O 2.96Å
86V81.5Confident90.3Very high112 Ų11278.8 Ų78.868%0.67944%0.438SS*.  trans-137.4140.4177.6-179.10000108.4A84A84-V86 VanDerWaalsContact C-N 3.31Å; A84-V86 PolarHBondContact O-N 3.39Å
87T84.3Confident90.6Very high28 Ų2876.8 Ų76.817%0.17243%0.428CS..  trans-148.3122.9178.7-43.10000110.6
88Q85.8Confident90.9Very high180 Ų18079.4 Ų79.484%0.84143%0.434SS*.  trans-105.5-20-177.8-68.1-170.1-19.800113.5
89S94.9Very high91.3Very high69 Ų6978 Ų7848%0.48341%0.411SS..SBendtrans-79.6142.2178.661.40000110.8I91 G92 Q93S89-I91 VanDerWaalsContact C-N 3.28Å; S89-I91 PolarHBondContact O-N 2.64Å; S89-G92 PolarHBondContact O-N 3.22Å; S89-G92 PolarHBondContact OG-N 3.21Å; S89-Q93 WeakPolarHBondContact O-CG 3.47Å; S89-Q93 PolarHBondContact O-N 3.35Å
90E93.8Very high91.7Very high109 Ų10975.1 Ų75.151%0.50939%0.392SS..Hα-helixtrans-53.1-46.7176.6-172-168.3153.300111.9G92 Q93 K94E90-G92 VanDerWaalsContact C-N 3.28Å; E90-G92 PolarHBondContact O-N 3.01Å; E90-Q93 PolarHBondContact O-N 3.42Å; E90-K94 HydrophobicContact CG-CD 4.44Å; E90-K94 PolarHBondContact O-N 3.47Å; E90-K94 IonicContact OE1-NZ 3.66Å; E90-K94 PolarHBondContact OE1-NZ 3.02Å
91I94.3Very high91.9Very high135 Ų13568.9 Ų68.969%0.69237%0.365SS*.Hα-helixtrans-57.7-43.9178.2-63.3168.5000110.7S89 K94 Q95S89-I91 VanDerWaalsContact C-N 3.28Å; S89-I91 PolarHBondContact O-N 2.64Å; I91-K94 PolarHBondContact O-N 3.11Å; I91-Q95 WeakPolarHBondContact O-CB 3.36Å; I91-Q95 PolarHBondContact O-N 2.46Å
92G94.9Very high92Very high12 Ų1272.1 Ų72.112%0.12438%0.38CS..Hα-helixtrans-72.7-34.5-178.600000113S89 E90 Q95 K96S89-G92 PolarHBondContact O-N 3.22Å; S89-G92 PolarHBondContact OG-N 3.21Å; E90-G92 VanDerWaalsContact C-N 3.28Å; E90-G92 PolarHBondContact O-N 3.01Å; G92-Q95 PolarHBondContact O-N 3.46Å; G92-K96 WeakPolarHBondContact O-CB 3.23Å; G92-K96 PolarHBondContact O-N 2.92Å
93Q96.3Very high92.1Very high17 Ų1765.6 Ų65.68%0.07935%0.347CS..Hα-helixtrans-63.1-47.1171.7-67.8172.9-16.500111.1D65 S89 E90 Q95 K96 L97 H123D65-Q93 HydrophobicContact CB-CB 4.5Å; D65-Q93 HydrophobicContact CB-CG 3.97Å; S89-Q93 WeakPolarHBondContact O-CG 3.47Å; S89-Q93 PolarHBondContact O-N 3.35Å; E90-Q93 PolarHBondContact O-N 3.42Å; Q93-Q95 VanDerWaalsContact C-N 3.32Å; Q93-Q95 PolarHBondContact O-N 2.94Å; Q93-K96 WeakPolarHBondContact O-CB 3.46Å; Q93-K96 PolarHBondContact O-N 3.4Å; Q93-L97 PolarHBondContact O-N 3.13Å; Q93-H123 PolarHBondContact OE1-NE2 3.03Å
94K96.6Very high92.2Very high61 Ų6164.5 Ų64.527%0.26534%0.341SS..Hα-helixtrans-61-40.5175.3-75.7-179.5168.9165.80112E90 I91 L97 Q98 V119 D120 H123E90-K94 HydrophobicContact CG-CD 4.44Å; E90-K94 PolarHBondContact O-N 3.47Å; E90-K94 IonicContact OE1-NZ 3.66Å; E90-K94 PolarHBondContact OE1-NZ 3.02Å; I91-K94 PolarHBondContact O-N 3.11Å; K94-L97 PolarHBondContact O-N 3.12Å; K94-Q98 WeakPolarHBondContact O-CB 3.25Å; K94-Q98 PolarHBondContact O-N 3.18Å; K94-V119 HydrophobicContact CB-CG1 3.84Å; K94-V119 HydrophobicContact CG-CG1 3.91Å; K94-V119 WeakPolarHBondContact O-CG1 3.49Å; K94-D120 IonicContact NZ-OD1 2.76Å; K94-H123 WeakPolarHBondContact CE-ND1 3.32Å; K94-H123 HydrophobicContact CG-CB 4.37Å
95Q96.1Very high92.5Very high133 Ų13365.9 Ų65.962%0.62134%0.337SS*.Hα-helixtrans-67.2-38.8176-168.8164.91200112.6I91 G92 Q93 Q98 T99I91-Q95 WeakPolarHBondContact O-CB 3.36Å; I91-Q95 PolarHBondContact O-N 2.46Å; G92-Q95 PolarHBondContact O-N 3.46Å; Q93-Q95 VanDerWaalsContact C-N 3.32Å; Q93-Q95 PolarHBondContact O-N 2.94Å; Q95-Q98 WeakPolarHBondContact O-CB 3.47Å; Q95-Q98 PolarHBondContact O-N 2.55Å; Q95-T99 PolarHBondContact O-N 3.38Å; Q95-T99 VanDerWaalsContact O-N 3.17Å; Q95-T99 PolarHBondContact O-OG1 3.43Å
96K96.4Very high92.8Very high8 Ų863.5 Ų63.54%0.03533%0.329CS..Hα-helixtrans-60.6-50.5172.4177.4-177.9-66.1-124.90111Q70 V83 A84 G92 Q93 Q98 T99 V100Q70-K96 VanDerWaalsContact OE1-NZ 3.1Å; V83-K96 HydrophobicContact CB-CG 4.28Å; V83-K96 HydrophobicContact CG1-CG 4.42Å; V83-K96 HydrophobicContact CG2-CG 4.37Å; A84-K96 WeakPolarHBondContact O-CE 3.43Å; A84-K96 PolarHBondContact O-NZ 3.43Å; G92-K96 WeakPolarHBondContact O-CB 3.23Å; G92-K96 PolarHBondContact O-N 2.92Å; Q93-K96 WeakPolarHBondContact O-CB 3.46Å; Q93-K96 PolarHBondContact O-N 3.4Å; K96-Q98 VanDerWaalsContact C-N 3.27Å; K96-Q98 PolarHBondContact O-N 3.5Å; K96-T99 PolarHBondContact O-N 3.39Å; K96-V100 HydrophobicContact CG-CG2 4.38Å; K96-V100 WeakPolarHBondContact O-CG2 3.33Å; K96-V100 PolarHBondContact O-N 3.33Å
97L97.4Very high92.9Very high0 Ų060.9 Ų60.90%031%0.311CS..Hα-helixtrans-57.1-41.9176.1-80.2174.1000111.8Y64 G66 L69 Q93 K94 T99 V100 L101 V119 I122 H123Y64-L97 VanDerWaalsContact O-CD1 3.29Å; Y64-L97 WeakPolarHBondContact O-CD1 3.43Å; G66-L97 VanDerWaalsContact CA-CD2 3.45Å; L69-L97 HydrophobicContact CD1-CD2 4.04Å; Q93-L97 PolarHBondContact O-N 3.13Å; K94-L97 PolarHBondContact O-N 3.12Å; L97-T99 PolarHBondContact O-N 2.97Å; L97-V100 PolarHBondContact O-N 3.45Å; L97-L101 VanDerWaalsContact O-CB 3.32Å; L97-L101 WeakPolarHBondContact O-CB 3.48Å; L97-L101 VanDerWaalsContact O-CG 3.24Å; L97-L101 WeakPolarHBondContact O-CG 3.41Å; L97-L101 PolarHBondContact O-N 3.14Å; L97-V119 HydrophobicContact CB-CG1 4.01Å; L97-V119 HydrophobicContact CB-CG2 4.18Å; L97-V119 HydrophobicContact CD1-CG1 4.25Å; L97-I122 HydrophobicContact CD1-CB 4.3Å; L97-I122 HydrophobicContact CD1-CG2 4.21Å; L97-I122 HydrophobicContact CD2-CB 4.27Å; L97-I122 HydrophobicContact CD2-CG2 3.64Å; L97-H123 HydrophobicContact CD1-CB 3.71Å
98Q96.6Very high92.8Very high90 Ų9059.9 Ų59.942%0.42131%0.305SS..Hα-helixtrans-54.9-52.4176.6-176.663.635.400110.8K94 Q95 K96 V100 L101 E102 V119K94-Q98 WeakPolarHBondContact O-CB 3.25Å; K94-Q98 PolarHBondContact O-N 3.18Å; Q95-Q98 WeakPolarHBondContact O-CB 3.47Å; Q95-Q98 PolarHBondContact O-N 2.55Å; K96-Q98 VanDerWaalsContact C-N 3.27Å; K96-Q98 PolarHBondContact O-N 3.5Å; Q98-V100 PolarHBondContact O-N 3.14Å; Q98-L101 PolarHBondContact O-N 2.89Å; Q98-E102 WeakPolarHBondContact CG-OE1 3.32Å; Q98-E102 PolarHBondContact NE2-OE1 3.38Å; Q98-E102 WeakPolarHBondContact O-CB 3.24Å; Q98-E102 VanDerWaalsContact O-CG 3.27Å; Q98-E102 WeakPolarHBondContact O-CG 3.29Å; Q98-E102 PolarHBondContact O-N 3.49Å; Q98-V119 HydrophobicContact CB-CG2 4.04Å; Q98-V119 VanDerWaalsContact OE1-CG2 3.23Å
99T96.1Very high92.5Very high42 Ų4260 Ų6026%0.25830%0.297SS..Hα-helixtrans-64-39.9179.1-56.50000112.7V83 Q95 K96 L97 A103V83-T99 HydrophobicContact CG1-CG2 3.47Å; V83-T99 VanDerWaalsContact CG1-CG2 3.47Å; Q95-T99 PolarHBondContact O-N 3.38Å; Q95-T99 VanDerWaalsContact O-N 3.17Å; Q95-T99 PolarHBondContact O-OG1 3.43Å; K96-T99 PolarHBondContact O-N 3.39Å; L97-T99 PolarHBondContact O-N 2.97Å; T99-A103 PolarHBondContact O-N 2.84Å; T99-A103 VanDerWaalsContact O-N 3.09Å
100V96.9Very high91.2Very high1 Ų157.7 Ų57.71%0.00628%0.281CS..Hα-helixtrans-63.4-47.5176.6172.20000110.6L69 Q70 L81 K96 L97 Q98 A103 V104L69-V100 HydrophobicContact CB-CG1 3.95Å; Q70-V100 HydrophobicContact CB-CG2 3.84Å; Q70-V100 HydrophobicContact CG-CG2 4.47Å; L81-V100 HydrophobicContact CD1-CG2 3.96Å; K96-V100 HydrophobicContact CG-CG2 4.38Å; K96-V100 WeakPolarHBondContact O-CG2 3.33Å; K96-V100 PolarHBondContact O-N 3.33Å; L97-V100 PolarHBondContact O-N 3.45Å; Q98-V100 PolarHBondContact O-N 3.14Å; V100-A103 PolarHBondContact O-N 3.21Å; V100-V104 WeakPolarHBondContact O-CG2 3.41Å; V100-V104 PolarHBondContact O-N 3.14Å
101L95.7Very high89.6Confident17 Ų1763.2 Ų63.29%0.08930%0.297CS..Hα-helixtrans-70.8-31.3-177.9-66.6-176.8000112.7L97 Q98 V104 H105 V119 I122 L133L97-L101 VanDerWaalsContact O-CB 3.32Å; L97-L101 WeakPolarHBondContact O-CB 3.48Å; L97-L101 VanDerWaalsContact O-CG 3.24Å; L97-L101 WeakPolarHBondContact O-CG 3.41Å; L97-L101 PolarHBondContact O-N 3.14Å; Q98-L101 PolarHBondContact O-N 2.89Å; L101-V104 PolarHBondContact O-N 3.38Å; L101-H105 WeakPolarHBondContact O-CB 3.49Å; L101-H105 PolarHBondContact O-N 3.32Å; L101-V119 HydrophobicContact CD1-CG2 3.93Å; L101-I122 HydrophobicContact CD1-CG1 4.44Å; L101-L133 HydrophobicContact CD2-CD1 4.28Å; L101-L133 HydrophobicContact CD2-CD2 3.84Å
102E92.3Very high87.9Confident94 Ų9460.8 Ų60.844%0.43931%0.306SS..Hα-helixtrans-62.2-46.9168.9-77.1169.2179.300111.3Q98 V104 H105 D106Q98-E102 WeakPolarHBondContact CG-OE1 3.32Å; Q98-E102 PolarHBondContact NE2-OE1 3.38Å; Q98-E102 WeakPolarHBondContact O-CB 3.24Å; Q98-E102 VanDerWaalsContact O-CG 3.27Å; Q98-E102 WeakPolarHBondContact O-CG 3.29Å; Q98-E102 PolarHBondContact O-N 3.49Å; E102-V104 VanDerWaalsContact C-N 3.31Å; E102-V104 PolarHBondContact O-N 3.44Å; E102-H105 WeakPolarHBondContact O-CB 3.45Å; E102-H105 PolarHBondContact O-N 3.47Å; E102-H105 VanDerWaalsContact O-N 3.09Å; E102-D106 PolarHBondContact O-N 3.09Å
103A92.9Very high86.8Confident20 Ų2062.4 Ų62.417%0.16531%0.308CS..Hα-helixtrans-62-39.8175.800000112L73 L81 T99 V100 D106 L107L73-A103 HydrophobicContact CD2-CB 3.68Å; L81-A103 HydrophobicContact CD2-CB 3.6Å; T99-A103 PolarHBondContact O-N 2.84Å; T99-A103 VanDerWaalsContact O-N 3.09Å; V100-A103 PolarHBondContact O-N 3.21Å; A103-D106 PolarHBondContact O-N 3.22Å; A103-L107 WeakPolarHBondContact O-CB 3.42Å; A103-L107 WeakPolarHBondContact O-CD1 3.27Å; A103-L107 VanDerWaalsContact O-CG 3.31Å; A103-L107 WeakPolarHBondContact O-CG 3.49Å; A103-L107 PolarHBondContact O-N 3.31Å; A103-L107 VanDerWaalsContact O-N 3.08Å
104V92.7Very high85.7Confident2 Ų264.7 Ų64.71%0.01233%0.33CS..Hα-helixtrans-61-44.3172.2172.50000110.9L73 V100 L101 E102 D106 L107 L108 W117 L133 L137L73-V104 HydrophobicContact CD1-CG2 3.97Å; L73-V104 HydrophobicContact CD2-CG2 3.75Å; L73-V104 HydrophobicContact CG-CG2 4.49Å; V100-V104 WeakPolarHBondContact O-CG2 3.41Å; V100-V104 PolarHBondContact O-N 3.14Å; L101-V104 PolarHBondContact O-N 3.38Å; E102-V104 VanDerWaalsContact C-N 3.31Å; E102-V104 PolarHBondContact O-N 3.44Å; V104-D106 VanDerWaalsContact C-N 3.34Å; V104-D106 PolarHBondContact O-N 2.91Å; V104-L107 PolarHBondContact O-N 3.45Å; V104-L108 HydrophobicContact CG1-CD1 3.5Å; V104-L108 HydrophobicContact CG1-CG 3.83Å; V104-L108 WeakPolarHBondContact O-CB 3.29Å; V104-L108 VanDerWaalsContact O-CG 3.3Å; V104-L108 WeakPolarHBondContact O-CG 3.26Å; V104-L108 PolarHBondContact O-N 2.97Å; V104-W117 HydrophobicContact CG1-CZ2 4.19Å; V104-L133 HydrophobicContact CG1-CD1 3.78Å; V104-L133 HydrophobicContact CG2-CD1 4.33Å; V104-L137 HydrophobicContact CG1-CD2 4.13Å; V104-L137 HydrophobicContact CG2-CD2 4.13Å
105H88.1Confident85.1Confident91 Ų9164.6 Ų64.642%0.42133%0.332SS..Hα-helixtrans-58.7-45.8178.3-177.487.4000111.8L101 E102 L107 R109 P110L101-H105 WeakPolarHBondContact O-CB 3.49Å; L101-H105 PolarHBondContact O-N 3.32Å; E102-H105 WeakPolarHBondContact O-CB 3.45Å; E102-H105 PolarHBondContact O-N 3.47Å; E102-H105 VanDerWaalsContact O-N 3.09Å; H105-L107 VanDerWaalsContact C-N 3.31Å; H105-L107 PolarHBondContact O-N 3.25Å; H105-R109 WeakPolarHBondContact O-CA 3.41Å; H105-R109 PolarHBondContact O-N 2.65Å; H105-P110 WeakPolarHBondContact O-CD 3.23Å
106D85.3Confident84.7Confident112 Ų11264.9 Ų64.960%0.59933%0.327SS*.Hα-helixtrans-65.9-32.1179.5-75.3-17.3000113.4E102 A103 V104 R109E102-D106 PolarHBondContact O-N 3.09Å; A103-D106 PolarHBondContact O-N 3.22Å; V104-D106 VanDerWaalsContact C-N 3.34Å; V104-D106 PolarHBondContact O-N 2.91Å; D106-R109 WeakPolarHBondContact O-CG 3.22Å; D106-R109 PolarHBondContact O-NE 3.25Å
107L83.9Confident84.6Confident57 Ų5765.6 Ų65.630%0.29833%0.33SS..Hα-helixtrans-74.6-52.7175.5-77164.1000111.8L73 A77 A103 V104 H105 R109 H140 F141L73-L107 HydrophobicContact CD1-CD1 3.59Å; L73-L107 HydrophobicContact CD2-CD1 4.11Å; L73-L107 HydrophobicContact CG-CD1 4Å; A77-L107 HydrophobicContact CB-CD1 4.31Å; A103-L107 WeakPolarHBondContact O-CB 3.42Å; A103-L107 WeakPolarHBondContact O-CD1 3.27Å; A103-L107 VanDerWaalsContact O-CG 3.31Å; A103-L107 WeakPolarHBondContact O-CG 3.49Å; A103-L107 PolarHBondContact O-N 3.31Å; A103-L107 VanDerWaalsContact O-N 3.08Å; V104-L107 PolarHBondContact O-N 3.45Å; H105-L107 VanDerWaalsContact C-N 3.31Å; H105-L107 PolarHBondContact O-N 3.25Å; L107-R109 VanDerWaalsContact C-N 3.3Å; L107-R109 PolarHBondContact O-N 2.98Å; L107-H140 PolarHBondContact O-CE1 2.82Å; L107-F141 HydrophobicContact CD1-CZ 4.21Å; L107-F141 HydrophobicContact CD2-CZ 4.49Å
108L82.6Confident84.5Confident8 Ų868.2 Ų68.24%0.04235%0.348CS..Hα-helixtrans-70.9-27.7-176-63.4-173.4000112.5V104 W113 W117 H140 F185V104-L108 HydrophobicContact CG1-CD1 3.5Å; V104-L108 HydrophobicContact CG1-CG 3.83Å; V104-L108 WeakPolarHBondContact O-CB 3.29Å; V104-L108 VanDerWaalsContact O-CG 3.3Å; V104-L108 WeakPolarHBondContact O-CG 3.26Å; V104-L108 PolarHBondContact O-N 2.97Å; L108-W113 HydrophobicContact CD1-CZ2 4.4Å; L108-W117 HydrophobicContact CD1-CH2 3.91Å; L108-W117 HydrophobicContact CD1-CZ2 3.87Å; L108-H140 HydrophobicContact CD2-CB 3.39Å; L108-H140 VanDerWaalsContact CD2-CG 3.48Å; L108-F185 HydrophobicContact CB-CE1 4.29Å; L108-F185 HydrophobicContact CD1-CE1 4.31Å; L108-F185 HydrophobicContact CD2-CD1 4.13Å; L108-F185 HydrophobicContact CD2-CE1 3.77Å; L108-F185 HydrophobicContact CG-CE1 4.34Å
109R78.6Confident84.4Confident181 Ų18164.7 Ų64.768%0.68333%0.333SS*.  trans42.162.2-176.1-61.2-173.9175.3-175-5.3112.3H105 D106 L107 R111H105-R109 WeakPolarHBondContact O-CA 3.41Å; H105-R109 PolarHBondContact O-N 2.65Å; D106-R109 WeakPolarHBondContact O-CG 3.22Å; D106-R109 PolarHBondContact O-NE 3.25Å; L107-R109 VanDerWaalsContact C-N 3.3Å; L107-R109 PolarHBondContact O-N 2.98Å; R109-R111 PolarHBondContact O-N 2.95Å
110P66.9Low84.3Confident21 Ų2167.7 Ų67.714%0.13635%0.347CS..  trans-65.691.8-172.728.4-35.8000111.1H105 G112 W113 L115H105-P110 WeakPolarHBondContact O-CD 3.23Å; P110-G112 PolarHBondContact O-N 3.43Å; P110-W113 HydrophobicContact CB-CD2 4.16Å; P110-W113 VanDerWaalsContact CB-CE2 3.49Å; P110-W113 HydrophobicContact CB-CG 4.2Å; P110-W113 HydrophobicContact CB-CZ2 4.02Å; P110-L115 HydrophobicContact CB-CD2 4.01Å; P110-L115 HydrophobicContact CG-CD1 4.28Å; P110-L115 HydrophobicContact CG-CD2 4.02Å; P110-L115 HydrophobicContact CG-CG 4.29Å
111R60.8Low84.2Confident225 Ų22568.7 Ų68.785%0.84935%0.354SS*.SBendtrans-78.187.3178.4-67.4-169.2-176-162.21.3109.8R109R109-R111 PolarHBondContact O-N 2.95Å
112G58.5Low84.2Confident85 Ų8567.9 Ų67.988%0.87635%0.35SS*.SBendtrans84.78.316800000116.4P110P110-G112 PolarHBondContact O-N 3.43Å
113W72.7Confident84.4Confident45 Ų4564.8 Ų64.817%0.1734%0.335CS..PPolyproline II helixtrans-100.2143.1169.168.9-82.7000110.9L108 P110 L115 W117 S136 F185L108-W113 HydrophobicContact CD1-CZ2 4.4Å; P110-W113 HydrophobicContact CB-CD2 4.16Å; P110-W113 VanDerWaalsContact CB-CE2 3.49Å; P110-W113 HydrophobicContact CB-CG 4.2Å; P110-W113 HydrophobicContact CB-CZ2 4.02Å; W113-L115 HydrophobicContact CE3-CD2 4.41Å; W113-L115 HydrophobicContact CH2-CD2 3.74Å; W113-L115 HydrophobicContact CZ2-CD2 3.88Å; W113-L115 HydrophobicContact CZ3-CD2 4.01Å; W113-L115 PolarHBondContact O-N 2.98Å; W113-W117 AromaticContact CH2-CH2 3.55Å; W113-W117 HydrophobicContact CH2-CH2 3.55Å; W113-W117 AromaticContact CH2-CZ3 3.91Å; W113-W117 HydrophobicContact CH2-CZ3 3.91Å; W113-W117 HydrophobicContact CZ2-CH2 4.44Å; W113-W117 HydrophobicContact CZ3-CH2 4.2Å; W113-W117 HydrophobicContact CZ3-CZ3 4.13Å; W113-S136 WeakPolarHBondContact CH2-OG 3.49Å; W113-F185 HydrophobicContact CH2-CZ 4.39Å; W113-F185 AromaticContact CZ2-CE1 3.82Å; W113-F185 HydrophobicContact CZ2-CE1 3.82Å; W113-F185 HydrophobicContact CZ2-CZ 4.07Å
114A72.8Confident84.4Confident65 Ų6566.4 Ų66.454%0.53735%0.354SS..PPolyproline II helixtrans-74.5123-178.600000110.6
115L83.1Confident84.6Confident60 Ų6069.8 Ų69.831%0.31437%0.369SS..PPolyproline II helixtrans-68131.1169.1-62.7-178.9000109P110 W113 W117P110-L115 HydrophobicContact CB-CD2 4.01Å; P110-L115 HydrophobicContact CG-CD1 4.28Å; P110-L115 HydrophobicContact CG-CD2 4.02Å; P110-L115 HydrophobicContact CG-CG 4.29Å; W113-L115 HydrophobicContact CE3-CD2 4.41Å; W113-L115 HydrophobicContact CH2-CD2 3.74Å; W113-L115 HydrophobicContact CZ2-CD2 3.88Å; W113-L115 HydrophobicContact CZ3-CD2 4.01Å; W113-L115 PolarHBondContact O-N 2.98Å; L115-W117 VanDerWaalsContact C-N 3.33Å; L115-W117 HydrophobicContact CD2-CH2 3.77Å; L115-W117 HydrophobicContact CD2-CZ2 3.6Å; L115-W117 HydrophobicContact CD2-CZ3 4.38Å
116R88.9Confident84.8Confident139 Ų13966.9 Ų66.953%0.52536%0.356SS..  trans-98.720.5-178.1-61-60.7-167.6167.87.5112.7A129 H132R116-A129 WeakPolarHBondContact O-CB 3.2Å; R116-H132 HydrophobicContact CB-CB 4Å; R116-H132 VanDerWaalsContact CB-CD2 3.45Å; R116-H132 WeakPolarHBondContact CB-CD2 3.43Å
117W94.1Very high85.3Confident23 Ų2362.3 Ų62.39%0.08733%0.332CS..  trans-142.7152.8179.36284.5000110.7V104 L108 W113 L115 I122 A129 H132 L133 S136V104-W117 HydrophobicContact CG1-CZ2 4.19Å; L108-W117 HydrophobicContact CD1-CH2 3.91Å; L108-W117 HydrophobicContact CD1-CZ2 3.87Å; W113-W117 AromaticContact CH2-CH2 3.55Å; W113-W117 HydrophobicContact CH2-CH2 3.55Å; W113-W117 AromaticContact CH2-CZ3 3.91Å; W113-W117 HydrophobicContact CH2-CZ3 3.91Å; W113-W117 HydrophobicContact CZ2-CH2 4.44Å; W113-W117 HydrophobicContact CZ3-CH2 4.2Å; W113-W117 HydrophobicContact CZ3-CZ3 4.13Å; L115-W117 VanDerWaalsContact C-N 3.33Å; L115-W117 HydrophobicContact CD2-CH2 3.77Å; L115-W117 HydrophobicContact CD2-CZ2 3.6Å; L115-W117 HydrophobicContact CD2-CZ3 4.38Å; W117-I122 HydrophobicContact CB-CD1 4.1Å; W117-I122 HydrophobicContact CB-CG1 4.39Å; W117-A129 HydrophobicContact CB-CB 4.01Å; W117-H132 HydrophobicContact CE3-CB 3.9Å; W117-H132 HydrophobicContact CZ3-CB 4.11Å; W117-H132 WeakPolarHBondContact CZ3-O 3.29Å; W117-L133 HydrophobicContact CD2-CB 3.98Å; W117-L133 HydrophobicContact CD2-CD1 4.21Å; W117-L133 HydrophobicContact CE3-CB 4.07Å; W117-L133 HydrophobicContact CG-CB 4.27Å; W117-L133 HydrophobicContact CH2-CD1 4.32Å; W117-L133 HydrophobicContact CZ2-CD1 3.75Å; W117-L133 HydrophobicContact CZ3-CB 4.46Å; W117-S136 WeakPolarHBondContact CH2-OG 3.41Å; W117-S136 WeakPolarHBondContact CZ3-OG 3.31Å
118S94.6Very high85.8Confident54 Ų5460 Ų6038%0.37832%0.32SS..  trans-143.8165.6174.767.80000109.4D120 S121 I122S118-D120 VanDerWaalsContact C-N 3.26Å; S118-D120 PolarHBondContact O-N 3.48Å; S118-S121 PolarHBondContact N-OG 3.41Å; S118-S121 PolarHBondContact O-N 2.8Å; S118-S121 VanDerWaalsContact O-N 3.15Å; S118-S121 PolarHBondContact O-OG 2.88Å; S118-S121 PolarHBondContact OG-N 2.82Å; S118-S121 VanDerWaalsContact OG-N 3.13Å; S118-S121 PolarHBondContact OG-OG 3.31Å; S118-I122 WeakPolarHBondContact O-CG1 2.94Å; S118-I122 PolarHBondContact O-N 3.32Å
119V96Very high86.4Confident16 Ų1659.8 Ų59.810%0.09732%0.319CS..Hα-helixtrans-51.1-49173.4171.70000110.9K94 L97 Q98 L101 S121 I122 H123K94-V119 HydrophobicContact CB-CG1 3.84Å; K94-V119 HydrophobicContact CG-CG1 3.91Å; K94-V119 WeakPolarHBondContact O-CG1 3.49Å; L97-V119 HydrophobicContact CB-CG1 4.01Å; L97-V119 HydrophobicContact CB-CG2 4.18Å; L97-V119 HydrophobicContact CD1-CG1 4.25Å; Q98-V119 HydrophobicContact CB-CG2 4.04Å; Q98-V119 VanDerWaalsContact OE1-CG2 3.23Å; L101-V119 HydrophobicContact CD1-CG2 3.93Å; V119-S121 VanDerWaalsContact C-N 3.34Å; V119-S121 PolarHBondContact O-N 3.44Å; V119-I122 PolarHBondContact O-N 2.8Å; V119-H123 VanDerWaalsContact O-CB 3.25Å; V119-H123 WeakPolarHBondContact O-CB 3.34Å; V119-H123 PolarHBondContact O-N 2.98Å
120D93.4Very high87.3Confident105 Ų10551.2 Ų51.256%0.56129%0.287SS*.Hα-helixtrans-64.4-37.5-178.5-59.6-54.9000112.5K94 S118 G124K94-D120 IonicContact NZ-OD1 2.76Å; S118-D120 VanDerWaalsContact C-N 3.26Å; S118-D120 PolarHBondContact O-N 3.48Å; D120-G124 WeakPolarHBondContact O-CA 3.31Å; D120-G124 PolarHBondContact O-N 2.79Å
121S94.2Very high88.8Confident22 Ų2250.2 Ų50.215%0.15428%0.28CS..Hα-helixtrans-69-39.1178.3690000112.6S118 V119 K125 N126 A129S118-S121 PolarHBondContact N-OG 3.41Å; S118-S121 PolarHBondContact O-N 2.8Å; S118-S121 VanDerWaalsContact O-N 3.15Å; S118-S121 PolarHBondContact O-OG 2.88Å; S118-S121 PolarHBondContact OG-N 2.82Å; S118-S121 VanDerWaalsContact OG-N 3.13Å; S118-S121 PolarHBondContact OG-OG 3.31Å; V119-S121 VanDerWaalsContact C-N 3.34Å; V119-S121 PolarHBondContact O-N 3.44Å; S121-K125 PolarHBondContact O-N 3.36Å; S121-N126 WeakPolarHBondContact O-CB 3.48Å; S121-N126 PolarHBondContact O-N 3.23Å; S121-A129 WeakPolarHBondContact OG-CB 3.26Å
122I96.8Very high90.4Very high0 Ų040.5 Ų40.50%025%0.245CC..Hα-helixtrans-73-46.2179.6-59.6-60.7000109.7Y64 L69 L97 L101 W117 S118 V119 G124 K125 A129 I130 L133Y64-I122 WeakPolarHBondContact CA-O 3.48Å; Y64-I122 WeakPolarHBondContact CB-O 3.43Å; L69-I122 HydrophobicContact CD1-CG2 3.91Å; L97-I122 HydrophobicContact CD1-CB 4.3Å; L97-I122 HydrophobicContact CD1-CG2 4.21Å; L97-I122 HydrophobicContact CD2-CB 4.27Å; L97-I122 HydrophobicContact CD2-CG2 3.64Å; L101-I122 HydrophobicContact CD1-CG1 4.44Å; W117-I122 HydrophobicContact CB-CD1 4.1Å; W117-I122 HydrophobicContact CB-CG1 4.39Å; S118-I122 WeakPolarHBondContact O-CG1 2.94Å; S118-I122 PolarHBondContact O-N 3.32Å; V119-I122 PolarHBondContact O-N 2.8Å; I122-G124 VanDerWaalsContact C-N 3.29Å; I122-G124 PolarHBondContact O-N 2.96Å; I122-K125 PolarHBondContact O-N 3.48Å; I122-A129 HydrophobicContact CD1-CB 4.05Å; I122-I130 HydrophobicContact CD1-CB 4.34Å; I122-I130 HydrophobicContact CD1-CG1 3.62Å; I122-I130 HydrophobicContact CG2-CG1 4.42Å; I122-L133 HydrophobicContact CD1-CD2 4.23Å
123H96.1Very high92.3Very high30 Ų3036.5 Ų36.514%0.13920%0.203CC..Hα-helixtrans-62.4-38.1176.4-170.4-98.7000112.1Y64 Q93 K94 L97 V119 K125Y64-H123 WeakPolarHBondContact O-CA 3.32Å; Q93-H123 PolarHBondContact OE1-NE2 3.03Å; K94-H123 WeakPolarHBondContact CE-ND1 3.32Å; K94-H123 HydrophobicContact CG-CB 4.37Å; L97-H123 HydrophobicContact CD1-CB 3.71Å; V119-H123 VanDerWaalsContact O-CB 3.25Å; V119-H123 WeakPolarHBondContact O-CB 3.34Å; V119-H123 PolarHBondContact O-N 2.98Å; H123-K125 PolarHBondContact O-N 3.2Å; H123-K125 VanDerWaalsContact O-N 3.13Å
124G93.4Very high93.5Very high54 Ų5434.4 Ų34.456%0.55720%0.195SC*.THydrogen-bonded Turntrans-74.714.1172.600000114.8D120 I122 N126D120-G124 WeakPolarHBondContact O-CA 3.31Å; D120-G124 PolarHBondContact O-N 2.79Å; I122-G124 VanDerWaalsContact C-N 3.29Å; I122-G124 PolarHBondContact O-N 2.96Å; G124-N126 PolarHBondContact O-N 3.12Å
125K94.8Very high94.5Very high73 Ų7331.8 Ų31.832%0.31717%0.172SC..THydrogen-bonded Turntrans58.430.5173.4-61.9-175173.5-177.30114.3E60 E61 Y64 S121 I122 H123 L127E60-K125 HydrophobicContact CB-CB 4.17Å; E61-K125 WeakPolarHBondContact OE1-CD 3.34Å; E61-K125 IonicContact OE1-NZ 2.76Å; E61-K125 PolarHBondContact OE1-NZ 3.27Å; E61-K125 IonicContact OE2-NZ 3.66Å; E61-K125 PolarHBondContact OE2-NZ 2.89Å; Y64-K125 HydrophobicContact CG-CG 4.16Å; S121-K125 PolarHBondContact O-N 3.36Å; I122-K125 PolarHBondContact O-N 3.48Å; H123-K125 PolarHBondContact O-N 3.2Å; H123-K125 VanDerWaalsContact O-N 3.13Å; K125-L127 PolarHBondContact O-N 3.15Å
126N93.3Very high95Very high29 Ų2929.4 Ų29.416%0.15516%0.161CC..  trans-72.4101.3177.9-175-30.1000110S121 G124 V128 A129 I130S121-N126 WeakPolarHBondContact O-CB 3.48Å; S121-N126 PolarHBondContact O-N 3.23Å; G124-N126 PolarHBondContact O-N 3.12Å; N126-V128 PolarHBondContact O-N 3.06Å; N126-V128 WeakPolarHBondContact OD1-CB 3.43Å; N126-V128 PolarHBondContact OD1-N 3.39Å; N126-A129 HydrophobicContact CB-CB 4.02Å; N126-A129 PolarHBondContact O-N 2.99Å; N126-A129 VanDerWaalsContact O-N 3.13Å; N126-A129 PolarHBondContact OD1-N 3.09Å; N126-I130 WeakPolarHBondContact O-CG1 3.33Å; N126-I130 PolarHBondContact O-N 3.26Å
127L94.9Very high95.2Very high17 Ų1722.9 Ų22.99%0.08914%0.136CC..Hα-helixtrans-57.3-35.9-179.2-177.656.3000112.7I24 F34 L59 E60 K125 I130 L131I24-L127 HydrophobicContact CD1-CB 4.23Å; I24-L127 HydrophobicContact CD1-CD2 3.96Å; I24-L127 HydrophobicContact CD1-CG 4.19Å; F34-L127 HydrophobicContact CE1-CD2 4.45Å; F34-L127 HydrophobicContact CZ-CD2 3.73Å; L59-L127 HydrophobicContact CB-CD1 4.04Å; L59-L127 HydrophobicContact CD1-CD1 4.24Å; E60-L127 HydrophobicContact CG-CB 3.72Å; E60-L127 HydrophobicContact CG-CD1 3.99Å; E60-L127 HydrophobicContact CG-CG 4.27Å; E60-L127 WeakPolarHBondContact OE1-CD2 3.46Å; K125-L127 PolarHBondContact O-N 3.15Å; L127-I130 PolarHBondContact O-N 3.19Å; L127-L131 HydrophobicContact CD1-CD1 4.01Å; L127-L131 HydrophobicContact CD1-CD2 4.32Å; L127-L131 HydrophobicContact CD1-CG 3.83Å; L127-L131 HydrophobicContact CD2-CD1 4.38Å; L127-L131 HydrophobicContact CG-CD1 3.8Å; L127-L131 HydrophobicContact CG-CG 4.12Å; L127-L131 WeakPolarHBondContact O-CB 3.49Å; L127-L131 WeakPolarHBondContact O-CG 3.45Å; L127-L131 PolarHBondContact O-N 2.84Å
128V94.9Very high95.2Very high9 Ų922 Ų226%0.05513%0.133CC..Hα-helixtrans-63.5-45.5178.61780000110.3I24 N126 L131 H132 V153 V155 E172 L174I24-V128 HydrophobicContact CD1-CG2 3.71Å; I24-V128 HydrophobicContact CG1-CG2 3.52Å; N126-V128 PolarHBondContact O-N 3.06Å; N126-V128 WeakPolarHBondContact OD1-CB 3.43Å; N126-V128 PolarHBondContact OD1-N 3.39Å; V128-L131 PolarHBondContact O-N 3.38Å; V128-H132 PolarHBondContact O-CD2 2.94Å; V128-H132 PolarHBondContact O-N 3.18Å; V128-V153 HydrophobicContact CG2-CG2 4.43Å; V128-V155 HydrophobicContact CG2-CG2 4.06Å; V128-E172 HydrophobicContact CG1-CB 4.33Å; V128-E172 HydrophobicContact CG1-CG 4.31Å; V128-L174 HydrophobicContact CG1-CD2 4.05Å
129A95.4Very high94.9Very high2 Ų220.6 Ų20.62%0.01712%0.122CC..Hα-helixtrans-63.5-43176.500000112R116 W117 S121 I122 N126 H132 L133R116-A129 WeakPolarHBondContact O-CB 3.2Å; W117-A129 HydrophobicContact CB-CB 4.01Å; S121-A129 WeakPolarHBondContact OG-CB 3.26Å; I122-A129 HydrophobicContact CD1-CB 4.05Å; N126-A129 HydrophobicContact CB-CB 4.02Å; N126-A129 PolarHBondContact O-N 2.99Å; N126-A129 VanDerWaalsContact O-N 3.13Å; N126-A129 PolarHBondContact OD1-N 3.09Å; A129-H132 PolarHBondContact O-N 3.26Å; A129-L133 PolarHBondContact O-N 3.48Å
130I97.8Very high94.4Very high1 Ų122.4 Ų22.41%0.00513%0.129CC..Hα-helixtrans-61.2-46.1176.6-67.1167.6000110.6L59 L63 I122 N126 L127 L133 L134L59-I130 HydrophobicContact CB-CG2 4.13Å; L63-I130 HydrophobicContact CD2-CG2 3.66Å; I122-I130 HydrophobicContact CD1-CB 4.34Å; I122-I130 HydrophobicContact CD1-CG1 3.62Å; I122-I130 HydrophobicContact CG2-CG1 4.42Å; N126-I130 WeakPolarHBondContact O-CG1 3.33Å; N126-I130 PolarHBondContact O-N 3.26Å; L127-I130 PolarHBondContact O-N 3.19Å; I130-L133 WeakPolarHBondContact O-CB 3.2Å; I130-L133 PolarHBondContact O-N 2.84Å; I130-L134 HydrophobicContact CG2-CD1 3.85Å; I130-L134 HydrophobicContact CG2-CG 4.32Å; I130-L134 VanDerWaalsContact O-CG 3.3Å; I130-L134 WeakPolarHBondContact O-CG 3.3Å; I130-L134 PolarHBondContact O-N 3.01Å
131L97.4Very high94Very high0 Ų020 Ų200%011%0.113CC..Hα-helixtrans-64-43.3178.8-71.2172.1000111.9F34 V38 L41 L59 L127 V128 L133 L134 V135 L174F34-L131 HydrophobicContact CE2-CD1 3.52Å; F34-L131 HydrophobicContact CZ-CD1 4.01Å; V38-L131 HydrophobicContact CG2-CD1 4.26Å; V38-L131 HydrophobicContact CG2-CD2 4.15Å; L41-L131 HydrophobicContact CD1-CD2 3.6Å; L59-L131 HydrophobicContact CD1-CD2 3.77Å; L127-L131 HydrophobicContact CD1-CD1 4.01Å; L127-L131 HydrophobicContact CD1-CD2 4.32Å; L127-L131 HydrophobicContact CD1-CG 3.83Å; L127-L131 HydrophobicContact CD2-CD1 4.38Å; L127-L131 HydrophobicContact CG-CD1 3.8Å; L127-L131 HydrophobicContact CG-CG 4.12Å; L127-L131 WeakPolarHBondContact O-CB 3.49Å; L127-L131 WeakPolarHBondContact O-CG 3.45Å; L127-L131 PolarHBondContact O-N 2.84Å; V128-L131 PolarHBondContact O-N 3.38Å; L131-L133 VanDerWaalsContact C-N 3.31Å; L131-L133 PolarHBondContact O-N 3.06Å; L131-L134 PolarHBondContact O-N 3.41Å; L131-V135 WeakPolarHBondContact O-CB 3.46Å; L131-V135 VanDerWaalsContact O-CG2 3.27Å; L131-V135 WeakPolarHBondContact O-CG2 3.43Å; L131-V135 PolarHBondContact O-N 2.78Å; L131-L174 HydrophobicContact CB-CD2 4.1Å; L131-L174 HydrophobicContact CD1-CD1 3.87Å
132H95.6Very high93.5Very high22 Ų2225.2 Ų25.210%0.10213%0.13CC..Hα-helixtrans-59.3-42175-81.6-59.8000112.8R116 W117 V128 A129 S136 E172 E173R116-H132 HydrophobicContact CB-CB 4Å; R116-H132 VanDerWaalsContact CB-CD2 3.45Å; R116-H132 WeakPolarHBondContact CB-CD2 3.43Å; W117-H132 HydrophobicContact CE3-CB 3.9Å; W117-H132 HydrophobicContact CZ3-CB 4.11Å; W117-H132 WeakPolarHBondContact CZ3-O 3.29Å; V128-H132 PolarHBondContact O-CD2 2.94Å; V128-H132 PolarHBondContact O-N 3.18Å; A129-H132 PolarHBondContact O-N 3.26Å; H132-S136 WeakPolarHBondContact O-CB 3.07Å; H132-S136 PolarHBondContact O-N 2.97Å; H132-S136 PolarHBondContact O-OG 3.44Å; H132-E172 IonicContact NE2-OE2 2.63Å; H132-E173 PolarHBondContact CE1-O 3.3Å
133L97Very high92.9Very high1 Ų126 Ų261%0.00514%0.136CC..Hα-helixtrans-62-50.3176.1172.761.5000110.9L69 L101 V104 W117 I122 A129 I130 L131 S136 L137L69-L133 HydrophobicContact CD1-CD2 3.89Å; L69-L133 HydrophobicContact CD2-CD2 3.96Å; L101-L133 HydrophobicContact CD2-CD1 4.28Å; L101-L133 HydrophobicContact CD2-CD2 3.84Å; V104-L133 HydrophobicContact CG1-CD1 3.78Å; V104-L133 HydrophobicContact CG2-CD1 4.33Å; W117-L133 HydrophobicContact CD2-CB 3.98Å; W117-L133 HydrophobicContact CD2-CD1 4.21Å; W117-L133 HydrophobicContact CE3-CB 4.07Å; W117-L133 HydrophobicContact CG-CB 4.27Å; W117-L133 HydrophobicContact CH2-CD1 4.32Å; W117-L133 HydrophobicContact CZ2-CD1 3.75Å; W117-L133 HydrophobicContact CZ3-CB 4.46Å; I122-L133 HydrophobicContact CD1-CD2 4.23Å; A129-L133 PolarHBondContact O-N 3.48Å; I130-L133 WeakPolarHBondContact O-CB 3.2Å; I130-L133 PolarHBondContact O-N 2.84Å; L131-L133 VanDerWaalsContact C-N 3.31Å; L131-L133 PolarHBondContact O-N 3.06Å; L133-S136 WeakPolarHBondContact O-CB 3.46Å; L133-S136 PolarHBondContact O-N 3.44Å; L133-L137 HydrophobicContact CD1-CD1 4.08Å; L133-L137 HydrophobicContact CD1-CG 4.25Å; L133-L137 HydrophobicContact CG-CD1 4.18Å; L133-L137 WeakPolarHBondContact O-CG 3.46Å; L133-L137 PolarHBondContact O-N 3.5Å
134L98Very high92.3Very high0 Ų030.7 Ų30.70%017%0.169CC..Hα-helixtrans-65.4-42.6-177.9-69.9176.2000112.8L41 I45 L59 L63 L69 L72 I130 L131 S136 L137 A138L41-L134 HydrophobicContact CB-CD1 4.48Å; L41-L134 HydrophobicContact CD1-CB 4.05Å; L41-L134 HydrophobicContact CD2-CB 4.16Å; I45-L134 HydrophobicContact CD1-CD1 3.75Å; I45-L134 HydrophobicContact CD1-CD2 3.66Å; I45-L134 HydrophobicContact CD1-CG 4.33Å; I45-L134 HydrophobicContact CG1-CD2 4.36Å; L59-L134 HydrophobicContact CD1-CD1 3.99Å; L59-L134 HydrophobicContact CD2-CD1 3.96Å; L63-L134 HydrophobicContact CD2-CD1 3.85Å; L63-L134 HydrophobicContact CD2-CD2 4.06Å; L63-L134 HydrophobicContact CD2-CG 4.24Å; L69-L134 HydrophobicContact CD2-CD2 4.24Å; L72-L134 HydrophobicContact CD2-CD2 3.99Å; I130-L134 HydrophobicContact CG2-CD1 3.85Å; I130-L134 HydrophobicContact CG2-CG 4.32Å; I130-L134 VanDerWaalsContact O-CG 3.3Å; I130-L134 WeakPolarHBondContact O-CG 3.3Å; I130-L134 PolarHBondContact O-N 3.01Å; L131-L134 PolarHBondContact O-N 3.41Å; L134-S136 VanDerWaalsContact C-N 3.28Å; L134-S136 PolarHBondContact O-N 3.33Å; L134-L137 PolarHBondContact O-N 2.91Å; L134-A138 WeakPolarHBondContact O-CB 3.27Å; L134-A138 PolarHBondContact O-N 3.12Å
135V95.6Very high92Very high10 Ų1030.3 Ų30.36%0.06115%0.154CC..Hα-helixtrans-57.9-45.4172.6168.30000109.8L37 L41 L131 L137 A138 M139 L147 T175 M181L37-V135 HydrophobicContact CD1-CG2 4.12Å; L41-V135 HydrophobicContact CD1-CG2 4.07Å; L131-V135 WeakPolarHBondContact O-CB 3.46Å; L131-V135 VanDerWaalsContact O-CG2 3.27Å; L131-V135 WeakPolarHBondContact O-CG2 3.43Å; L131-V135 PolarHBondContact O-N 2.78Å; V135-L137 VanDerWaalsContact C-N 3.35Å; V135-L137 PolarHBondContact O-N 3.4Å; V135-A138 PolarHBondContact O-N 3.45Å; V135-M139 HydrophobicContact CG1-CG 4.31Å; V135-M139 WeakPolarHBondContact O-CB 3.46Å; V135-M139 WeakPolarHBondContact O-CG 3.43Å; V135-M139 PolarHBondContact O-N 3.49Å; V135-L147 HydrophobicContact CG1-CD1 4.1Å; V135-L147 HydrophobicContact CG2-CD1 4.5Å; V135-T175 HydrophobicContact CG1-CG2 4.44Å; V135-T175 HydrophobicContact CG2-CG2 4.17Å; V135-M181 HydrophobicContact CG1-SD 4.14Å
136S92.6Very high91.6Very high10 Ų1037.2 Ų37.27%0.0718%0.178CC..Hα-helixtrans-62.5-41.2179.4-58.90000112.5W113 W117 H132 L133 L134 H140W113-S136 WeakPolarHBondContact CH2-OG 3.49Å; W117-S136 WeakPolarHBondContact CH2-OG 3.41Å; W117-S136 WeakPolarHBondContact CZ3-OG 3.31Å; H132-S136 WeakPolarHBondContact O-CB 3.07Å; H132-S136 PolarHBondContact O-N 2.97Å; H132-S136 PolarHBondContact O-OG 3.44Å; L133-S136 WeakPolarHBondContact O-CB 3.46Å; L133-S136 PolarHBondContact O-N 3.44Å; L134-S136 VanDerWaalsContact C-N 3.28Å; L134-S136 PolarHBondContact O-N 3.33Å; S136-H140 VanDerWaalsContact O-CB 3.28Å; S136-H140 WeakPolarHBondContact O-CB 3.2Å; S136-H140 PolarHBondContact O-N 3.41Å
137L94.1Very high91.6Very high3 Ų336.7 Ų36.72%0.01618%0.175CC..Hα-helixtrans-67.2-47.5175.9-70173.3000111.9W44 L72 L73 V104 L133 L134 V135 M139 H140 F141W44-L137 HydrophobicContact CH2-CB 4.08Å; L72-L137 HydrophobicContact CD2-CD1 4.44Å; L73-L137 HydrophobicContact CD1-CD2 3.91Å; V104-L137 HydrophobicContact CG1-CD2 4.13Å; V104-L137 HydrophobicContact CG2-CD2 4.13Å; L133-L137 HydrophobicContact CD1-CD1 4.08Å; L133-L137 HydrophobicContact CD1-CG 4.25Å; L133-L137 HydrophobicContact CG-CD1 4.18Å; L133-L137 WeakPolarHBondContact O-CG 3.46Å; L133-L137 PolarHBondContact O-N 3.5Å; L134-L137 PolarHBondContact O-N 2.91Å; V135-L137 VanDerWaalsContact C-N 3.35Å; V135-L137 PolarHBondContact O-N 3.4Å; L137-M139 VanDerWaalsContact C-N 3.27Å; L137-M139 PolarHBondContact O-N 2.88Å; L137-H140 PolarHBondContact O-N 3.08Å; L137-F141 HydrophobicContact CD2-CD2 4.44Å; L137-F141 HydrophobicContact CD2-CE2 4.08Å; L137-F141 WeakPolarHBondContact O-CD2 3.27Å; L137-F141 PolarHBondContact O-N 3.48Å
138A93.1Very high91.5Very high3 Ų336.6 Ų36.63%0.02518%0.175CC..Hα-helixtrans-57.2-43.217800000111.3L41 W44 L134 V135 R142 A143 I145L41-A138 HydrophobicContact CD2-CB 4.3Å; W44-A138 HydrophobicContact CE3-CB 4.16Å; W44-A138 HydrophobicContact CH2-CB 3.9Å; W44-A138 HydrophobicContact CZ2-CB 4.34Å; W44-A138 HydrophobicContact CZ3-CB 3.8Å; L134-A138 WeakPolarHBondContact O-CB 3.27Å; L134-A138 PolarHBondContact O-N 3.12Å; V135-A138 PolarHBondContact O-N 3.45Å; A138-R142 WeakPolarHBondContact O-CA 3.27Å; A138-R142 PolarHBondContact O-N 3.44Å; A138-R142 VanDerWaalsContact O-N 3.1Å; A138-A143 HydrophobicContact CB-CB 3.98Å; A138-A143 WeakPolarHBondContact O-CB 3.37Å; A138-A143 PolarHBondContact O-N 3.2Å; A138-I145 HydrophobicContact CB-CD1 4.07Å
139M87.9Confident91.2Very high26 Ų2639.8 Ų39.813%0.12819%0.189CC..Hα-helixtrans-68.8-46.7177.9-67.6-56.2-55.400112.4V135 L137 F141 R142 L147 M181 M182 F185V135-M139 HydrophobicContact CG1-CG 4.31Å; V135-M139 WeakPolarHBondContact O-CB 3.46Å; V135-M139 WeakPolarHBondContact O-CG 3.43Å; V135-M139 PolarHBondContact O-N 3.49Å; L137-M139 VanDerWaalsContact C-N 3.27Å; L137-M139 PolarHBondContact O-N 2.88Å; M139-F141 PolarHBondContact O-N 3.44Å; M139-R142 PolarHBondContact O-N 3.42Å; M139-L147 HydrophobicContact CG-CD1 4.09Å; M139-L147 HydrophobicContact SD-CD1 3.68Å; M139-M181 HydrophobicContact CE-CB 3.64Å; M139-M181 HydrophobicContact CG-CB 4.14Å; M139-M181 HydrophobicContact SD-CB 4.16Å; M139-M181 HydrophobicContact SD-CE 4.42Å; M139-M182 HydrophobicContact CE-CB 4.26Å; M139-M182 HydrophobicContact CE-CG 3.27Å; M139-F185 HydrophobicContact CB-CD2 3.98Å; M139-F185 HydrophobicContact CB-CE2 3.72Å
140H85.9Confident91.1Very high54 Ų5443.9 Ų43.925%0.2521%0.208CC..Hα-helixtrans-61-45.5-179.6178.280.6000112.3L107 L108 S136 L137 R142 F185L107-H140 PolarHBondContact O-CE1 2.82Å; L108-H140 HydrophobicContact CD2-CB 3.39Å; L108-H140 VanDerWaalsContact CD2-CG 3.48Å; S136-H140 VanDerWaalsContact O-CB 3.28Å; S136-H140 WeakPolarHBondContact O-CB 3.2Å; S136-H140 PolarHBondContact O-N 3.41Å; L137-H140 PolarHBondContact O-N 3.08Å; H140-R142 PolarHBondContact O-N 3.27Å; H140-F185 HydrophobicContact CB-CD1 4.25Å; H140-F185 HydrophobicContact CB-CG 4.44Å
141F84.8Confident91Very high54 Ų5444 Ų4424%0.23721%0.209CC..THydrogen-bonded Turntrans-83.72.7179.4-73-76.4000113.6L73 L76 A77 L107 L137 M139 A143L73-F141 HydrophobicContact CD1-CE2 4.22Å; L76-F141 HydrophobicContact CB-CD1 3.91Å; L76-F141 HydrophobicContact CB-CD2 3.97Å; L76-F141 HydrophobicContact CB-CE1 3.89Å; L76-F141 HydrophobicContact CB-CE2 3.95Å; L76-F141 HydrophobicContact CB-CG 3.95Å; L76-F141 HydrophobicContact CB-CZ 3.91Å; L76-F141 HydrophobicContact CD1-CD2 3.81Å; L76-F141 HydrophobicContact CD1-CE2 4.2Å; L76-F141 HydrophobicContact CD1-CG 4.24Å; L76-F141 HydrophobicContact CD2-CB 4.34Å; L76-F141 HydrophobicContact CD2-CG 4.42Å; L76-F141 HydrophobicContact CG-CD2 4.4Å; L76-F141 HydrophobicContact CG-CG 4.44Å; L76-F141 WeakPolarHBondContact O-CE1 3.35Å; A77-F141 HydrophobicContact CB-CE1 4.45Å; A77-F141 HydrophobicContact CB-CZ 4.2Å; L107-F141 HydrophobicContact CD1-CZ 4.21Å; L107-F141 HydrophobicContact CD2-CZ 4.49Å; L137-F141 HydrophobicContact CD2-CD2 4.44Å; L137-F141 HydrophobicContact CD2-CE2 4.08Å; L137-F141 WeakPolarHBondContact O-CD2 3.27Å; L137-F141 PolarHBondContact O-N 3.48Å; M139-F141 PolarHBondContact O-N 3.44Å; F141-A143 VanDerWaalsContact C-N 3.27Å; F141-A143 PolarHBondContact O-N 3.09Å
142R84.9Confident90.9Very high132 Ų13247.4 Ų47.450%0.49823%0.23SC..THydrogen-bonded Turntrans49.151-177.4-56.9-176.1-177.7174.62.4111.3A138 M139 H140 E186 R276A138-R142 WeakPolarHBondContact O-CA 3.27Å; A138-R142 PolarHBondContact O-N 3.44Å; A138-R142 VanDerWaalsContact O-N 3.1Å; M139-R142 PolarHBondContact O-N 3.42Å; H140-R142 PolarHBondContact O-N 3.27Å; R142-E186 IonicContact NH2-OE1 3.99Å; R142-E186 IonicContact NH2-OE2 3.21Å; R142-E186 PolarHBondContact NH2-OE2 3.29Å; R142-R276 VanDerWaalsContact NH2-NH1 3.19Å
143A83.7Confident90.9Very high15 Ų1546.4 Ų46.412%0.12423%0.225CC..  trans-50.1140178.800000110.4W44 A138 F141 I145W44-A143 HydrophobicContact CD2-CB 4.2Å; W44-A143 HydrophobicContact CG-CB 4.45Å; W44-A143 HydrophobicContact CZ2-CB 3.86Å; A138-A143 HydrophobicContact CB-CB 3.98Å; A138-A143 WeakPolarHBondContact O-CB 3.37Å; A138-A143 PolarHBondContact O-N 3.2Å; F141-A143 VanDerWaalsContact C-N 3.27Å; F141-A143 PolarHBondContact O-N 3.09Å; A143-I145 HydrophobicContact CB-CD1 3.97Å; A143-I145 HydrophobicContact CB-CG1 3.86Å; A143-I145 PolarHBondContact O-N 3.21Å
144P82.9Confident90.7Very high130 Ų13050 Ų5084%0.84424%0.242SC*.SBendtrans-76.847.7-177.234.1-37.4000112
145I86.5Confident90.4Very high45 Ų4550 Ų5023%0.23124%0.242CC..SBendtrans-128.6154.6-177.865.9-174.4000110.1V40 L41 W44 A138 A143 L147V40-I145 HydrophobicContact CG1-CB 3.9Å; V40-I145 HydrophobicContact CG1-CD1 3.98Å; V40-I145 HydrophobicContact CG1-CG1 4.19Å; L41-I145 HydrophobicContact CD2-CD1 4.36Å; W44-I145 HydrophobicContact CB-CD1 3.73Å; W44-I145 HydrophobicContact CB-CG2 3.89Å; W44-I145 HydrophobicContact CD2-CD1 3.93Å; W44-I145 HydrophobicContact CE3-CD1 4.26Å; W44-I145 HydrophobicContact CG-CD1 3.67Å; W44-I145 HydrophobicContact CG-CG2 4.13Å; A138-I145 HydrophobicContact CB-CD1 4.07Å; A143-I145 HydrophobicContact CB-CD1 3.97Å; A143-I145 HydrophobicContact CB-CG1 3.86Å; A143-I145 PolarHBondContact O-N 3.21Å; I145-L147 HydrophobicContact CD1-CD2 4.02Å; I145-L147 HydrophobicContact CG1-CD2 4.37Å
146R87.9Confident90.1Very high219 Ų21950.3 Ų50.383%0.82624%0.244SC*.  trans-104108.8174-68.1-173.3176.8-162.1-2.4108.9
147L91.7Very high89.8Confident18 Ų1850.2 Ų50.29%0.09424%0.243CC..PPolyproline II helixtrans-75.3135.5174-61.9176.7000109.6L37 V40 L41 V135 M139 I145L37-L147 HydrophobicContact CD1-CD2 3.97Å; V40-L147 HydrophobicContact CG1-CD2 4.2Å; L41-L147 HydrophobicContact CD2-CD2 3.81Å; L41-L147 HydrophobicContact CG-CD2 4.29Å; V135-L147 HydrophobicContact CG1-CD1 4.1Å; V135-L147 HydrophobicContact CG2-CD1 4.5Å; M139-L147 HydrophobicContact CG-CD1 4.09Å; M139-L147 HydrophobicContact SD-CD1 3.68Å; I145-L147 HydrophobicContact CD1-CD2 4.02Å; I145-L147 HydrophobicContact CG1-CD2 4.37Å
148P92.9Very high89.4Confident14 Ų1451 Ų519%0.09125%0.248CC..PPolyproline II helixtrans-63.9137.6171.826.2-33.9000110.4E36 L37 V151 T175E36-P148 HydrophobicContact CG-CG 4.33Å; L37-P148 HydrophobicContact CB-CG 3.74Å; L37-P148 HydrophobicContact CD1-CG 4.19Å; P148-V151 HydrophobicContact CB-CG2 3.98Å; P148-V151 HydrophobicContact CG-CG2 3.79Å; P148-T175 WeakPolarHBondContact O-CB 3.27Å; P148-T175 PolarHBondContact O-OG1 3.47Å
149E90.5Very high88.9Confident76 Ų7655 Ų5536%0.35526%0.262SS..SBendtrans-88.2149.6-179.3-59.2-170.3153.100112.2K33 T178K33-E149 PolarHBondContact NZ-O 2.92Å; E149-T178 WeakPolarHBondContact OE1-CB 3.5Å; E149-T178 PolarHBondContact OE1-N 3.14Å; E149-T178 PolarHBondContact OE1-OG1 2.85Å
150H92.1Very high88.6Confident89 Ų8956.6 Ų56.641%0.41227%0.269SS..SBendtrans57.846.4178.1-53.4-69.4000113.2T152 T175H150-T152 PolarHBondContact O-N 3.33Å; H150-T175 VanDerWaalsContact CA-O 3.29Å; H150-T175 WeakPolarHBondContact CA-O 3.38Å; H150-T175 PolarHBondContact N-O 2.97Å; H150-T175 PolarHBondContact N-OG1 2.91Å
151V96.4Very high88.4Confident2 Ų259.8 Ų59.81%0.01228%0.279CS..  trans-82.9114.1171.5-175.90000108.4K33 F34 L37 P148 L174 T175K33-V151 HydrophobicContact CB-CG2 4.01Å; F34-V151 HydrophobicContact CB-CG1 4.31Å; F34-V151 HydrophobicContact CD2-CG1 4.37Å; L37-V151 HydrophobicContact CB-CG2 4.39Å; L37-V151 HydrophobicContact CD2-CB 4.16Å; L37-V151 HydrophobicContact CD2-CG1 3.92Å; L37-V151 HydrophobicContact CD2-CG2 4.33Å; P148-V151 HydrophobicContact CB-CG2 3.98Å; P148-V151 HydrophobicContact CG-CG2 3.79Å; V151-L174 HydrophobicContact CB-CB 4.34Å; V151-L174 HydrophobicContact CG1-CB 4.33Å; V151-L174 HydrophobicContact CG1-CD1 4.05Å; V151-L174 PolarHBondContact O-N 2.87Å; V151-T175 WeakPolarHBondContact CB-OG1 3.31Å; V151-T175 VanDerWaalsContact CG2-OG1 3.32Å; V151-T175 WeakPolarHBondContact CG2-OG1 3.46Å; V151-T175 PolarHBondContact N-O 3.18Å; V151-T175 PolarHBondContact N-OG1 2.79Å; V151-T175 PolarHBondContact O-N 2.85Å
152T95.3Very high88.4Confident73 Ų7365.9 Ų65.945%0.44831%0.308SS..EExtended strand (participates in β ladder)trans-122.6139.517755.90000110H150 E172 E173H150-T152 PolarHBondContact O-N 3.33Å; T152-E172 CarbonylContact C-O 3.55Å; T152-E172 VanDerWaalsContact CA-O 3.27Å; T152-E172 WeakPolarHBondContact CA-O 3.3Å; T152-E173 HydrophobicContact CG2-CB 4.05Å; T152-E173 HydrophobicContact CG2-CG 3.99Å
153V94.8Very high88Confident1 Ų161.9 Ų61.91%0.00631%0.308CS..EExtended strand (participates in β ladder)trans-124.9142.8177.7-65.40000111I24 F34 V128 V155 E172 L174I24-V153 HydrophobicContact CG2-CB 4.15Å; I24-V153 HydrophobicContact CG2-CG1 4.4Å; F34-V153 HydrophobicContact CB-CG1 4.49Å; F34-V153 HydrophobicContact CD2-CG1 3.38Å; F34-V153 HydrophobicContact CE2-CG1 3.78Å; F34-V153 HydrophobicContact CG-CG1 4.08Å; V128-V153 HydrophobicContact CG2-CG2 4.43Å; V153-V155 HydrophobicContact CG2-CG2 3.88Å; V153-E172 HydrophobicContact CG2-CB 4.14Å; V153-E172 PolarHBondContact N-O 3.4Å; V153-E172 PolarHBondContact O-N 2.74Å; V153-L174 HydrophobicContact CG1-CD1 3.88Å; V153-L174 HydrophobicContact CG2-CD1 4.06Å; V153-L174 HydrophobicContact CG2-CG 4.22Å
154Q94Very high87.9Confident75 Ų7566.6 Ų66.635%0.3533%0.33SS..EExtended strand (participates in β ladder)trans-80.8132.4165.8-67.7-62.3-36.500109D25 S28 S171D25-Q154 HydrophobicContact CB-CB 3.82Å; D25-Q154 WeakPolarHBondContact CB-O 3.42Å; D25-Q154 PolarHBondContact N-O 2.96Å; S28-Q154 PolarHBondContact OG-N 2.71Å; Q154-S171 PolarHBondContact NE2-OG 2.66Å
155V91.7Very high87.9Confident2 Ų264.6 Ų64.61%0.01231%0.312CS..EExtended strand (participates in β ladder)trans-123.4125.4-175-177.90000108.4T22 M23 V128 V153 V157 H169 I170 E172T22-V155 HydrophobicContact CG2-CG1 3.07Å; M23-V155 CarbonylContact O-C 3.57Å; M23-V155 WeakPolarHBondContact O-CA 3.35Å; V128-V155 HydrophobicContact CG2-CG2 4.06Å; V153-V155 HydrophobicContact CG2-CG2 3.88Å; V155-V157 HydrophobicContact CG1-CG2 4.39Å; V155-H169 CarbonylContact O-C 3.56Å; V155-H169 WeakPolarHBondContact O-CA 3.39Å; V155-I170 WeakPolarHBondContact CA-O 3.2Å; V155-I170 WeakPolarHBondContact CB-O 3.37Å; V155-I170 PolarHBondContact N-O 3.37Å; V155-I170 PolarHBondContact O-N 2.94Å; V155-E172 HydrophobicContact CG2-CB 3.96Å; V155-E172 HydrophobicContact CG2-CG 3.8Å
156V88.2Confident87.8Confident16 Ų1667.2 Ų67.210%0.09732%0.323CS..EExtended strand (participates in β ladder)trans-91.2117.5172.8-169.90000107.8M23 D25 V158M23-V156 HydrophobicContact CG-CB 3.78Å; M23-V156 PolarHBondContact N-O 3.48Å; M23-V156 PolarHBondContact O-N 3.46Å; D25-V156 HydrophobicContact CB-CG2 4.48Å; V156-V158 HydrophobicContact CG1-CG2 4.04Å
157V86.4Confident87.6Confident8 Ų860.9 Ų60.95%0.04831%0.312CS..EExtended strand (participates in β ladder)trans-99.5117.4172.1179.80000107.7E20 R21 V155 S167 S168 I170E20-V157 VanDerWaalsContact CD-CG1 3.46Å; E20-V157 HydrophobicContact CG-CG1 3.46Å; E20-V157 VanDerWaalsContact CG-CG1 3.46Å; E20-V157 WeakPolarHBondContact OE1-CG1 3.14Å; R21-V157 WeakPolarHBondContact O-CA 3.48Å; V155-V157 HydrophobicContact CG1-CG2 4.39Å; V157-S167 CarbonylContact O-C 3.6Å; V157-S167 WeakPolarHBondContact O-CA 3.45Å; V157-S168 PolarHBondContact N-O 3.42Å; V157-S168 PolarHBondContact O-N 3.35Å; V157-I170 HydrophobicContact CB-CD1 4.42Å; V157-I170 HydrophobicContact CG2-CD1 3.62Å; V157-I170 HydrophobicContact CG2-CG1 4.13Å
158V85.3Confident87.3Confident20 Ų2062.9 Ų62.912%0.12133%0.327CS..EExtended strand (participates in β ladder)trans-107.9121.4176.3-174.20000108L15 E20 R21 M23 V156 L165 H166L15-V158 HydrophobicContact CD1-CB 4.23Å; L15-V158 HydrophobicContact CD1-CG1 3.81Å; E20-V158 WeakPolarHBondContact CA-O 3.18Å; R21-V158 PolarHBondContact N-O 2.97Å; R21-V158 PolarHBondContact O-N 3.01Å; M23-V158 HydrophobicContact CE-CG2 4Å; V156-V158 HydrophobicContact CG1-CG2 4.04Å; V158-L165 HydrophobicContact CG1-CB 4.29Å; V158-L165 HydrophobicContact CG1-CD2 4.04Å; V158-H166 CarbonylContact C-O 3.52Å; V158-H166 WeakPolarHBondContact CA-O 3.49Å
159R83.2Confident87Confident86 Ų8667.8 Ų67.833%0.32535%0.349SS..EExtended strand (participates in β ladder)trans-123.6132.1177.7-169.7-175.8-71.2148.7-10.2110.5E19 E20 R161 H166E19-R159 WeakPolarHBondContact O-CA 3.43Å; E20-R159 IonicContact OE2-CZ 3.86Å; E20-R159 VanDerWaalsContact OE2-CZ 3.23Å; E20-R159 IonicContact OE2-NE 2.8Å; E20-R159 PolarHBondContact OE2-NE 3.24Å; E20-R159 VanDerWaalsContact OE2-NE 3.11Å; E20-R159 IonicContact OE2-NH2 2.74Å; E20-R159 PolarHBondContact OE2-NH2 3.49Å; R159-R161 HydrophobicContact CG-CG 4.29Å; R159-R161 VanDerWaalsContact NH1-NH2 3.16Å; R159-H166 PolarHBondContact N-O 2.86Å; R159-H166 PolarHBondContact O-N 2.74Å
160K81Confident87Confident59 Ų5967.5 Ų67.526%0.25735%0.349SS..EExtended strand (participates in β ladder)trans-89.4121.6172.7-168.71751741780110.5L15 N18 E19 L164 L165L15-K160 HydrophobicContact CB-CB 4.08Å; L15-K160 HydrophobicContact CB-CD 4.29Å; L15-K160 WeakPolarHBondContact O-CD 3.29Å; L15-K160 PolarHBondContact O-NZ 2.79Å; N18-K160 WeakPolarHBondContact CA-O 3.41Å; N18-K160 PolarHBondContact N-O 3.34Å; E19-K160 PolarHBondContact O-N 2.84Å; K160-L164 WeakPolarHBondContact CA-O 3.4Å; K160-L165 HydrophobicContact CB-CD2 4Å; K160-L165 HydrophobicContact CG-CD2 4.22Å
161R82.3Confident87Confident122 Ų12266.6 Ų66.646%0.4635%0.353SS..EExtended strand (participates in β ladder)trans-136.8129.5174.8-72.4-174.4173.1-178.4-1.6110.1R159 G163 L164R159-R161 HydrophobicContact CG-CG 4.29Å; R159-R161 VanDerWaalsContact NH1-NH2 3.16Å; R161-G163 PolarHBondContact O-N 3.4Å; R161-L164 PolarHBondContact N-O 2.8Å; R161-L164 WeakPolarHBondContact O-CB 3.38Å; R161-L164 PolarHBondContact O-N 3.15Å
162E83.9Confident86.8Confident182 Ų18268.4 Ų68.485%0.8536%0.361SS*.THydrogen-bonded Turntrans53.237.5-176.6-57.2-178.8171.800112.1E17 L164E17-E162 WeakPolarHBondContact OE1-CA 3.14Å; E17-E162 PolarHBondContact OE1-N 3Å; E162-L164 PolarHBondContact O-N 3.48Å
163G78.2Confident86.7Confident48 Ų4869.2 Ų69.250%0.49536%0.36SS..THydrogen-bonded Turntrans73.6-0.7-17500000115.7E17 R161E17-G163 PolarHBondContact OE1-N 3.35Å; E17-G163 PolarHBondContact OE2-N 3.13Å; R161-G163 PolarHBondContact O-N 3.4Å
164L80.8Confident86.6Confident114 Ų11469.5 Ų69.560%0.59736%0.361SS*.EExtended strand (participates in β ladder)trans-102.4135177.2-67.3169.4000111.9K160 R161 E162 H166K160-L164 WeakPolarHBondContact CA-O 3.4Å; R161-L164 PolarHBondContact N-O 2.8Å; R161-L164 WeakPolarHBondContact O-CB 3.38Å; R161-L164 PolarHBondContact O-N 3.15Å; E162-L164 PolarHBondContact O-N 3.48Å; L164-H166 PolarHBondContact O-ND1 2.95Å; L164-H166 VanDerWaalsContact O-ND1 3.16Å
165L82.8Confident86.6Confident88 Ų8866.1 Ų66.146%0.46135%0.346SS..EExtended strand (participates in β ladder)trans-78.9121.6172.5-63177.7000109.9L15 V158 K160L15-L165 HydrophobicContact CD1-CD2 4.07Å; V158-L165 HydrophobicContact CG1-CB 4.29Å; V158-L165 HydrophobicContact CG1-CD2 4.04Å; K160-L165 HydrophobicContact CB-CD2 4Å; K160-L165 HydrophobicContact CG-CD2 4.22Å
166H83.7Confident86.3Confident99 Ų9966.6 Ų66.646%0.45835%0.349SS..EExtended strand (participates in β ladder)trans-106120.2172.6-66.377.8000108.6V158 R159 L164V158-H166 CarbonylContact C-O 3.52Å; V158-H166 WeakPolarHBondContact CA-O 3.49Å; R159-H166 PolarHBondContact N-O 2.86Å; R159-H166 PolarHBondContact O-N 2.74Å; L164-H166 PolarHBondContact O-ND1 2.95Å; L164-H166 VanDerWaalsContact O-ND1 3.16Å
167S84.5Confident85.9Confident87 Ų8767.5 Ų67.561%0.60835%0.354SS*.EExtended strand (participates in β ladder)trans-105132.1175.860.30000111.1V157V157-S167 CarbonylContact O-C 3.6Å; V157-S167 WeakPolarHBondContact O-CA 3.45Å
168S85.5Confident85.4Confident59 Ų5969.8 Ų69.841%0.41337%0.368SS..EExtended strand (participates in β ladder)trans-130.3145170.455.60000110.9V157V157-S168 PolarHBondContact N-O 3.42Å; V157-S168 PolarHBondContact O-N 3.35Å
169H86.4Confident84.5Confident117 Ų11776.5 Ų76.554%0.54240%0.398SS..EExtended strand (participates in β ladder)trans-97.3131.7173.2-66.3-102.2000109.8V155V155-H169 CarbonylContact O-C 3.56Å; V155-H169 WeakPolarHBondContact O-CA 3.39Å
170I89.9Confident83.9Confident70 Ų7078 Ų7836%0.35941%0.411SS..EExtended strand (participates in β ladder)trans-127.4134.5178.3-54.1-176.4000107.9V155 V157V155-I170 WeakPolarHBondContact CA-O 3.2Å; V155-I170 WeakPolarHBondContact CB-O 3.37Å; V155-I170 PolarHBondContact N-O 3.37Å; V155-I170 PolarHBondContact O-N 2.94Å; V157-I170 HydrophobicContact CB-CD1 4.42Å; V157-I170 HydrophobicContact CG2-CD1 3.62Å; V157-I170 HydrophobicContact CG2-CG1 4.13Å
171S91.8Very high83.5Confident70 Ų7075.7 Ų75.749%0.4940%0.401SS..EExtended strand (participates in β ladder)trans-87.8122.9172-1670000109.3Q154Q154-S171 PolarHBondContact NE2-OG 2.66Å
172E92.6Very high82.7Confident40 Ų4074 Ų7419%0.18740%0.399CS..EExtended strand (participates in β ladder)trans-111.2129.1175.8-74.7-66.9165.800110.4V128 H132 T152 V153 V155V128-E172 HydrophobicContact CG1-CB 4.33Å; V128-E172 HydrophobicContact CG1-CG 4.31Å; H132-E172 IonicContact NE2-OE2 2.63Å; T152-E172 CarbonylContact C-O 3.55Å; T152-E172 VanDerWaalsContact CA-O 3.27Å; T152-E172 WeakPolarHBondContact CA-O 3.3Å; V153-E172 HydrophobicContact CG2-CB 4.14Å; V153-E172 PolarHBondContact N-O 3.4Å; V153-E172 PolarHBondContact O-N 2.74Å; V155-E172 HydrophobicContact CG2-CB 3.96Å; V155-E172 HydrophobicContact CG2-CG 3.8Å
173E93.6Very high81.5Confident90 Ų9066.5 Ų66.542%0.42137%0.371SS..EExtended strand (participates in β ladder)trans-95.6108.1175.5-175.5-177.8-121.500109.5H132 T152 T175H132-E173 PolarHBondContact CE1-O 3.3Å; T152-E173 HydrophobicContact CG2-CB 4.05Å; T152-E173 HydrophobicContact CG2-CG 3.99Å; E173-T175 VanDerWaalsContact CG-O 3.26Å; E173-T175 WeakPolarHBondContact CG-O 3.18Å
174L94.1Very high80.8Confident7 Ų770.6 Ų70.64%0.03737%0.372CS..  trans-79.3-38.2-178.5-64.9173.6000112.1F34 L37 V128 L131 V151 V153F34-L174 HydrophobicContact CD2-CD1 3.81Å; F34-L174 HydrophobicContact CE2-CD1 3.79Å; L37-L174 HydrophobicContact CD2-CB 3.88Å; L37-L174 HydrophobicContact CD2-CD1 3.92Å; V128-L174 HydrophobicContact CG1-CD2 4.05Å; L131-L174 HydrophobicContact CB-CD2 4.1Å; L131-L174 HydrophobicContact CD1-CD1 3.87Å; V151-L174 HydrophobicContact CB-CB 4.34Å; V151-L174 HydrophobicContact CG1-CB 4.33Å; V151-L174 HydrophobicContact CG1-CD1 4.05Å; V151-L174 PolarHBondContact O-N 2.87Å; V153-L174 HydrophobicContact CG1-CD1 3.88Å; V153-L174 HydrophobicContact CG2-CD1 4.06Å; V153-L174 HydrophobicContact CG2-CG 4.22Å
175T92.1Very high79.6Confident4 Ų467.1 Ų67.13%0.02535%0.352CS..  trans-136.1148.6176.965.70000110.9L37 V135 P148 H150 V151 E173 M181L37-T175 HydrophobicContact CD1-CG2 3.89Å; L37-T175 HydrophobicContact CD2-CG2 4.05Å; V135-T175 HydrophobicContact CG1-CG2 4.44Å; V135-T175 HydrophobicContact CG2-CG2 4.17Å; P148-T175 WeakPolarHBondContact O-CB 3.27Å; P148-T175 PolarHBondContact O-OG1 3.47Å; H150-T175 VanDerWaalsContact CA-O 3.29Å; H150-T175 WeakPolarHBondContact CA-O 3.38Å; H150-T175 PolarHBondContact N-O 2.97Å; H150-T175 PolarHBondContact N-OG1 2.91Å; V151-T175 WeakPolarHBondContact CB-OG1 3.31Å; V151-T175 VanDerWaalsContact CG2-OG1 3.32Å; V151-T175 WeakPolarHBondContact CG2-OG1 3.46Å; V151-T175 PolarHBondContact N-O 3.18Å; V151-T175 PolarHBondContact N-OG1 2.79Å; V151-T175 PolarHBondContact O-N 2.85Å; E173-T175 VanDerWaalsContact CG-O 3.26Å; E173-T175 WeakPolarHBondContact CG-O 3.18Å; T175-M181 HydrophobicContact CG2-SD 4.25Å
176T87.1Confident78Confident13 Ų1366.7 Ų66.78%0.0835%0.348CS..  trans-119.7-149.9171.5-172.40000108.7M180 M181T176-M180 HydrophobicContact CG2-CB 3.66Å; T176-M181 HydrophobicContact CG2-CG 3.53Å; T176-M181 WeakPolarHBondContact O-CE 3.49Å
177T79.6Confident76.4Confident34 Ų3471.8 Ų71.821%0.20936%0.363CS..  trans-71.3149.3172.465.10000111.4E179 M180 M181T177-E179 PolarHBondContact O-N 3.02Å; T177-M180 PolarHBondContact O-N 2.72Å; T177-M180 VanDerWaalsContact O-N 3.14Å; T177-M180 WeakPolarHBondContact OG1-CB 3.47Å; T177-M180 VanDerWaalsContact OG1-CG 3.22Å; T177-M180 WeakPolarHBondContact OG1-CG 3.23Å; T177-M180 PolarHBondContact OG1-N 2.84Å; T177-M181 WeakPolarHBondContact O-CG 3.4Å; T177-M181 PolarHBondContact O-N 3.47Å
178T74.4Confident75.2Confident56 Ų5669.3 Ų69.334%0.34434%0.342SS..Hα-helixtrans-55.2-40.7178.3-55.60000111.5E149 M181 M182E149-T178 WeakPolarHBondContact OE1-CB 3.5Å; E149-T178 PolarHBondContact OE1-N 3.14Å; E149-T178 PolarHBondContact OE1-OG1 2.85Å; T178-M181 PolarHBondContact O-N 3.35Å; T178-M182 HydrophobicContact CG2-CE 4.06Å; T178-M182 HydrophobicContact CG2-SD 4.45Å; T178-M182 WeakPolarHBondContact O-CB 3.47Å; T178-M182 WeakPolarHBondContact O-CG 3.29Å; T178-M182 PolarHBondContact O-N 2.85Å
179E67.5Low73.8Confident161 Ų16170.4 Ų70.475%0.75236%0.355SS*.Hα-helixtrans-60.4-48.5176.7-173.9178.1-172.900112.3T177 M181 M182 G183T177-E179 PolarHBondContact O-N 3.02Å; E179-M181 PolarHBondContact O-N 3.1Å; E179-M182 PolarHBondContact O-N 2.96Å; E179-G183 PolarHBondContact O-N 2.86Å
180M69.8Low72.6Confident118 Ų11866.5 Ų66.558%0.58134%0.337SS*.Hα-helixtrans-68.2-35.8-179.8-70.7179.597.800112.4T176 T177T176-M180 HydrophobicContact CG2-CB 3.66Å; T177-M180 PolarHBondContact O-N 2.72Å; T177-M180 VanDerWaalsContact O-N 3.14Å; T177-M180 WeakPolarHBondContact OG1-CB 3.47Å; T177-M180 VanDerWaalsContact OG1-CG 3.22Å; T177-M180 WeakPolarHBondContact OG1-CG 3.23Å; T177-M180 PolarHBondContact OG1-N 2.84Å
181M73.6Confident71.4Confident11 Ų1164.5 Ų64.55%0.05433%0.327CS..Hα-helixtrans-67.9-42.3175.3-68-172.3-71.300111.6V135 M139 T175 T176 T177 T178 E179 R184 F185V135-M181 HydrophobicContact CG1-SD 4.14Å; M139-M181 HydrophobicContact CE-CB 3.64Å; M139-M181 HydrophobicContact CG-CB 4.14Å; M139-M181 HydrophobicContact SD-CB 4.16Å; M139-M181 HydrophobicContact SD-CE 4.42Å; T175-M181 HydrophobicContact CG2-SD 4.25Å; T176-M181 HydrophobicContact CG2-CG 3.53Å; T176-M181 WeakPolarHBondContact O-CE 3.49Å; T177-M181 WeakPolarHBondContact O-CG 3.4Å; T177-M181 PolarHBondContact O-N 3.47Å; T178-M181 PolarHBondContact O-N 3.35Å; E179-M181 PolarHBondContact O-N 3.1Å; M181-R184 PolarHBondContact O-N 3.33Å; M181-F185 VanDerWaalsContact O-CD2 3.29Å; M181-F185 WeakPolarHBondContact O-CD2 3.33Å
182M65.4Low70.1Confident85 Ų8565 Ų6542%0.41933%0.327SS..Hα-helixtrans-66.3-37.6175.2-72.1-165.7-60.100112.4M139 T178 E179 R184 F185 E186M139-M182 HydrophobicContact CE-CB 4.26Å; M139-M182 HydrophobicContact CE-CG 3.27Å; T178-M182 HydrophobicContact CG2-CE 4.06Å; T178-M182 HydrophobicContact CG2-SD 4.45Å; T178-M182 WeakPolarHBondContact O-CB 3.47Å; T178-M182 WeakPolarHBondContact O-CG 3.29Å; T178-M182 PolarHBondContact O-N 2.85Å; E179-M182 PolarHBondContact O-N 2.96Å; M182-R184 PolarHBondContact O-N 3.29Å; M182-R184 VanDerWaalsContact O-N 3.15Å; M182-F185 PolarHBondContact O-N 3.05Å; M182-F185 VanDerWaalsContact O-N 3.13Å; M182-E186 PolarHBondContact O-N 3.43Å
183G59.3Low68.8Low26 Ų2666.1 Ų66.127%0.26833%0.334SS..Hα-helixtrans-62.8-16.9178.400000114.7E179E179-G183 PolarHBondContact O-N 2.86Å
184R62.4Low67.5Low134 Ų13464.1 Ų64.151%0.50632%0.324SS..THydrogen-bonded Turntrans-76.4-26174.7-69.1-172.6-172.6-155.35.1113.8M181 M182M181-R184 PolarHBondContact O-N 3.33Å; M182-R184 PolarHBondContact O-N 3.29Å; M182-R184 VanDerWaalsContact O-N 3.15Å
185F55.8Low66.2Low40 Ų4068.8 Ų68.818%0.17535%0.349CS..THydrogen-bonded Turntrans-102.5-17.6-175-60.4-72.8000113L108 W113 M139 H140 M181 M182L108-F185 HydrophobicContact CB-CE1 4.29Å; L108-F185 HydrophobicContact CD1-CE1 4.31Å; L108-F185 HydrophobicContact CD2-CD1 4.13Å; L108-F185 HydrophobicContact CD2-CE1 3.77Å; L108-F185 HydrophobicContact CG-CE1 4.34Å; W113-F185 HydrophobicContact CH2-CZ 4.39Å; W113-F185 AromaticContact CZ2-CE1 3.82Å; W113-F185 HydrophobicContact CZ2-CE1 3.82Å; W113-F185 HydrophobicContact CZ2-CZ 4.07Å; M139-F185 HydrophobicContact CB-CD2 3.98Å; M139-F185 HydrophobicContact CB-CE2 3.72Å; H140-F185 HydrophobicContact CB-CD1 4.25Å; H140-F185 HydrophobicContact CB-CG 4.44Å; M181-F185 VanDerWaalsContact O-CD2 3.29Å; M181-F185 WeakPolarHBondContact O-CD2 3.33Å; M182-F185 PolarHBondContact O-N 3.05Å; M182-F185 VanDerWaalsContact O-N 3.13Å
186E49.1Very low65.2Low80 Ų8075.8 Ų75.837%0.37438%0.381SS..  trans-140.994.7170.1-75.7-179.3148.300110.2R142 M182 D188 K272 R276R142-E186 IonicContact NH2-OE1 3.99Å; R142-E186 IonicContact NH2-OE2 3.21Å; R142-E186 PolarHBondContact NH2-OE2 3.29Å; M182-E186 PolarHBondContact O-N 3.43Å; E186-D188 PolarHBondContact O-N 2.99Å; E186-K272 PolarHBondContact O-NZ 3.02Å; E186-R276 IonicContact OE1-NH2 2.64Å; E186-R276 IonicContact OE2-CZ 2.8Å; E186-R276 IonicContact OE2-NH1 2.71Å; E186-R276 IonicContact OE2-NH2 2.74Å; E186-R276 PolarHBondContact OE2-NH2 3Å
187R51Low64.3Low206 Ų20676 Ų7678%0.77738%0.384SS*.  trans-82.888.2143.9-79.6-163.5-176.9-173-0.6107.8D191R187-D191 WeakPolarHBondContact CA-OD2 3.39Å; R187-D191 HydrophobicContact CB-CB 4.3Å; R187-D191 HydrophobicContact CG-CB 4.17Å
188D57.9Low63.7Low34 Ų3477.8 Ų77.818%0.18240%0.396CS..  trans-85.1173.8170.568.127.3000110.3E186 F190 D191 K272 R276E186-D188 PolarHBondContact O-N 2.99Å; D188-F190 PolarHBondContact O-N 2.91Å; D188-F190 WeakPolarHBondContact OD1-CA 3.32Å; D188-F190 WeakPolarHBondContact OD1-CB 3.38Å; D188-F190 WeakPolarHBondContact OD1-CD2 3.5Å; D188-F190 PolarHBondContact OD1-N 2.75Å; D188-D191 PolarHBondContact N-OD2 3.33Å; D188-D191 WeakPolarHBondContact O-CB 3.49Å; D188-D191 PolarHBondContact O-N 2.93Å; D188-D191 PolarHBondContact OD1-N 3.29Å; D188-K272 VanDerWaalsContact CG-CE 3.46Å; D188-K272 WeakPolarHBondContact OD1-CE 3.32Å; D188-K272 IonicContact OD1-NZ 3.3Å; D188-K272 WeakPolarHBondContact OD2-CE 3.38Å; D188-K272 IonicContact OD2-NZ 3.53Å; D188-R276 IonicContact OD2-CZ 3.78Å; D188-R276 IonicContact OD2-NE 2.66Å; D188-R276 IonicContact OD2-NH2 3.93Å; D188-R276 PolarHBondContact OD2-NH2 2.74Å
189A57.6Low63.7Low83 Ų8381.8 Ų81.869%0.68642%0.416SS*.Hα-helixtrans-58.7-18.4-178.500000113.1L193A189-L193 PolarHBondContact O-N 3.37Å
190F59.8Low63.7Low35 Ų3581.4 Ų81.415%0.15441%0.411CS..Hα-helixtrans-74.9-31.1174.6-57.4-75.3000111.8D188 T192 L193 F194 L275 R276 Y279D188-F190 PolarHBondContact O-N 2.91Å; D188-F190 WeakPolarHBondContact OD1-CA 3.32Å; D188-F190 WeakPolarHBondContact OD1-CB 3.38Å; D188-F190 WeakPolarHBondContact OD1-CD2 3.5Å; D188-F190 PolarHBondContact OD1-N 2.75Å; F190-T192 VanDerWaalsContact C-N 3.34Å; F190-T192 PolarHBondContact O-N 3.36Å; F190-L193 HydrophobicContact CD1-CD2 4.28Å; F190-L193 CarbonylContact O-C 3.54Å; F190-L193 WeakPolarHBondContact O-CA 3.41Å; F190-L193 VanDerWaalsContact O-CB 3.31Å; F190-L193 WeakPolarHBondContact O-CB 3.5Å; F190-L193 PolarHBondContact O-N 3.47Å; F190-L193 VanDerWaalsContact O-N 3.09Å; F190-F194 HydrophobicContact CB-CD2 4.43Å; F190-F194 HydrophobicContact CB-CE2 4.09Å; F190-F194 WeakPolarHBondContact O-CD2 3.45Å; F190-F194 WeakPolarHBondContact O-CG 3.37Å; F190-F194 PolarHBondContact O-N 2.99Å; F190-L275 HydrophobicContact CB-CD1 4.39Å; F190-L275 HydrophobicContact CD1-CB 3.86Å; F190-L275 HydrophobicContact CD1-CD1 3.86Å; F190-L275 HydrophobicContact CD1-CD2 4.42Å; F190-L275 HydrophobicContact CD1-CG 4.27Å; F190-L275 HydrophobicContact CE1-CB 3.9Å; F190-L275 HydrophobicContact CE1-CD2 4.44Å; F190-L275 HydrophobicContact CG-CB 4.43Å; F190-L275 HydrophobicContact CG-CD1 4.42Å; F190-R276 HydrophobicContact CE2-CG 4.35Å; F190-Y279 HydrophobicContact CZ-CD1 4.45Å; F190-Y279 HydrophobicContact CZ-CD2 4.12Å; F190-Y279 AromaticContact CZ-CG 3.84Å; F190-Y279 HydrophobicContact CZ-CG 3.84Å
191D64.6Low63.8Low27 Ų2776.6 Ų76.614%0.14439%0.388CS..Hα-helixtrans-63.3-40.8173.9-57.2-68.8000111.6R187 D188 L193 F194 D195 K272R187-D191 WeakPolarHBondContact CA-OD2 3.39Å; R187-D191 HydrophobicContact CB-CB 4.3Å; R187-D191 HydrophobicContact CG-CB 4.17Å; D188-D191 PolarHBondContact N-OD2 3.33Å; D188-D191 WeakPolarHBondContact O-CB 3.49Å; D188-D191 PolarHBondContact O-N 2.93Å; D188-D191 PolarHBondContact OD1-N 3.29Å; D191-L193 VanDerWaalsContact C-N 3.32Å; D191-L193 PolarHBondContact O-N 3.46Å; D191-F194 WeakPolarHBondContact O-CB 3.46Å; D191-F194 PolarHBondContact O-N 3.21Å; D191-D195 PolarHBondContact O-N 2.63Å; D191-D195 VanDerWaalsContact O-N 3.08Å; D191-K272 IonicContact OD1-NZ 2.77Å; D191-K272 PolarHBondContact OD1-NZ 2.99Å; D191-K272 WeakPolarHBondContact OD2-CE 3.35Å; D191-K272 IonicContact OD2-NZ 3.31Å; D191-K272 PolarHBondContact OD2-NZ 3.05Å
192T65.8Low64Low81 Ų8179.8 Ų79.850%0.49741%0.411SS..Hα-helixtrans-63.4-38170.9-52.20000112F190 D195 H196F190-T192 VanDerWaalsContact C-N 3.34Å; F190-T192 PolarHBondContact O-N 3.36Å; T192-D195 PolarHBondContact O-N 2.85Å; T192-H196 WeakPolarHBondContact O-CB 3.4Å; T192-H196 PolarHBondContact O-N 2.81Å; T192-H196 VanDerWaalsContact O-N 3.12Å; T192-H196 PolarHBondContact O-ND1 2.8Å
193L64.4Low64.8Low64 Ų6479.5 Ų79.534%0.33541%0.414SS..Hα-helixtrans-64.7-39.7175.8-175.973.8000111.6A189 F190 D191 H196 A197 L275A189-L193 PolarHBondContact O-N 3.37Å; F190-L193 HydrophobicContact CD1-CD2 4.28Å; F190-L193 CarbonylContact O-C 3.54Å; F190-L193 WeakPolarHBondContact O-CA 3.41Å; F190-L193 VanDerWaalsContact O-CB 3.31Å; F190-L193 WeakPolarHBondContact O-CB 3.5Å; F190-L193 PolarHBondContact O-N 3.47Å; F190-L193 VanDerWaalsContact O-N 3.09Å; D191-L193 VanDerWaalsContact C-N 3.32Å; D191-L193 PolarHBondContact O-N 3.46Å; L193-H196 PolarHBondContact O-N 2.76Å; L193-A197 HydrophobicContact CD1-CB 4.03Å; L193-A197 WeakPolarHBondContact O-CA 3.48Å; L193-A197 PolarHBondContact O-N 2.77Å; L193-L275 HydrophobicContact CD2-CD1 4.43Å
194F66.5Low66Low48 Ų4878.7 Ų78.721%0.21140%0.404CS..Hα-helixtrans-61-44.9175.1-74.9-62.1000111.4F190 D191 L201 L271 K272 L275F190-F194 HydrophobicContact CB-CD2 4.43Å; F190-F194 HydrophobicContact CB-CE2 4.09Å; F190-F194 WeakPolarHBondContact O-CD2 3.45Å; F190-F194 WeakPolarHBondContact O-CG 3.37Å; F190-F194 PolarHBondContact O-N 2.99Å; D191-F194 WeakPolarHBondContact O-CB 3.46Å; D191-F194 PolarHBondContact O-N 3.21Å; F194-L201 HydrophobicContact CD1-CD1 3.33Å; F194-L201 HydrophobicContact CD1-CD2 3.76Å; F194-L201 HydrophobicContact CD1-CG 4.17Å; F194-L201 HydrophobicContact CE1-CD1 3.69Å; F194-L201 HydrophobicContact CE1-CD2 3.51Å; F194-L201 HydrophobicContact CE1-CG 4.2Å; F194-L201 HydrophobicContact CZ-CD2 4.45Å; F194-L271 HydrophobicContact CE1-CB 3.56Å; F194-L271 HydrophobicContact CE1-CD1 3.69Å; F194-L271 HydrophobicContact CE1-CG 4.24Å; F194-L271 HydrophobicContact CZ-CB 3.47Å; F194-L271 VanDerWaalsContact CZ-CB 3.47Å; F194-L271 HydrophobicContact CZ-CD1 4.45Å; F194-K272 HydrophobicContact CE2-CB 4.45Å; F194-L275 HydrophobicContact CE1-CD1 4.11Å; F194-L275 HydrophobicContact CE2-CD1 4.11Å; F194-L275 HydrophobicContact CZ-CD1 3.53Å
195D66.1Low67.2Low105 Ų10577.7 Ų77.756%0.56140%0.404SS*.Hα-helixtrans-67.8-34.6-179.3-72.5-18000113.3D191 T192D191-D195 PolarHBondContact O-N 2.63Å; D191-D195 VanDerWaalsContact O-N 3.08Å; T192-D195 PolarHBondContact O-N 2.85Å
196H70.9Confident68.8Low150 Ų15081.3 Ų81.369%0.69442%0.419SS*.Hα-helixtrans-110.4-11-168.7-61.677.5000114.6T192 L193T192-H196 WeakPolarHBondContact O-CB 3.4Å; T192-H196 PolarHBondContact O-N 2.81Å; T192-H196 VanDerWaalsContact O-N 3.12Å; T192-H196 PolarHBondContact O-ND1 2.8Å; L193-H196 PolarHBondContact O-N 2.76Å
197A69.4Low70.9Confident17 Ų1779 Ų7914%0.1441%0.408CS..  trans-145.153.6-177.600000113.9L193 D199 K200L193-A197 HydrophobicContact CD1-CB 4.03Å; L193-A197 WeakPolarHBondContact O-CA 3.48Å; L193-A197 PolarHBondContact O-N 2.77Å; A197-D199 PolarHBondContact O-N 3.19Å; A197-K200 HydrophobicContact CB-CB 4.47Å; A197-K200 HydrophobicContact CB-CD 4.14Å; A197-K200 HydrophobicContact CB-CG 4.26Å; A197-K200 PolarHBondContact O-N 3.39Å; A197-K200 VanDerWaalsContact O-N 3.14Å
198P67.7Low73Confident72 Ų7269.7 Ų69.747%0.46838%0.375SS..G310 helixtrans-59.3-32.2-178.925.3-34.6000112.8K200 L201P198-K200 PolarHBondContact O-N 2.79Å; P198-L201 HydrophobicContact CB-CD1 4.47Å; P198-L201 VanDerWaalsContact O-CB 3.3Å; P198-L201 WeakPolarHBondContact O-CB 3.34Å; P198-L201 WeakPolarHBondContact O-CG 3.5Å; P198-L201 PolarHBondContact O-N 2.91Å; P198-L201 VanDerWaalsContact O-N 3.08Å
199D73.9Confident74.8Confident140 Ų14070.3 Ų70.375%0.74938%0.378SS*.G310 helixtrans-64-26.8-178.2-51.4-32.6000112.8A197 L201 S202A197-D199 PolarHBondContact O-N 3.19Å; D199-L201 VanDerWaalsContact C-N 3.28Å; D199-L201 PolarHBondContact O-N 3.48Å; D199-S202 PolarHBondContact O-OG 3.01Å
200K67.6Low76.6Confident153 Ų15366.4 Ų66.467%0.66535%0.346SS*.G310 helixtrans-77.9-12.2179-63.8-170.6179.5-179.40113A197 P198A197-K200 HydrophobicContact CB-CB 4.47Å; A197-K200 HydrophobicContact CB-CD 4.14Å; A197-K200 HydrophobicContact CB-CG 4.26Å; A197-K200 PolarHBondContact O-N 3.39Å; A197-K200 VanDerWaalsContact O-N 3.14Å; P198-K200 PolarHBondContact O-N 2.79Å
201L71.9Confident78.4Confident18 Ų1865.2 Ų65.29%0.09434%0.341CS..G310 helixtrans-82.7-18.5-174.6-56.1170.1000113.6F194 P198 D199 V203 V204 K205 L271 L275F194-L201 HydrophobicContact CD1-CD1 3.33Å; F194-L201 HydrophobicContact CD1-CD2 3.76Å; F194-L201 HydrophobicContact CD1-CG 4.17Å; F194-L201 HydrophobicContact CE1-CD1 3.69Å; F194-L201 HydrophobicContact CE1-CD2 3.51Å; F194-L201 HydrophobicContact CE1-CG 4.2Å; F194-L201 HydrophobicContact CZ-CD2 4.45Å; P198-L201 HydrophobicContact CB-CD1 4.47Å; P198-L201 VanDerWaalsContact O-CB 3.3Å; P198-L201 WeakPolarHBondContact O-CB 3.34Å; P198-L201 WeakPolarHBondContact O-CG 3.5Å; P198-L201 PolarHBondContact O-N 2.91Å; P198-L201 VanDerWaalsContact O-N 3.08Å; D199-L201 VanDerWaalsContact C-N 3.28Å; D199-L201 PolarHBondContact O-N 3.48Å; L201-V203 PolarHBondContact O-N 3Å; L201-V204 WeakPolarHBondContact O-CB 3.3Å; L201-V204 PolarHBondContact O-N 2.84Å; L201-K205 PolarHBondContact O-N 3.35Å; L201-L271 HydrophobicContact CD1-CD1 4.36Å; L201-L275 HydrophobicContact CD2-CD1 4.3Å
202S77.9Confident79.9Confident77 Ų7769.5 Ų69.554%0.53836%0.356SS..G310 helixtrans-61.5-28.5177.765.20000112.1D199D199-S202 PolarHBondContact O-OG 3.01Å
203V80.6Confident81.4Confident79 Ų7965.7 Ų65.748%0.47933%0.333SS..THydrogen-bonded Turntrans-70.3-36.3174.1-175.20000111.6L201 K205 K206L201-V203 PolarHBondContact O-N 3Å; V203-K205 VanDerWaalsContact C-N 3.3Å; V203-K205 PolarHBondContact O-N 3.13Å; V203-K206 VanDerWaalsContact O-CB 3.31Å; V203-K206 WeakPolarHBondContact O-CB 3.44Å; V203-K206 PolarHBondContact O-N 2.98Å
204V85.4Confident83Confident10 Ų1062.7 Ų62.76%0.06132%0.317CS..G310 helixtrans-63.4-38.2-179.9-177.60000110.9L201 K206 F207 L271 T274 L275 L278L201-V204 WeakPolarHBondContact O-CB 3.3Å; L201-V204 PolarHBondContact O-N 2.84Å; V204-K206 PolarHBondContact O-N 3.23Å; V204-K206 VanDerWaalsContact O-N 3.12Å; V204-F207 PolarHBondContact O-N 3.3Å; V204-F207 VanDerWaalsContact O-N 3.08Å; V204-L271 HydrophobicContact CB-CD2 4.1Å; V204-L271 HydrophobicContact CG1-CD2 3.96Å; V204-T274 HydrophobicContact CG1-CG2 3.49Å; V204-T274 VanDerWaalsContact CG1-CG2 3.49Å; V204-L275 HydrophobicContact CG1-CD2 4.48Å; V204-L275 HydrophobicContact CG1-CG 4.22Å; V204-L275 HydrophobicContact CG2-CD2 3.74Å; V204-L275 HydrophobicContact CG2-CG 4.21Å; V204-L278 HydrophobicContact CG1-CD1 4.38Å
205K86.6Confident84.4Confident113 Ų11363.8 Ų63.849%0.49133%0.325SS..G310 helixtrans-60.9-22.9178.8-65.8-174.3176.7-177.90113.5L201 V203 F207 A208 L269 L271L201-K205 PolarHBondContact O-N 3.35Å; V203-K205 VanDerWaalsContact C-N 3.3Å; V203-K205 PolarHBondContact O-N 3.13Å; K205-F207 PolarHBondContact O-N 2.94Å; K205-A208 WeakPolarHBondContact O-CB 3.39Å; K205-A208 PolarHBondContact O-N 3.19Å; K205-L269 HydrophobicContact CB-CD2 4.03Å; K205-L269 HydrophobicContact CG-CD2 4.12Å; K205-L271 HydrophobicContact CG-CD2 3.91Å
206K90Very high85.8Confident116 Ų11661.1 Ų61.150%0.50431%0.311SS..G310 helixtrans-63.6-29.4177.4-63.1-173.8177.5-176.80111.8V203 V204 A208 Y212V203-K206 VanDerWaalsContact O-CB 3.31Å; V203-K206 WeakPolarHBondContact O-CB 3.44Å; V203-K206 PolarHBondContact O-N 2.98Å; V204-K206 PolarHBondContact O-N 3.23Å; V204-K206 VanDerWaalsContact O-N 3.12Å; K206-A208 PolarHBondContact O-N 3.01Å; K206-Y212 HydrophobicContact CB-CD2 3.8Å; K206-Y212 HydrophobicContact CB-CE2 3.73Å; K206-Y212 HydrophobicContact CD-CE2 4.41Å; K206-Y212 VanDerWaalsContact O-CD2 3.28Å; K206-Y212 WeakPolarHBondContact O-CD2 3.28Å
207F93.9Very high86.9Confident32 Ų3254 Ų5414%0.1428%0.277CS..G310 helixtrans-76.1-7-178.4-66.9-89000114.2V204 K205 D209 G210 L213 L216 T274 L278V204-F207 PolarHBondContact O-N 3.3Å; V204-F207 VanDerWaalsContact O-N 3.08Å; K205-F207 PolarHBondContact O-N 2.94Å; F207-D209 VanDerWaalsContact C-N 3.26Å; F207-D209 PolarHBondContact O-N 3.4Å; F207-G210 PolarHBondContact O-N 3.05Å; F207-L213 HydrophobicContact CB-CD2 4.41Å; F207-L213 HydrophobicContact CB-CG 4.22Å; F207-L213 HydrophobicContact CD1-CD2 3.53Å; F207-L213 HydrophobicContact CD1-CG 3.79Å; F207-L213 HydrophobicContact CE1-CD2 4.18Å; F207-L213 HydrophobicContact CG-CD2 4.3Å; F207-L213 HydrophobicContact CG-CG 4.48Å; F207-L216 HydrophobicContact CE1-CD2 4.16Å; F207-T274 HydrophobicContact CB-CG2 3.99Å; F207-L278 HydrophobicContact CD1-CD2 3.92Å; F207-L278 HydrophobicContact CD2-CD1 3.93Å; F207-L278 HydrophobicContact CD2-CD2 4.3Å; F207-L278 HydrophobicContact CE1-CD2 3.74Å; F207-L278 HydrophobicContact CE2-CD1 3.94Å; F207-L278 HydrophobicContact CE2-CD2 4.15Å; F207-L278 HydrophobicContact CG-CD1 4.43Å; F207-L278 HydrophobicContact CG-CD2 4.18Å; F207-L278 HydrophobicContact CZ-CD1 4.44Å; F207-L278 HydrophobicContact CZ-CD2 3.85Å
208A94Very high88.1Confident10 Ų1053.5 Ų53.58%0.08327%0.274CS..G310 helixtrans-67.9-21.2-172.500000114.4K205 K206 G210 V266 V267 L269K205-A208 WeakPolarHBondContact O-CB 3.39Å; K205-A208 PolarHBondContact O-N 3.19Å; K206-A208 PolarHBondContact O-N 3.01Å; A208-G210 VanDerWaalsContact C-N 3.29Å; A208-V266 WeakPolarHBondContact CB-O 3.45Å; A208-V267 WeakPolarHBondContact O-CA 3.43Å; A208-L269 HydrophobicContact CB-CD2 3.39Å; A208-L269 HydrophobicContact CB-CG 4.3Å
209D95.9Very high89.3Confident47 Ų4756.9 Ų56.925%0.25129%0.287SS..G310 helixtrans-86.8-1.9175.36812000113.7F207 V211 P234 K240 N243F207-D209 VanDerWaalsContact C-N 3.26Å; F207-D209 PolarHBondContact O-N 3.4Å; D209-V211 PolarHBondContact O-N 3.29Å; D209-V211 VanDerWaalsContact O-N 3.15Å; D209-V211 WeakPolarHBondContact OD1-CB 3.26Å; D209-V211 PolarHBondContact OD1-N 2.71Å; D209-P234 HydrophobicContact CB-CG 3.77Å; D209-K240 HydrophobicContact CB-CD 4.39Å; D209-K240 HydrophobicContact CB-CG 4.18Å; D209-N243 WeakPolarHBondContact O-CB 3.4Å; D209-N243 PolarHBondContact O-ND2 3.06Å; D209-N243 VanDerWaalsContact O-ND2 3.1Å
210G96.6Very high90.2Very high0 Ų053 Ų530%027%0.267CS..SBendtrans74.4-13.9-179.600000115.3F207 A208 Y212 L213 V214F207-G210 PolarHBondContact O-N 3.05Å; A208-G210 VanDerWaalsContact C-N 3.29Å; G210-Y212 PolarHBondContact O-N 3.43Å; G210-L213 PolarHBondContact O-N 3.29Å; G210-V214 WeakPolarHBondContact O-CG2 3.33Å; G210-V214 PolarHBondContact O-N 3.41Å; G210-V214 VanDerWaalsContact O-N 3.07Å
211V97.2Very high91.4Very high10 Ų1049 Ų496%0.06125%0.25CS..Hα-helixtrans-63-48.9-174.8176.30000110.6D209 L213 V214 L215 F230 Y231 L232 P234D209-V211 PolarHBondContact O-N 3.29Å; D209-V211 VanDerWaalsContact O-N 3.15Å; D209-V211 WeakPolarHBondContact OD1-CB 3.26Å; D209-V211 PolarHBondContact OD1-N 2.71Å; V211-L213 VanDerWaalsContact C-N 3.27Å; V211-L213 PolarHBondContact O-N 2.94Å; V211-V214 PolarHBondContact O-N 3.28Å; V211-L215 HydrophobicContact CG1-CD1 3.93Å; V211-L215 HydrophobicContact CG1-CG 4.37Å; V211-L215 WeakPolarHBondContact O-CG 3.38Å; V211-L215 PolarHBondContact O-N 3.2Å; V211-F230 HydrophobicContact CG1-CE2 4.27Å; V211-Y231 VanDerWaalsContact CG2-O 3.31Å; V211-Y231 WeakPolarHBondContact CG2-O 3.39Å; V211-L232 HydrophobicContact CG1-CD1 4.05Å; V211-P234 HydrophobicContact CG2-CG 4.04Å
212Y96.1Very high92.4Very high118 Ų11855.6 Ų55.646%0.46329%0.286SS..Hα-helixtrans-65.7-28.6178.6-71.1-60.6000113.2K206 G210 L216K206-Y212 HydrophobicContact CB-CD2 3.8Å; K206-Y212 HydrophobicContact CB-CE2 3.73Å; K206-Y212 HydrophobicContact CD-CE2 4.41Å; K206-Y212 VanDerWaalsContact O-CD2 3.28Å; K206-Y212 WeakPolarHBondContact O-CD2 3.28Å; G210-Y212 PolarHBondContact O-N 3.43Å; Y212-L216 WeakPolarHBondContact O-CB 3.49Å; Y212-L216 PolarHBondContact O-N 3.17Å
213L96.7Very high93.2Very high1 Ų156 Ų561%0.00528%0.276CS..Hα-helixtrans-68.9-44.7174.9-69.7175.4000111.1F207 G210 V211 L216 M217 V244 A247 M251 V266 V277 L278 L281F207-L213 HydrophobicContact CB-CD2 4.41Å; F207-L213 HydrophobicContact CB-CG 4.22Å; F207-L213 HydrophobicContact CD1-CD2 3.53Å; F207-L213 HydrophobicContact CD1-CG 3.79Å; F207-L213 HydrophobicContact CE1-CD2 4.18Å; F207-L213 HydrophobicContact CG-CD2 4.3Å; F207-L213 HydrophobicContact CG-CG 4.48Å; G210-L213 PolarHBondContact O-N 3.29Å; V211-L213 VanDerWaalsContact C-N 3.27Å; V211-L213 PolarHBondContact O-N 2.94Å; L213-L216 PolarHBondContact O-N 3.46Å; L213-M217 WeakPolarHBondContact O-CG 3.32Å; L213-M217 PolarHBondContact O-N 3.15Å; L213-V244 HydrophobicContact CD1-CG1 4.37Å; L213-A247 HydrophobicContact CB-CB 3.61Å; L213-M251 HydrophobicContact CD2-CE 4.24Å; L213-V266 HydrophobicContact CD1-CG1 4.41Å; L213-V277 HydrophobicContact CD2-CG1 4.22Å; L213-L278 HydrophobicContact CD2-CD2 3.89Å; L213-L281 HydrophobicContact CD2-CD1 4.46Å
214V97.6Very high93.9Very high0 Ų060 Ų600%029%0.287CS..Hα-helixtrans-60.9-48.7176.8174.10000110.9G210 V211 L216 M217 G218 V225 F230 F246 A247 L250G210-V214 WeakPolarHBondContact O-CG2 3.33Å; G210-V214 PolarHBondContact O-N 3.41Å; G210-V214 VanDerWaalsContact O-N 3.07Å; V211-V214 PolarHBondContact O-N 3.28Å; V214-L216 PolarHBondContact O-N 3.24Å; V214-M217 PolarHBondContact O-N 2.8Å; V214-G218 PolarHBondContact O-N 2.93Å; V214-G218 VanDerWaalsContact O-N 3.17Å; V214-V225 HydrophobicContact CG1-CB 4.09Å; V214-V225 HydrophobicContact CG1-CG1 3.65Å; V214-V225 HydrophobicContact CG1-CG2 4.02Å; V214-F230 HydrophobicContact CB-CD2 4.48Å; V214-F230 HydrophobicContact CG1-CB 4.49Å; V214-F230 HydrophobicContact CG1-CD1 3.82Å; V214-F230 HydrophobicContact CG1-CD2 4.21Å; V214-F230 HydrophobicContact CG1-CE1 4.01Å; V214-F230 HydrophobicContact CG1-CE2 4.39Å; V214-F230 HydrophobicContact CG1-CG 3.92Å; V214-F230 HydrophobicContact CG1-CZ 4.28Å; V214-F230 HydrophobicContact CG2-CB 4.46Å; V214-F246 HydrophobicContact CG1-CD1 4.23Å; V214-F246 HydrophobicContact CG1-CE1 4.11Å; V214-F246 HydrophobicContact CG2-CD1 3.93Å; V214-A247 HydrophobicContact CG2-CB 3.87Å; V214-L250 HydrophobicContact CG1-CD1 4.19Å
215L96Very high94.3Very high72 Ų7260 Ų6038%0.37729%0.287SS..Hα-helixtrans-65-39.6179.1-65.5178.3000112V211 M217 G218 L219 F230V211-L215 HydrophobicContact CG1-CD1 3.93Å; V211-L215 HydrophobicContact CG1-CG 4.37Å; V211-L215 WeakPolarHBondContact O-CG 3.38Å; V211-L215 PolarHBondContact O-N 3.2Å; L215-M217 VanDerWaalsContact C-N 3.33Å; L215-M217 PolarHBondContact O-N 2.96Å; L215-G218 PolarHBondContact O-N 2.87Å; L215-L219 WeakPolarHBondContact O-CG 3.41Å; L215-L219 PolarHBondContact O-N 3.18Å; L215-F230 HydrophobicContact CD2-CZ 4.1Å
216L94.8Very high94.7Very high49 Ų4956.7 Ų56.726%0.25728%0.277SS..Hα-helixtrans-62.1-40.9176.4178.660.9000111.5F207 Y212 L213 V214 L219 L220 L281F207-L216 HydrophobicContact CE1-CD2 4.16Å; Y212-L216 WeakPolarHBondContact O-CB 3.49Å; Y212-L216 PolarHBondContact O-N 3.17Å; L213-L216 PolarHBondContact O-N 3.46Å; V214-L216 PolarHBondContact O-N 3.24Å; L216-L219 PolarHBondContact O-N 2.88Å; L216-L220 HydrophobicContact CD1-CD1 3.88Å; L216-L220 HydrophobicContact CD1-CG 3.98Å; L216-L220 HydrophobicContact CD2-CD1 4.44Å; L216-L220 HydrophobicContact CG-CD1 3.75Å; L216-L220 HydrophobicContact CG-CG 4.29Å; L216-L220 WeakPolarHBondContact O-CB 3.25Å; L216-L220 VanDerWaalsContact O-CG 3.27Å; L216-L220 WeakPolarHBondContact O-CG 3.45Å; L216-L220 PolarHBondContact O-N 3.31Å; L216-L281 HydrophobicContact CD2-CD1 3.82Å
217M95.8Very high94.8Very high0 Ų056 Ų560%028%0.278CS..Hα-helixtrans-61.5-45.1175-76.6-52.8-52.200112.3L213 V214 L215 L219 L220 E221 L250 M251 L281L213-M217 WeakPolarHBondContact O-CG 3.32Å; L213-M217 PolarHBondContact O-N 3.15Å; V214-M217 PolarHBondContact O-N 2.8Å; L215-M217 VanDerWaalsContact C-N 3.33Å; L215-M217 PolarHBondContact O-N 2.96Å; M217-L219 VanDerWaalsContact C-N 3.29Å; M217-L219 PolarHBondContact O-N 3.37Å; M217-L220 PolarHBondContact O-N 2.94Å; M217-E221 HydrophobicContact CE-CG 3.84Å; M217-E221 WeakPolarHBondContact O-CB 3.39Å; M217-E221 PolarHBondContact O-N 3.41Å; M217-L250 HydrophobicContact CB-CB 4.06Å; M217-L250 HydrophobicContact CB-CD1 4.13Å; M217-L250 HydrophobicContact CG-CB 4.07Å; M217-M251 HydrophobicContact CE-CG 4.21Å; M217-M251 HydrophobicContact CG-CE 4.33Å; M217-M251 HydrophobicContact CG-CG 4.02Å; M217-M251 HydrophobicContact SD-CB 4.39Å; M217-M251 HydrophobicContact SD-CE 4.37Å; M217-M251 HydrophobicContact SD-CG 3.43Å; M217-M251 WeakPolarHBondContact SD-CG 3.35Å; M217-L281 HydrophobicContact SD-CD2 3.43Å; M217-L281 WeakPolarHBondContact SD-CD2 3.5Å
218G93.8Very high94.8Very high7 Ų761.6 Ų61.67%0.07230%0.304CS..Hα-helixtrans-59.3-39.7175.600000112.9V214 L215 D222 Y223V214-G218 PolarHBondContact O-N 2.93Å; V214-G218 VanDerWaalsContact O-N 3.17Å; L215-G218 PolarHBondContact O-N 2.87Å; G218-D222 PolarHBondContact O-N 3.03Å; G218-D222 VanDerWaalsContact O-N 3.12Å; G218-Y223 CarbonylContact C-O 3.27Å; G218-Y223 VanDerWaalsContact C-O 3.27Å; G218-Y223 WeakPolarHBondContact CA-O 3.34Å; G218-Y223 PolarHBondContact O-N 3.33Å
219L93.4Very high94.9Very high142 Ų14265.2 Ų65.274%0.74332%0.319SS*.Hα-helixtrans-68.8-40.3176.3-68.9173.2000113.2L215 L216 M217L215-L219 WeakPolarHBondContact O-CG 3.41Å; L215-L219 PolarHBondContact O-N 3.18Å; L216-L219 PolarHBondContact O-N 2.88Å; M217-L219 VanDerWaalsContact C-N 3.29Å; M217-L219 PolarHBondContact O-N 3.37Å
220L92.5Very high95Very high60 Ų6063.4 Ų63.431%0.31431%0.309SS..Hα-helixtrans-72.8-31.6-177.7-72.4170.8000113.1L216 M217 L281 Y285L216-L220 HydrophobicContact CD1-CD1 3.88Å; L216-L220 HydrophobicContact CD1-CG 3.98Å; L216-L220 HydrophobicContact CD2-CD1 4.44Å; L216-L220 HydrophobicContact CG-CD1 3.75Å; L216-L220 HydrophobicContact CG-CG 4.29Å; L216-L220 WeakPolarHBondContact O-CB 3.25Å; L216-L220 VanDerWaalsContact O-CG 3.27Å; L216-L220 WeakPolarHBondContact O-CG 3.45Å; L216-L220 PolarHBondContact O-N 3.31Å; M217-L220 PolarHBondContact O-N 2.94Å; L220-L281 HydrophobicContact CD1-CD2 4.23Å; L220-Y285 HydrophobicContact CB-CD1 4.21Å; L220-Y285 HydrophobicContact CB-CD2 4.36Å; L220-Y285 HydrophobicContact CB-CE1 4.07Å; L220-Y285 HydrophobicContact CB-CE2 4.25Å; L220-Y285 HydrophobicContact CB-CG 4.37Å; L220-Y285 HydrophobicContact CD1-CD2 3.69Å; L220-Y285 HydrophobicContact CD1-CE2 3.87Å; L220-Y285 HydrophobicContact CD1-CG 4.25Å; L220-Y285 HydrophobicContact CD2-CD1 4.29Å; L220-Y285 HydrophobicContact CD2-CD2 4.17Å; L220-Y285 HydrophobicContact CD2-CG 3.88Å; L220-Y285 HydrophobicContact CG-CD2 4.3Å; L220-Y285 HydrophobicContact CG-CG 4.4Å
221E93.1Very high95Very high69 Ų6968.5 Ų68.532%0.32233%0.329SS..THydrogen-bonded Turntrans-100.67.6-179.5-67.7-72.2132.900113.1M217 Y223 Y285M217-E221 HydrophobicContact CE-CG 3.84Å; M217-E221 WeakPolarHBondContact O-CB 3.39Å; M217-E221 PolarHBondContact O-N 3.41Å; E221-Y223 HydrophobicContact CB-CD1 3.38Å; E221-Y223 HydrophobicContact CB-CE1 3.09Å; E221-Y223 HydrophobicContact CB-CG 4.49Å; E221-Y223 HydrophobicContact CG-CD1 4.5Å; E221-Y223 HydrophobicContact CG-CE1 3.78Å; E221-Y223 PolarHBondContact O-N 2.77Å; E221-Y285 VanDerWaalsContact OE1-CE1 3.25Å; E221-Y285 WeakPolarHBondContact OE1-CE1 3.39Å; E221-Y285 VanDerWaalsContact OE1-CZ 3.22Å; E221-Y285 PolarHBondContact OE1-OH 3.34Å
222D93Very high95Very high156 Ų15672.3 Ų72.383%0.83435%0.349SS*.THydrogen-bonded Turntrans54.344.3178.2-161.934.1000114.2G218G218-D222 PolarHBondContact O-N 3.03Å; G218-D222 VanDerWaalsContact O-N 3.12Å
223Y93.7Very high95Very high86 Ų8672.2 Ų72.234%0.33736%0.361SS..  trans-135.6156.4173.765.1-109.9000113.7G218 E221 V225G218-Y223 CarbonylContact C-O 3.27Å; G218-Y223 VanDerWaalsContact C-O 3.27Å; G218-Y223 WeakPolarHBondContact CA-O 3.34Å; G218-Y223 PolarHBondContact O-N 3.33Å; E221-Y223 HydrophobicContact CB-CD1 3.38Å; E221-Y223 HydrophobicContact CB-CE1 3.09Å; E221-Y223 HydrophobicContact CB-CG 4.49Å; E221-Y223 HydrophobicContact CG-CD1 4.5Å; E221-Y223 HydrophobicContact CG-CE1 3.78Å; E221-Y223 PolarHBondContact O-N 2.77Å; Y223-V225 HydrophobicContact CD2-CG2 4.09Å; Y223-V225 HydrophobicContact CE2-CG2 3.62Å
224F94.9Very high94.9Very high162 Ų16273 Ų7371%0.71137%0.366SS*.PPolyproline II helixtrans-86.2130.7172.6178.6-101.1000111.2P226F224-P226 WeakPolarHBondContact O-CD 3.48Å
225V95.6Very high94.8Very high10 Ų1081.4 Ų81.46%0.06141%0.405CS..PPolyproline II helixtrans-91.6118.6171.5-176.80000109.9V214 Y223 L227 F230 F246 L250V214-V225 HydrophobicContact CG1-CB 4.09Å; V214-V225 HydrophobicContact CG1-CG1 3.65Å; V214-V225 HydrophobicContact CG1-CG2 4.02Å; Y223-V225 HydrophobicContact CD2-CG2 4.09Å; Y223-V225 HydrophobicContact CE2-CG2 3.62Å; V225-L227 PolarHBondContact O-N 2.88Å; V225-F230 HydrophobicContact CB-CE1 4.23Å; V225-F230 HydrophobicContact CG1-CD1 3.75Å; V225-F230 HydrophobicContact CG1-CE1 3.76Å; V225-F246 HydrophobicContact CG1-CE1 3.68Å; V225-F246 HydrophobicContact CG1-CZ 4.17Å; V225-L250 HydrophobicContact CG2-CD1 4.07Å
226P95Very high94.9Very high43 Ų4380.2 Ų80.228%0.27940%0.403SS..PPolyproline II helixtrans-60.6133.5177.4-24.134.4000113.7F224 H228 H229F224-P226 WeakPolarHBondContact O-CD 3.48Å; P226-H228 WeakPolarHBondContact CB-CE1 3.48Å; P226-H228 WeakPolarHBondContact CB-ND1 3.48Å; P226-H228 PolarHBondContact O-N 2.87Å; P226-H229 PolarHBondContact O-N 3.44Å
227L91.3Very high94.9Very high101 Ų10182.1 Ų82.153%0.52941%0.409SS..THydrogen-bonded Turntrans-63.5-12.3-177.5-62.9-179.3000114.8V225 F230 L232V225-L227 PolarHBondContact O-N 2.88Å; L227-F230 HydrophobicContact CD2-CE1 3.97Å; L227-F230 HydrophobicContact CD2-CZ 3.71Å; L227-L232 HydrophobicContact CD2-CD1 4.47Å; L227-L232 HydrophobicContact CD2-CD2 4.4Å
228H93.6Very high95Very high150 Ų15088 Ų8869%0.69444%0.441SS*.THydrogen-bonded Turntrans-86.1-8.7176.563.3-92.4000113.1P226P226-H228 WeakPolarHBondContact CB-CE1 3.48Å; P226-H228 WeakPolarHBondContact CB-ND1 3.48Å; P226-H228 PolarHBondContact O-N 2.87Å
229H95.6Very high95.2Very high86 Ų8690.1 Ų90.140%0.39845%0.449SS..SBendtrans-87.8-17177.1-68.8159.4000113.5P226 H242 F246P226-H229 PolarHBondContact O-N 3.44Å; H229-H242 PolarHBondContact O-NE2 3.13Å; H229-F246 HydrophobicContact CB-CE1 3.83Å; H229-F246 HydrophobicContact CB-CE2 4.3Å; H229-F246 HydrophobicContact CB-CZ 3.66Å
230F98Very high95.4Very high9 Ų986.6 Ų86.64%0.03943%0.427CS..SBendtrans-146.4160.1-17874.9-79.9000111V211 V214 L215 V225 L227 L232 N243 F246V211-F230 HydrophobicContact CG1-CE2 4.27Å; V214-F230 HydrophobicContact CB-CD2 4.48Å; V214-F230 HydrophobicContact CG1-CB 4.49Å; V214-F230 HydrophobicContact CG1-CD1 3.82Å; V214-F230 HydrophobicContact CG1-CD2 4.21Å; V214-F230 HydrophobicContact CG1-CE1 4.01Å; V214-F230 HydrophobicContact CG1-CE2 4.39Å; V214-F230 HydrophobicContact CG1-CG 3.92Å; V214-F230 HydrophobicContact CG1-CZ 4.28Å; V214-F230 HydrophobicContact CG2-CB 4.46Å; L215-F230 HydrophobicContact CD2-CZ 4.1Å; V225-F230 HydrophobicContact CB-CE1 4.23Å; V225-F230 HydrophobicContact CG1-CD1 3.75Å; V225-F230 HydrophobicContact CG1-CE1 3.76Å; L227-F230 HydrophobicContact CD2-CE1 3.97Å; L227-F230 HydrophobicContact CD2-CZ 3.71Å; F230-L232 HydrophobicContact CE2-CB 4.44Å; F230-L232 HydrophobicContact CE2-CD1 3.97Å; F230-L232 HydrophobicContact CZ-CD1 4.3Å; F230-N243 WeakPolarHBondContact CB-OD1 3.45Å; F230-F246 HydrophobicContact CB-CD1 4.1Å; F230-F246 HydrophobicContact CB-CE1 4.46Å
231Y98Very high95.7Very high107 Ų10784.8 Ų84.842%0.4242%0.419SS..  trans-88.9112.1178.8-61.1-84.4000109.6V211 T233 P234 Q239 H242 N243V211-Y231 VanDerWaalsContact CG2-O 3.31Å; V211-Y231 WeakPolarHBondContact CG2-O 3.39Å; Y231-T233 VanDerWaalsContact C-N 3.26Å; Y231-T233 PolarHBondContact O-N 2.99Å; Y231-P234 WeakPolarHBondContact O-CD 3.42Å; Y231-Q239 HydrophobicContact CD1-CG 3.88Å; Y231-Q239 HydrophobicContact CD2-CB 3.73Å; Y231-Q239 HydrophobicContact CD2-CG 3.72Å; Y231-Q239 HydrophobicContact CE1-CG 3.9Å; Y231-Q239 HydrophobicContact CE2-CB 4.15Å; Y231-Q239 HydrophobicContact CE2-CG 3.75Å; Y231-Q239 HydrophobicContact CG-CB 3.94Å; Y231-Q239 HydrophobicContact CG-CG 3.79Å; Y231-H242 AromaticContact CD2-CD2 3.86Å; Y231-H242 HydrophobicContact CE2-CB 4.31Å; Y231-H242 AromaticContact CE2-CD2 3.71Å; Y231-N243 PolarHBondContact N-OD1 3.2Å; Y231-N243 PolarHBondContact O-ND2 2.85Å
232L95.8Very high95.9Very high91 Ų9185.4 Ų85.448%0.47642%0.422SS..SBendtrans-67.8-28178.6-172.564.8000112.9V211 L227 F230V211-L232 HydrophobicContact CG1-CD1 4.05Å; L227-L232 HydrophobicContact CD2-CD1 4.47Å; L227-L232 HydrophobicContact CD2-CD2 4.4Å; F230-L232 HydrophobicContact CE2-CB 4.44Å; F230-L232 HydrophobicContact CE2-CD1 3.97Å; F230-L232 HydrophobicContact CZ-CD1 4.3Å
233T96Very high96.2Very high116 Ų11678 Ų7871%0.71238%0.382SS*.SBendtrans-130.472.9178.143.70000109.2Y231 E235Y231-T233 VanDerWaalsContact C-N 3.26Å; Y231-T233 PolarHBondContact O-N 2.99Å; T233-E235 PolarHBondContact O-N 2.77Å
234P96.4Very high96.4Very high16 Ų1673.9 Ų73.910%0.10437%0.366CS..  trans-73.9122.4-175.331.5-34.4000110.9D209 V211 Y231 Q239 K240D209-P234 HydrophobicContact CB-CG 3.77Å; V211-P234 HydrophobicContact CG2-CG 4.04Å; Y231-P234 WeakPolarHBondContact O-CD 3.42Å; P234-Q239 HydrophobicContact CB-CB 3.79Å; P234-K240 HydrophobicContact CB-CG 3.79Å; P234-K240 HydrophobicContact CG-CG 3.94Å; P234-K240 WeakPolarHBondContact O-CE 3.45Å
235E94.6Very high96.5Very high178 Ų17868 Ų6883%0.83235%0.345SS*.  trans-98-34.8-179-63.4-171.8167.400112.2T233T233-E235 PolarHBondContact O-N 2.77Å
236S97.3Very high96.7Very high47 Ų4769 Ų6933%0.32935%0.348SS..SBendtrans-94.9156.9-178.966.80000112.9D238 Q239 K240S236-D238 VanDerWaalsContact C-N 3.3Å; S236-D238 PolarHBondContact O-N 3.04Å; S236-Q239 PolarHBondContact O-N 2.79Å; S236-Q239 WeakPolarHBondContact OG-CB 3.46Å; S236-Q239 WeakPolarHBondContact OG-CG 3.38Å; S236-Q239 PolarHBondContact OG-N 3.37Å; S236-K240 WeakPolarHBondContact O-CG 3.12Å; S236-K240 PolarHBondContact O-N 3.31Å
237F96.4Very high96.8Very high88 Ų8867 Ų6739%0.38634%0.335SS..Hα-helixtrans-56.7-45.2173.3-176.2-94.3000111.3Q239 K240 V241 E264 V267 N268F237-Q239 VanDerWaalsContact C-N 3.35Å; F237-Q239 PolarHBondContact O-N 2.92Å; F237-K240 WeakPolarHBondContact O-CB 3.3Å; F237-K240 PolarHBondContact O-N 3.43Å; F237-K240 VanDerWaalsContact O-N 3.12Å; F237-V241 HydrophobicContact CD1-CG2 3.81Å; F237-V241 HydrophobicContact CE1-CG2 3.43Å; F237-V241 VanDerWaalsContact CE1-CG2 3.43Å; F237-V241 HydrophobicContact CG-CG2 4.5Å; F237-V241 HydrophobicContact CZ-CG2 3.82Å; F237-V241 WeakPolarHBondContact O-CG2 3.43Å; F237-V241 PolarHBondContact O-N 3.47Å; F237-E264 HydrophobicContact CE1-CG 4.35Å; F237-E264 HydrophobicContact CZ-CB 4.15Å; F237-E264 HydrophobicContact CZ-CG 4.38Å; F237-V267 HydrophobicContact CD2-CG1 3.52Å; F237-V267 HydrophobicContact CE2-CB 3.98Å; F237-V267 HydrophobicContact CE2-CG1 3.42Å; F237-V267 VanDerWaalsContact CE2-CG1 3.42Å; F237-V267 HydrophobicContact CG-CG1 4.36Å; F237-V267 HydrophobicContact CZ-CB 4.38Å; F237-V267 HydrophobicContact CZ-CG1 4.19Å; F237-N268 WeakPolarHBondContact CE2-OD1 3.1Å
238D97.2Very high97.1Very high124 Ų12462.7 Ų62.766%0.66331%0.312SS*.Hα-helixtrans-63.3-38-179.2-61.8-35.7000112.7S236 K240 V241 H242S236-D238 VanDerWaalsContact C-N 3.3Å; S236-D238 PolarHBondContact O-N 3.04Å; D238-K240 VanDerWaalsContact C-N 3.34Å; D238-K240 PolarHBondContact O-N 2.85Å; D238-V241 PolarHBondContact O-N 2.71Å; D238-H242 WeakPolarHBondContact O-CB 3.42Å; D238-H242 PolarHBondContact O-N 3.18Å
239Q98.1Very high97.2Very high52 Ų5260.8 Ų60.824%0.24330%0.304CS..Hα-helixtrans-63.6-39.3174.2-75.8171.5-9.500112.3Y231 P234 S236 F237 H242 N243Y231-Q239 HydrophobicContact CD1-CG 3.88Å; Y231-Q239 HydrophobicContact CD2-CB 3.73Å; Y231-Q239 HydrophobicContact CD2-CG 3.72Å; Y231-Q239 HydrophobicContact CE1-CG 3.9Å; Y231-Q239 HydrophobicContact CE2-CB 4.15Å; Y231-Q239 HydrophobicContact CE2-CG 3.75Å; Y231-Q239 HydrophobicContact CG-CB 3.94Å; Y231-Q239 HydrophobicContact CG-CG 3.79Å; P234-Q239 HydrophobicContact CB-CB 3.79Å; S236-Q239 PolarHBondContact O-N 2.79Å; S236-Q239 WeakPolarHBondContact OG-CB 3.46Å; S236-Q239 WeakPolarHBondContact OG-CG 3.38Å; S236-Q239 PolarHBondContact OG-N 3.37Å; F237-Q239 VanDerWaalsContact C-N 3.35Å; F237-Q239 PolarHBondContact O-N 2.92Å; Q239-H242 WeakPolarHBondContact O-CB 3.4Å; Q239-H242 PolarHBondContact O-N 3.43Å; Q239-N243 PolarHBondContact O-N 2.89Å; Q239-N243 PolarHBondContact O-OD1 3.09Å
240K98.1Very high97.3Very high67 Ų6757.5 Ų57.529%0.29129%0.289SS..Hα-helixtrans-67.3-43.6176.2-63.5174.9-174.9176.70111.1D209 P234 S236 F237 D238 H242 N243 V244 V267D209-K240 HydrophobicContact CB-CD 4.39Å; D209-K240 HydrophobicContact CB-CG 4.18Å; P234-K240 HydrophobicContact CB-CG 3.79Å; P234-K240 HydrophobicContact CG-CG 3.94Å; P234-K240 WeakPolarHBondContact O-CE 3.45Å; S236-K240 WeakPolarHBondContact O-CG 3.12Å; S236-K240 PolarHBondContact O-N 3.31Å; F237-K240 WeakPolarHBondContact O-CB 3.3Å; F237-K240 PolarHBondContact O-N 3.43Å; F237-K240 VanDerWaalsContact O-N 3.12Å; D238-K240 VanDerWaalsContact C-N 3.34Å; D238-K240 PolarHBondContact O-N 2.85Å; K240-H242 VanDerWaalsContact C-N 3.32Å; K240-H242 PolarHBondContact O-N 3.08Å; K240-N243 PolarHBondContact O-N 3.03Å; K240-V244 WeakPolarHBondContact O-CG2 3.4Å; K240-V244 PolarHBondContact O-N 2.92Å; K240-V267 HydrophobicContact CB-CB 4.42Å; K240-V267 HydrophobicContact CB-CG1 3.65Å; K240-V267 HydrophobicContact CB-CG2 3.78Å; K240-V267 HydrophobicContact CD-CG1 4Å; K240-V267 HydrophobicContact CG-CG1 4.48Å
241V97.8Very high97.2Very high23 Ų2357.1 Ų57.114%0.13929%0.287CS..Hα-helixtrans-61.7-41.5176.2170.30000111F237 D238 V244 S245 P263 E264 V267F237-V241 HydrophobicContact CD1-CG2 3.81Å; F237-V241 HydrophobicContact CE1-CG2 3.43Å; F237-V241 VanDerWaalsContact CE1-CG2 3.43Å; F237-V241 HydrophobicContact CG-CG2 4.5Å; F237-V241 HydrophobicContact CZ-CG2 3.82Å; F237-V241 WeakPolarHBondContact O-CG2 3.43Å; F237-V241 PolarHBondContact O-N 3.47Å; D238-V241 PolarHBondContact O-N 2.71Å; V241-V244 PolarHBondContact O-N 3.44Å; V241-S245 WeakPolarHBondContact O-CB 3.42Å; V241-S245 PolarHBondContact O-N 3.27Å; V241-S245 PolarHBondContact O-OG 3.42Å; V241-P263 HydrophobicContact CG1-CB 4.11Å; V241-E264 HydrophobicContact CG1-CG 4.28Å; V241-E264 HydrophobicContact CG2-CG 4.05Å; V241-V267 HydrophobicContact CB-CG2 4.46Å; V241-V267 HydrophobicContact CG2-CB 4.21Å; V241-V267 HydrophobicContact CG2-CG1 4.42Å; V241-V267 HydrophobicContact CG2-CG2 3.78Å
242H98.4Very high97Very high82 Ų8255.6 Ų55.638%0.3829%0.286SS..Hα-helixtrans-57-51.1173.1174.684.6000111.3H229 Y231 D238 Q239 K240 V244 S245 F246H229-H242 PolarHBondContact O-NE2 3.13Å; Y231-H242 AromaticContact CD2-CD2 3.86Å; Y231-H242 HydrophobicContact CE2-CB 4.31Å; Y231-H242 AromaticContact CE2-CD2 3.71Å; D238-H242 WeakPolarHBondContact O-CB 3.42Å; D238-H242 PolarHBondContact O-N 3.18Å; Q239-H242 WeakPolarHBondContact O-CB 3.4Å; Q239-H242 PolarHBondContact O-N 3.43Å; K240-H242 VanDerWaalsContact C-N 3.32Å; K240-H242 PolarHBondContact O-N 3.08Å; H242-V244 PolarHBondContact O-N 3.48Å; H242-S245 PolarHBondContact O-N 3.43Å; H242-F246 WeakPolarHBondContact O-CB 3.45Å; H242-F246 PolarHBondContact O-N 3.18Å
243N98.4Very high96.9Very high0 Ų057.7 Ų57.70%030%0.298CS..Hα-helixtrans-59.1-45.1179.1-73.2-5.1000112.7D209 F230 Y231 Q239 K240 F246 A247D209-N243 WeakPolarHBondContact O-CB 3.4Å; D209-N243 PolarHBondContact O-ND2 3.06Å; D209-N243 VanDerWaalsContact O-ND2 3.1Å; F230-N243 WeakPolarHBondContact CB-OD1 3.45Å; Y231-N243 PolarHBondContact N-OD1 3.2Å; Y231-N243 PolarHBondContact O-ND2 2.85Å; Q239-N243 PolarHBondContact O-N 2.89Å; Q239-N243 PolarHBondContact O-OD1 3.09Å; K240-N243 PolarHBondContact O-N 3.03Å; N243-F246 PolarHBondContact O-N 3.43Å; N243-A247 PolarHBondContact O-N 2.63Å
244V98.2Very high96.6Very high0 Ų052.7 Ų52.70%027%0.269CS..Hα-helixtrans-66-42.1179177.60000111L213 K240 V241 H242 F246 A247 F248 P263 V266 V267L213-V244 HydrophobicContact CD1-CG1 4.37Å; K240-V244 WeakPolarHBondContact O-CG2 3.4Å; K240-V244 PolarHBondContact O-N 2.92Å; V241-V244 PolarHBondContact O-N 3.44Å; H242-V244 PolarHBondContact O-N 3.48Å; V244-F246 VanDerWaalsContact C-N 3.34Å; V244-F246 PolarHBondContact O-N 2.91Å; V244-A247 PolarHBondContact O-N 3.49Å; V244-F248 HydrophobicContact CG1-CD1 4.31Å; V244-F248 HydrophobicContact CG1-CE1 3.76Å; V244-F248 HydrophobicContact CG1-CE2 4.18Å; V244-F248 HydrophobicContact CG1-CZ 3.69Å; V244-F248 WeakPolarHBondContact O-CD1 3.23Å; V244-F248 WeakPolarHBondContact O-CG 3.36Å; V244-F248 PolarHBondContact O-N 3.18Å; V244-P263 HydrophobicContact CB-CB 4.09Å; V244-P263 HydrophobicContact CG1-CB 3.9Å; V244-V266 HydrophobicContact CG1-CB 4.01Å; V244-V266 HydrophobicContact CG1-CG1 4.2Å; V244-V266 HydrophobicContact CG1-CG2 4.18Å; V244-V266 HydrophobicContact CG2-CB 4.36Å; V244-V266 HydrophobicContact CG2-CG1 4.02Å; V244-V267 HydrophobicContact CG2-CG2 3.91Å
245S97.9Very high96.3Very high38 Ų3854.4 Ų54.427%0.26629%0.289SS..Hα-helixtrans-59.7-46.9176.2-57.60000111.1V241 H242 A247 F248 E249 P263V241-S245 WeakPolarHBondContact O-CB 3.42Å; V241-S245 PolarHBondContact O-N 3.27Å; V241-S245 PolarHBondContact O-OG 3.42Å; H242-S245 PolarHBondContact O-N 3.43Å; S245-A247 PolarHBondContact O-N 2.97Å; S245-F248 WeakPolarHBondContact O-CB 3.13Å; S245-F248 PolarHBondContact O-N 3.4Å; S245-F248 VanDerWaalsContact O-N 3.09Å; S245-E249 PolarHBondContact O-N 3.37Å; S245-E249 VanDerWaalsContact O-N 3.08Å; S245-P263 WeakPolarHBondContact OG-CB 3.49Å; S245-P263 VanDerWaalsContact OG-CG 3.23Å; S245-P263 WeakPolarHBondContact OG-CG 3.43Å
246F98.1Very high96.2Very high31 Ų3146.9 Ų46.914%0.13626%0.255CS..Hα-helixtrans-61.8-41.4176.6-179.1-120.2000112V214 V225 H229 F230 H242 N243 V244 F248 E249 L250V214-F246 HydrophobicContact CG1-CD1 4.23Å; V214-F246 HydrophobicContact CG1-CE1 4.11Å; V214-F246 HydrophobicContact CG2-CD1 3.93Å; V225-F246 HydrophobicContact CG1-CE1 3.68Å; V225-F246 HydrophobicContact CG1-CZ 4.17Å; H229-F246 HydrophobicContact CB-CE1 3.83Å; H229-F246 HydrophobicContact CB-CE2 4.3Å; H229-F246 HydrophobicContact CB-CZ 3.66Å; F230-F246 HydrophobicContact CB-CD1 4.1Å; F230-F246 HydrophobicContact CB-CE1 4.46Å; H242-F246 WeakPolarHBondContact O-CB 3.45Å; H242-F246 PolarHBondContact O-N 3.18Å; N243-F246 PolarHBondContact O-N 3.43Å; V244-F246 VanDerWaalsContact C-N 3.34Å; V244-F246 PolarHBondContact O-N 2.91Å; F246-F248 VanDerWaalsContact C-N 3.26Å; F246-F248 PolarHBondContact O-N 2.76Å; F246-E249 WeakPolarHBondContact O-CB 3.31Å; F246-E249 PolarHBondContact O-N 3.32Å; F246-E249 VanDerWaalsContact O-N 3.15Å; F246-L250 HydrophobicContact CD1-CD1 4.27Å; F246-L250 HydrophobicContact CE1-CD1 3.86Å; F246-L250 HydrophobicContact CE1-CG 4.3Å; F246-L250 HydrophobicContact CE2-CD2 4.2Å; F246-L250 HydrophobicContact CE2-CG 4.38Å; F246-L250 HydrophobicContact CZ-CD1 4.13Å; F246-L250 HydrophobicContact CZ-CD2 3.95Å; F246-L250 HydrophobicContact CZ-CG 4.16Å; F246-L250 WeakPolarHBondContact O-CG 3.46Å; F246-L250 PolarHBondContact O-N 2.85Å
247A97.7Very high95.6Very high0 Ų054 Ų540%028%0.28CS..Hα-helixtrans-60.7-35.4173.800000112.7L213 V214 N243 V244 S245 L250 M251L213-A247 HydrophobicContact CB-CB 3.61Å; V214-A247 HydrophobicContact CG2-CB 3.87Å; N243-A247 PolarHBondContact O-N 2.63Å; V244-A247 PolarHBondContact O-N 3.49Å; S245-A247 PolarHBondContact O-N 2.97Å; A247-L250 PolarHBondContact O-N 2.78Å; A247-M251 HydrophobicContact CB-CE 4.36Å; A247-M251 VanDerWaalsContact O-CG 3.28Å; A247-M251 WeakPolarHBondContact O-CG 3.24Å; A247-M251 PolarHBondContact O-N 3.11Å
248F97.5Very high95Very high11 Ų1157.1 Ų57.15%0.04829%0.293CS..Hα-helixtrans-70.6-31.9176.6-69.92.3000112.6V244 S245 F246 M251 L252 P259 A261 P263 V266 V277V244-F248 HydrophobicContact CG1-CD1 4.31Å; V244-F248 HydrophobicContact CG1-CE1 3.76Å; V244-F248 HydrophobicContact CG1-CE2 4.18Å; V244-F248 HydrophobicContact CG1-CZ 3.69Å; V244-F248 WeakPolarHBondContact O-CD1 3.23Å; V244-F248 WeakPolarHBondContact O-CG 3.36Å; V244-F248 PolarHBondContact O-N 3.18Å; S245-F248 WeakPolarHBondContact O-CB 3.13Å; S245-F248 PolarHBondContact O-N 3.4Å; S245-F248 VanDerWaalsContact O-N 3.09Å; F246-F248 VanDerWaalsContact C-N 3.26Å; F246-F248 PolarHBondContact O-N 2.76Å; F248-M251 HydrophobicContact CD1-CE 4.13Å; F248-M251 HydrophobicContact CD1-SD 4.05Å; F248-M251 HydrophobicContact CE1-CE 4.48Å; F248-M251 PolarHBondContact O-N 2.91Å; F248-L252 PolarHBondContact O-N 3.05Å; F248-L252 VanDerWaalsContact O-N 3.12Å; F248-P259 HydrophobicContact CB-CG 4.19Å; F248-P259 HydrophobicContact CD1-CB 4.23Å; F248-P259 HydrophobicContact CD1-CG 3.76Å; F248-P259 HydrophobicContact CD2-CB 3.96Å; F248-P259 HydrophobicContact CD2-CG 4.08Å; F248-P259 HydrophobicContact CE1-CB 4.16Å; F248-P259 HydrophobicContact CE1-CG 4.1Å; F248-P259 HydrophobicContact CE2-CB 3.89Å; F248-P259 HydrophobicContact CE2-CG 4.4Å; F248-P259 HydrophobicContact CG-CB 4.14Å; F248-P259 HydrophobicContact CG-CG 3.74Å; F248-P259 HydrophobicContact CZ-CB 3.99Å; F248-P259 HydrophobicContact CZ-CG 4.41Å; F248-A261 WeakPolarHBondContact CE2-O 3.13Å; F248-P263 HydrophobicContact CD2-CG 4.2Å; F248-P263 HydrophobicContact CE2-CG 4.16Å; F248-V266 HydrophobicContact CZ-CG2 4.13Å; F248-V277 HydrophobicContact CE1-CG1 3.93Å; F248-V277 HydrophobicContact CE1-CG2 3.81Å; F248-V277 HydrophobicContact CZ-CG2 3.76Å
249E96.6Very high94.5Very high111 Ų11151.7 Ų51.752%0.51927%0.265SS..Hα-helixtrans-64.6-47.7170.4-67174177.500110.4S245 F246 M251 L252 D253S245-E249 PolarHBondContact O-N 3.37Å; S245-E249 VanDerWaalsContact O-N 3.08Å; F246-E249 WeakPolarHBondContact O-CB 3.31Å; F246-E249 PolarHBondContact O-N 3.32Å; F246-E249 VanDerWaalsContact O-N 3.15Å; E249-M251 VanDerWaalsContact C-N 3.27Å; E249-M251 PolarHBondContact O-N 2.62Å; E249-L252 WeakPolarHBondContact O-CA 3.32Å; E249-L252 WeakPolarHBondContact O-CB 3.49Å; E249-L252 PolarHBondContact O-N 3.33Å; E249-D253 PolarHBondContact O-N 3.16Å
250L96.4Very high93.8Very high16 Ų1658.7 Ų58.78%0.08430%0.295CS..Hα-helixtrans-58-38.7175-64.1179.3000112.5V214 M217 V225 F246 A247 L252 D253 G254V214-L250 HydrophobicContact CG1-CD1 4.19Å; M217-L250 HydrophobicContact CB-CB 4.06Å; M217-L250 HydrophobicContact CB-CD1 4.13Å; M217-L250 HydrophobicContact CG-CB 4.07Å; V225-L250 HydrophobicContact CG2-CD1 4.07Å; F246-L250 HydrophobicContact CD1-CD1 4.27Å; F246-L250 HydrophobicContact CE1-CD1 3.86Å; F246-L250 HydrophobicContact CE1-CG 4.3Å; F246-L250 HydrophobicContact CE2-CD2 4.2Å; F246-L250 HydrophobicContact CE2-CG 4.38Å; F246-L250 HydrophobicContact CZ-CD1 4.13Å; F246-L250 HydrophobicContact CZ-CD2 3.95Å; F246-L250 HydrophobicContact CZ-CG 4.16Å; F246-L250 WeakPolarHBondContact O-CG 3.46Å; F246-L250 PolarHBondContact O-N 2.85Å; A247-L250 PolarHBondContact O-N 2.78Å; L250-L252 VanDerWaalsContact C-N 3.34Å; L250-D253 PolarHBondContact O-N 2.88Å; L250-G254 PolarHBondContact O-N 3.26Å
251M96Very high93.3Very high2 Ų256.4 Ų56.41%0.0129%0.288CS..Hα-helixtrans-62.8-40.6174.8-72.9174.8-155.200112.4L213 M217 A247 F248 E249 G254 G255 L256 P259 V277 L281L213-M251 HydrophobicContact CD2-CE 4.24Å; M217-M251 HydrophobicContact CE-CG 4.21Å; M217-M251 HydrophobicContact CG-CE 4.33Å; M217-M251 HydrophobicContact CG-CG 4.02Å; M217-M251 HydrophobicContact SD-CB 4.39Å; M217-M251 HydrophobicContact SD-CE 4.37Å; M217-M251 HydrophobicContact SD-CG 3.43Å; M217-M251 WeakPolarHBondContact SD-CG 3.35Å; A247-M251 HydrophobicContact CB-CE 4.36Å; A247-M251 VanDerWaalsContact O-CG 3.28Å; A247-M251 WeakPolarHBondContact O-CG 3.24Å; A247-M251 PolarHBondContact O-N 3.11Å; F248-M251 HydrophobicContact CD1-CE 4.13Å; F248-M251 HydrophobicContact CD1-SD 4.05Å; F248-M251 HydrophobicContact CE1-CE 4.48Å; F248-M251 PolarHBondContact O-N 2.91Å; E249-M251 VanDerWaalsContact C-N 3.27Å; E249-M251 PolarHBondContact O-N 2.62Å; M251-G254 PolarHBondContact O-N 3.09Å; M251-G255 PolarHBondContact O-N 2.82Å; M251-L256 HydrophobicContact CB-CB 4.33Å; M251-L256 HydrophobicContact CB-CD1 4.24Å; M251-L256 VanDerWaalsContact O-CB 3.29Å; M251-L256 WeakPolarHBondContact O-CB 3.43Å; M251-L256 VanDerWaalsContact O-CD1 3.24Å; M251-L256 WeakPolarHBondContact O-CD1 3.23Å; M251-L256 PolarHBondContact O-N 2.8Å; M251-P259 HydrophobicContact SD-CG 3.83Å; M251-V277 HydrophobicContact CE-CG1 3.71Å; M251-V277 HydrophobicContact SD-CG1 3.96Å; M251-L281 HydrophobicContact CE-CD1 3.88Å; M251-L281 HydrophobicContact CE-CD2 4.25Å; M251-L281 HydrophobicContact CE-CG 4.33Å; M251-L281 HydrophobicContact CG-CD2 3.98Å; M251-L281 HydrophobicContact SD-CD2 4.17Å; M251-L281 HydrophobicContact SD-CG 4.42Å
252L94.4Very high93.1Very high74 Ų7461.4 Ų61.439%0.38730%0.304SS..Hα-helixtrans-64.3-44.1176.3-84.2166.4000111.3F248 E249 L250 G254 G255 K258F248-L252 PolarHBondContact O-N 3.05Å; F248-L252 VanDerWaalsContact O-N 3.12Å; E249-L252 WeakPolarHBondContact O-CA 3.32Å; E249-L252 WeakPolarHBondContact O-CB 3.49Å; E249-L252 PolarHBondContact O-N 3.33Å; L250-L252 VanDerWaalsContact C-N 3.34Å; L252-G254 VanDerWaalsContact C-N 3.31Å; L252-G254 PolarHBondContact O-N 3.35Å; L252-G255 WeakPolarHBondContact O-CA 3.32Å; L252-G255 PolarHBondContact O-N 2.83Å; L252-K258 HydrophobicContact CD1-CB 4.15Å; L252-K258 HydrophobicContact CD1-CD 4.28Å; L252-K258 HydrophobicContact CD1-CG 4.03Å; L252-K258 HydrophobicContact CD2-CB 3.84Å; L252-K258 HydrophobicContact CG-CB 4.27Å
253D93.2Very high92.9Very high136 Ų13658.7 Ų58.773%0.72729%0.294SS*.Hα-helixtrans-64.3-35.8177.6-68.2-16.2000111.8E249 L250 G255E249-D253 PolarHBondContact O-N 3.16Å; L250-D253 PolarHBondContact O-N 2.88Å; D253-G255 PolarHBondContact O-N 3.13Å; D253-G255 VanDerWaalsContact O-N 3.13Å
254G90.6Very high92.8Very high11 Ų1161.3 Ų61.311%0.11331%0.306CS..THydrogen-bonded Turntrans-71.87.4170.100000114.8L250 M251 L252 L256L250-G254 PolarHBondContact O-N 3.26Å; M251-G254 PolarHBondContact O-N 3.09Å; L252-G254 VanDerWaalsContact C-N 3.31Å; L252-G254 PolarHBondContact O-N 3.35Å; G254-L256 PolarHBondContact O-N 2.77Å
255G90.3Very high92.3Very high51 Ų5163.6 Ų63.653%0.52632%0.318SS..THydrogen-bonded Turntrans72.925.4175.900000114.4M251 L252 D253 K284M251-G255 PolarHBondContact O-N 2.82Å; L252-G255 WeakPolarHBondContact O-CA 3.32Å; L252-G255 PolarHBondContact O-N 2.83Å; D253-G255 PolarHBondContact O-N 3.13Å; D253-G255 VanDerWaalsContact O-N 3.13Å; G255-K284 PolarHBondContact O-NZ 3.25Å
256L91.3Very high92.2Very high20 Ų2061.8 Ų61.811%0.10531%0.306CS..PPolyproline II helixtrans-82.3157.3162.4-66.694.7000110.2M251 G254 N280 L281 K284 Y285M251-L256 HydrophobicContact CB-CB 4.33Å; M251-L256 HydrophobicContact CB-CD1 4.24Å; M251-L256 VanDerWaalsContact O-CB 3.29Å; M251-L256 WeakPolarHBondContact O-CB 3.43Å; M251-L256 VanDerWaalsContact O-CD1 3.24Å; M251-L256 WeakPolarHBondContact O-CD1 3.23Å; M251-L256 PolarHBondContact O-N 2.8Å; G254-L256 PolarHBondContact O-N 2.77Å; L256-N280 HydrophobicContact CD2-CB 4.48Å; L256-L281 HydrophobicContact CD1-CD2 4.42Å; L256-L281 HydrophobicContact CD2-CD2 3.94Å; L256-K284 HydrophobicContact CD1-CG 4.3Å; L256-K284 HydrophobicContact CD2-CB 4.04Å; L256-K284 HydrophobicContact CD2-CG 4.33Å; L256-K284 HydrophobicContact CG-CB 4.31Å; L256-K284 HydrophobicContact CG-CG 4.08Å; L256-Y285 HydrophobicContact CD1-CE2 3.95Å; L256-Y285 WeakPolarHBondContact CD1-OH 3.34Å
257K86.2Confident92Very high196 Ų19661 Ų6185%0.85230%0.304SS*.PPolyproline II helixtrans-68.4145166.7-67.3-177.4178.3-179.70109.1P259K257-P259 WeakPolarHBondContact O-CD 3.49Å
258K81.9Confident91.8Very high154 Ų15466 Ų6667%0.6733%0.33SS*.PPolyproline II helixtrans-47.5124.8173.9-170.4167.1179.4172.40109.6L252 K260L252-K258 HydrophobicContact CD1-CB 4.15Å; L252-K258 HydrophobicContact CD1-CD 4.28Å; L252-K258 HydrophobicContact CD1-CG 4.03Å; L252-K258 HydrophobicContact CD2-CB 3.84Å; L252-K258 HydrophobicContact CG-CB 4.27Å; K258-K260 PolarHBondContact O-N 3.15Å
259P88.4Confident91.3Very high11 Ų1169.6 Ų69.67%0.07135%0.35CS..PPolyproline II helixtrans-54136.4173.2-28.837.4000111F248 M251 K257 A261 V277F248-P259 HydrophobicContact CB-CG 4.19Å; F248-P259 HydrophobicContact CD1-CB 4.23Å; F248-P259 HydrophobicContact CD1-CG 3.76Å; F248-P259 HydrophobicContact CD2-CB 3.96Å; F248-P259 HydrophobicContact CD2-CG 4.08Å; F248-P259 HydrophobicContact CE1-CB 4.16Å; F248-P259 HydrophobicContact CE1-CG 4.1Å; F248-P259 HydrophobicContact CE2-CB 3.89Å; F248-P259 HydrophobicContact CE2-CG 4.4Å; F248-P259 HydrophobicContact CG-CB 4.14Å; F248-P259 HydrophobicContact CG-CG 3.74Å; F248-P259 HydrophobicContact CZ-CB 3.99Å; F248-P259 HydrophobicContact CZ-CG 4.41Å; M251-P259 HydrophobicContact SD-CG 3.83Å; K257-P259 WeakPolarHBondContact O-CD 3.49Å; P259-A261 VanDerWaalsContact C-N 3.33Å; P259-V277 HydrophobicContact CB-CG2 4.25Å
260K83.5Confident90.8Very high199 Ų19966.8 Ų66.887%0.86534%0.338SS*.SBendtrans-75.4-23.7177-71.1-174.7174-175.40112.8K258K258-K260 PolarHBondContact O-N 3.15Å
261A87.6Confident90.3Very high18 Ų1867.8 Ų67.815%0.14934%0.344CS..SBendtrans-67.8148.317800000110.2F248 P259 V277F248-A261 WeakPolarHBondContact CE2-O 3.13Å; P259-A261 VanDerWaalsContact C-N 3.33Å; A261-V277 HydrophobicContact CB-CG2 4.15Å
262R92Very high89.5Confident128 Ų12869.4 Ų69.448%0.48335%0.35SS..  trans-83.1149.1168.6-55.4172.151.4176.7-1.1110.1E264 D265R262-E264 WeakPolarHBondContact CB-OE2 3.27Å; R262-E264 IonicContact CZ-OE1 2.63Å; R262-E264 IonicContact CZ-OE2 2.79Å; R262-E264 IonicContact NE-OE1 2.8Å; R262-E264 IonicContact NE-OE2 3.65Å; R262-E264 PolarHBondContact NE-OE2 2.87Å; R262-E264 VanDerWaalsContact NH2-CD 3.29Å; R262-E264 IonicContact NH2-OE1 3.95Å; R262-E264 PolarHBondContact NH2-OE1 3.33Å; R262-E264 IonicContact NH2-OE2 3.75Å; R262-E264 PolarHBondContact O-N 3.41Å; R262-D265 VanDerWaalsContact CB-OD2 3.23Å; R262-D265 WeakPolarHBondContact CB-OD2 3.34Å; R262-D265 WeakPolarHBondContact CG-OD2 3.43Å; R262-D265 PolarHBondContact N-OD2 2.98Å; R262-D265 VanDerWaalsContact N-OD2 3.11Å; R262-D265 WeakPolarHBondContact O-CB 3.16Å; R262-D265 PolarHBondContact O-N 3.09Å; R262-D265 VanDerWaalsContact O-N 3.12Å
263P95.6Very high89.2Confident25 Ų2566.5 Ų66.516%0.16234%0.337CS..Hα-helixtrans-54.8-40.1174.4-2836.9000113V241 V244 S245 F248 D265 V266 V267V241-P263 HydrophobicContact CG1-CB 4.11Å; V244-P263 HydrophobicContact CB-CB 4.09Å; V244-P263 HydrophobicContact CG1-CB 3.9Å; S245-P263 WeakPolarHBondContact OG-CB 3.49Å; S245-P263 VanDerWaalsContact OG-CG 3.23Å; S245-P263 WeakPolarHBondContact OG-CG 3.43Å; F248-P263 HydrophobicContact CD2-CG 4.2Å; F248-P263 HydrophobicContact CE2-CG 4.16Å; P263-D265 VanDerWaalsContact C-N 3.27Å; P263-D265 PolarHBondContact O-N 3.42Å; P263-V266 PolarHBondContact O-N 3.4Å; P263-V267 WeakPolarHBondContact O-CG2 3.45Å; P263-V267 PolarHBondContact O-N 2.89Å; P263-V267 VanDerWaalsContact O-N 3.12Å
264E95Very high89.1Confident55 Ų5560.2 Ų60.226%0.25730%0.303SS..Hα-helixtrans-64.6-31.2179.9-54.196.1134.600112.4F237 V241 R262 V267 N268F237-E264 HydrophobicContact CE1-CG 4.35Å; F237-E264 HydrophobicContact CZ-CB 4.15Å; F237-E264 HydrophobicContact CZ-CG 4.38Å; V241-E264 HydrophobicContact CG1-CG 4.28Å; V241-E264 HydrophobicContact CG2-CG 4.05Å; R262-E264 WeakPolarHBondContact CB-OE2 3.27Å; R262-E264 IonicContact CZ-OE1 2.63Å; R262-E264 IonicContact CZ-OE2 2.79Å; R262-E264 IonicContact NE-OE1 2.8Å; R262-E264 IonicContact NE-OE2 3.65Å; R262-E264 PolarHBondContact NE-OE2 2.87Å; R262-E264 VanDerWaalsContact NH2-CD 3.29Å; R262-E264 IonicContact NH2-OE1 3.95Å; R262-E264 PolarHBondContact NH2-OE1 3.33Å; R262-E264 IonicContact NH2-OE2 3.75Å; R262-E264 PolarHBondContact O-N 3.41Å; E264-V267 PolarHBondContact O-N 3.44Å; E264-N268 VanDerWaalsContact O-CB 3.28Å; E264-N268 WeakPolarHBondContact O-CB 3.38Å; E264-N268 VanDerWaalsContact O-CG 3.31Å; E264-N268 PolarHBondContact O-N 3.26Å; E264-N268 PolarHBondContact O-ND2 3.09Å
265D89.1Confident89Confident48 Ų4860.5 Ų60.526%0.25730%0.302SS..Hα-helixtrans-65.9-42.6178-55.9-29.8000110R262 P263 N268 L269 D270R262-D265 VanDerWaalsContact CB-OD2 3.23Å; R262-D265 WeakPolarHBondContact CB-OD2 3.34Å; R262-D265 WeakPolarHBondContact CG-OD2 3.43Å; R262-D265 PolarHBondContact N-OD2 2.98Å; R262-D265 VanDerWaalsContact N-OD2 3.11Å; R262-D265 WeakPolarHBondContact O-CB 3.16Å; R262-D265 PolarHBondContact O-N 3.09Å; R262-D265 VanDerWaalsContact O-N 3.12Å; P263-D265 VanDerWaalsContact C-N 3.27Å; P263-D265 PolarHBondContact O-N 3.42Å; D265-N268 PolarHBondContact O-N 2.95Å; D265-L269 PolarHBondContact O-N 2.9Å; D265-D270 HydrophobicContact CB-CB 4.16Å; D265-D270 WeakPolarHBondContact O-CB 3.11Å; D265-D270 PolarHBondContact O-N 3.42Å
266V94.3Very high88.8Confident0 Ų061 Ų610%029%0.288CS..Hα-helixtrans-63.6-44.2176.2178.50000111.1A208 L213 V244 F248 P263 N268 L269 T274A208-V266 WeakPolarHBondContact CB-O 3.45Å; L213-V266 HydrophobicContact CD1-CG1 4.41Å; V244-V266 HydrophobicContact CG1-CB 4.01Å; V244-V266 HydrophobicContact CG1-CG1 4.2Å; V244-V266 HydrophobicContact CG1-CG2 4.18Å; V244-V266 HydrophobicContact CG2-CB 4.36Å; V244-V266 HydrophobicContact CG2-CG1 4.02Å; F248-V266 HydrophobicContact CZ-CG2 4.13Å; P263-V266 PolarHBondContact O-N 3.4Å; V266-N268 VanDerWaalsContact C-N 3.31Å; V266-N268 PolarHBondContact O-N 3.4Å; V266-L269 PolarHBondContact O-N 3.34Å; V266-L269 VanDerWaalsContact O-N 3.12Å; V266-T274 HydrophobicContact CG1-CG2 4.39Å
267V95.1Very high88.9Confident15 Ų1560.2 Ų60.29%0.09128%0.284CS..Hα-helixtrans-66.3-34.7178.9-179.70000112A208 F237 K240 V241 V244 P263 E264 L269A208-V267 WeakPolarHBondContact O-CA 3.43Å; F237-V267 HydrophobicContact CD2-CG1 3.52Å; F237-V267 HydrophobicContact CE2-CB 3.98Å; F237-V267 HydrophobicContact CE2-CG1 3.42Å; F237-V267 VanDerWaalsContact CE2-CG1 3.42Å; F237-V267 HydrophobicContact CG-CG1 4.36Å; F237-V267 HydrophobicContact CZ-CB 4.38Å; F237-V267 HydrophobicContact CZ-CG1 4.19Å; K240-V267 HydrophobicContact CB-CB 4.42Å; K240-V267 HydrophobicContact CB-CG1 3.65Å; K240-V267 HydrophobicContact CB-CG2 3.78Å; K240-V267 HydrophobicContact CD-CG1 4Å; K240-V267 HydrophobicContact CG-CG1 4.48Å; V241-V267 HydrophobicContact CB-CG2 4.46Å; V241-V267 HydrophobicContact CG2-CB 4.21Å; V241-V267 HydrophobicContact CG2-CG1 4.42Å; V241-V267 HydrophobicContact CG2-CG2 3.78Å; V244-V267 HydrophobicContact CG2-CG2 3.91Å; P263-V267 WeakPolarHBondContact O-CG2 3.45Å; P263-V267 PolarHBondContact O-N 2.89Å; P263-V267 VanDerWaalsContact O-N 3.12Å; E264-V267 PolarHBondContact O-N 3.44Å; V267-L269 PolarHBondContact O-N 2.8Å
268N92.3Very high89.1Confident105 Ų10552.4 Ų52.456%0.56125%0.251SS*.THydrogen-bonded Turntrans-77.312.5174.8-74.7-50000113.8F237 E264 D265 V266 D270F237-N268 WeakPolarHBondContact CE2-OD1 3.1Å; E264-N268 VanDerWaalsContact O-CB 3.28Å; E264-N268 WeakPolarHBondContact O-CB 3.38Å; E264-N268 VanDerWaalsContact O-CG 3.31Å; E264-N268 PolarHBondContact O-N 3.26Å; E264-N268 PolarHBondContact O-ND2 3.09Å; D265-N268 PolarHBondContact O-N 2.95Å; V266-N268 VanDerWaalsContact C-N 3.31Å; V266-N268 PolarHBondContact O-N 3.4Å; N268-D270 VanDerWaalsContact C-N 3.28Å; N268-D270 PolarHBondContact O-N 3.27Å
269L88.4Confident89.4Confident86 Ų8650.8 Ų50.845%0.4524%0.242SC..THydrogen-bonded Turntrans63.729177.4-57.5164000113.7K205 A208 D265 V266 V267 L271K205-L269 HydrophobicContact CB-CD2 4.03Å; K205-L269 HydrophobicContact CG-CD2 4.12Å; A208-L269 HydrophobicContact CB-CD2 3.39Å; A208-L269 HydrophobicContact CB-CG 4.3Å; D265-L269 PolarHBondContact O-N 2.9Å; V266-L269 PolarHBondContact O-N 3.34Å; V266-L269 VanDerWaalsContact O-N 3.12Å; V267-L269 PolarHBondContact O-N 2.8Å; L269-L271 PolarHBondContact O-N 3.36Å
270D85.8Confident89.4Confident53 Ų5353.8 Ų53.828%0.28326%0.257SS..  trans-65.1103.3166.4-179.1164.3000108.8D265 N268 K272 S273 T274D265-D270 HydrophobicContact CB-CB 4.16Å; D265-D270 WeakPolarHBondContact O-CB 3.11Å; D265-D270 PolarHBondContact O-N 3.42Å; N268-D270 VanDerWaalsContact C-N 3.28Å; N268-D270 PolarHBondContact O-N 3.27Å; D270-K272 VanDerWaalsContact C-N 3.3Å; D270-K272 PolarHBondContact O-N 3.45Å; D270-K272 WeakPolarHBondContact OD2-CA 3.45Å; D270-K272 WeakPolarHBondContact OD2-CB 3.36Å; D270-K272 PolarHBondContact OD2-N 2.89Å; D270-S273 VanDerWaalsContact CG-CB 3.44Å; D270-S273 PolarHBondContact OD1-OG 2.94Å; D270-S273 PolarHBondContact OD2-N 2.68Å; D270-S273 PolarHBondContact OD2-OG 3.28Å; D270-T274 WeakPolarHBondContact O-CB 3.41Å; D270-T274 PolarHBondContact O-N 3.31Å; D270-T274 PolarHBondContact O-OG1 2.94Å
271L84.5Confident89.7Confident37 Ų3744.5 Ų44.519%0.19422%0.217CC..Hα-helixtrans-65.3-34.1-176.9-65.6173.3000111.8F194 L201 V204 K205 L269 L275F194-L271 HydrophobicContact CE1-CB 3.56Å; F194-L271 HydrophobicContact CE1-CD1 3.69Å; F194-L271 HydrophobicContact CE1-CG 4.24Å; F194-L271 HydrophobicContact CZ-CB 3.47Å; F194-L271 VanDerWaalsContact CZ-CB 3.47Å; F194-L271 HydrophobicContact CZ-CD1 4.45Å; L201-L271 HydrophobicContact CD1-CD1 4.36Å; V204-L271 HydrophobicContact CB-CD2 4.1Å; V204-L271 HydrophobicContact CG1-CD2 3.96Å; K205-L271 HydrophobicContact CG-CD2 3.91Å; L269-L271 PolarHBondContact O-N 3.36Å; L271-L275 VanDerWaalsContact O-CB 3.23Å; L271-L275 WeakPolarHBondContact O-CB 3.49Å; L271-L275 WeakPolarHBondContact O-CD1 3.25Å; L271-L275 WeakPolarHBondContact O-CG 3.44Å; L271-L275 PolarHBondContact O-N 2.78Å
272K80.6Confident89.7Confident35 Ų3549.8 Ų49.815%0.15224%0.237CC..Hα-helixtrans-74.7-42.1-177.2-159.7168.7-161163.40110.4E186 D188 D191 F194 D270 L275 R276E186-K272 PolarHBondContact O-NZ 3.02Å; D188-K272 VanDerWaalsContact CG-CE 3.46Å; D188-K272 WeakPolarHBondContact OD1-CE 3.32Å; D188-K272 IonicContact OD1-NZ 3.3Å; D188-K272 WeakPolarHBondContact OD2-CE 3.38Å; D188-K272 IonicContact OD2-NZ 3.53Å; D191-K272 IonicContact OD1-NZ 2.77Å; D191-K272 PolarHBondContact OD1-NZ 2.99Å; D191-K272 WeakPolarHBondContact OD2-CE 3.35Å; D191-K272 IonicContact OD2-NZ 3.31Å; D191-K272 PolarHBondContact OD2-NZ 3.05Å; F194-K272 HydrophobicContact CE2-CB 4.45Å; D270-K272 VanDerWaalsContact C-N 3.3Å; D270-K272 PolarHBondContact O-N 3.45Å; D270-K272 WeakPolarHBondContact OD2-CA 3.45Å; D270-K272 WeakPolarHBondContact OD2-CB 3.36Å; D270-K272 PolarHBondContact OD2-N 2.89Å; K272-L275 PolarHBondContact O-N 3.03Å; K272-R276 WeakPolarHBondContact O-CB 3.29Å; K272-R276 VanDerWaalsContact O-CG 3.26Å; K272-R276 WeakPolarHBondContact O-CG 3.24Å; K272-R276 PolarHBondContact O-N 2.99Å
273S87.4Confident89.4Confident14 Ų1446.2 Ų46.210%0.09823%0.23CC..Hα-helixtrans-60.2-46.5172.2-70.10000111.1D270 R276 V277D270-S273 VanDerWaalsContact CG-CB 3.44Å; D270-S273 PolarHBondContact OD1-OG 2.94Å; D270-S273 PolarHBondContact OD2-N 2.68Å; D270-S273 PolarHBondContact OD2-OG 3.28Å; S273-R276 PolarHBondContact O-N 3.26Å; S273-V277 WeakPolarHBondContact O-CG2 3.32Å; S273-V277 PolarHBondContact O-N 2.92Å
274T91Very high89.1Confident3 Ų350 Ų502%0.01824%0.243CC..Hα-helixtrans-64.9-45.5177.8-51.50000112V204 F207 V266 D270 R276 V277 L278V204-T274 HydrophobicContact CG1-CG2 3.49Å; V204-T274 VanDerWaalsContact CG1-CG2 3.49Å; F207-T274 HydrophobicContact CB-CG2 3.99Å; V266-T274 HydrophobicContact CG1-CG2 4.39Å; D270-T274 WeakPolarHBondContact O-CB 3.41Å; D270-T274 PolarHBondContact O-N 3.31Å; D270-T274 PolarHBondContact O-OG1 2.94Å; T274-R276 VanDerWaalsContact C-N 3.32Å; T274-R276 PolarHBondContact O-N 3.49Å; T274-V277 WeakPolarHBondContact O-CB 3.47Å; T274-V277 PolarHBondContact O-N 2.65Å; T274-L278 HydrophobicContact CG2-CD1 4.27Å; T274-L278 WeakPolarHBondContact O-CG 3.44Å; T274-L278 PolarHBondContact O-N 3Å
275L87.9Confident88.8Confident17 Ų1748.5 Ų48.59%0.08924%0.235CC..Hα-helixtrans-62.5-36.7177.7-79.8168.2000112.6F190 L193 F194 L201 V204 L271 K272 V277 L278 Y279F190-L275 HydrophobicContact CB-CD1 4.39Å; F190-L275 HydrophobicContact CD1-CB 3.86Å; F190-L275 HydrophobicContact CD1-CD1 3.86Å; F190-L275 HydrophobicContact CD1-CD2 4.42Å; F190-L275 HydrophobicContact CD1-CG 4.27Å; F190-L275 HydrophobicContact CE1-CB 3.9Å; F190-L275 HydrophobicContact CE1-CD2 4.44Å; F190-L275 HydrophobicContact CG-CB 4.43Å; F190-L275 HydrophobicContact CG-CD1 4.42Å; L193-L275 HydrophobicContact CD2-CD1 4.43Å; F194-L275 HydrophobicContact CE1-CD1 4.11Å; F194-L275 HydrophobicContact CE2-CD1 4.11Å; F194-L275 HydrophobicContact CZ-CD1 3.53Å; L201-L275 HydrophobicContact CD2-CD1 4.3Å; V204-L275 HydrophobicContact CG1-CD2 4.48Å; V204-L275 HydrophobicContact CG1-CG 4.22Å; V204-L275 HydrophobicContact CG2-CD2 3.74Å; V204-L275 HydrophobicContact CG2-CG 4.21Å; L271-L275 VanDerWaalsContact O-CB 3.23Å; L271-L275 WeakPolarHBondContact O-CB 3.49Å; L271-L275 WeakPolarHBondContact O-CD1 3.25Å; L271-L275 WeakPolarHBondContact O-CG 3.44Å; L271-L275 PolarHBondContact O-N 2.78Å; K272-L275 PolarHBondContact O-N 3.03Å; L275-V277 VanDerWaalsContact C-N 3.35Å; L275-L278 PolarHBondContact O-N 2.75Å; L275-Y279 WeakPolarHBondContact O-CB 3.32Å; L275-Y279 PolarHBondContact O-N 3.33Å
276R87.4Confident88.6Confident61 Ų6151.4 Ų51.423%0.2325%0.246CC..Hα-helixtrans-64-39.7175.2-77170.3175.3172.6-4.7111.9R142 E186 D188 F190 K272 S273 T274 N280R142-R276 VanDerWaalsContact NH2-NH1 3.19Å; E186-R276 IonicContact OE1-NH2 2.64Å; E186-R276 IonicContact OE2-CZ 2.8Å; E186-R276 IonicContact OE2-NH1 2.71Å; E186-R276 IonicContact OE2-NH2 2.74Å; E186-R276 PolarHBondContact OE2-NH2 3Å; D188-R276 IonicContact OD2-CZ 3.78Å; D188-R276 IonicContact OD2-NE 2.66Å; D188-R276 IonicContact OD2-NH2 3.93Å; D188-R276 PolarHBondContact OD2-NH2 2.74Å; F190-R276 HydrophobicContact CE2-CG 4.35Å; K272-R276 WeakPolarHBondContact O-CB 3.29Å; K272-R276 VanDerWaalsContact O-CG 3.26Å; K272-R276 WeakPolarHBondContact O-CG 3.24Å; K272-R276 PolarHBondContact O-N 2.99Å; S273-R276 PolarHBondContact O-N 3.26Å; T274-R276 VanDerWaalsContact C-N 3.32Å; T274-R276 PolarHBondContact O-N 3.49Å; R276-N280 PolarHBondContact O-N 2.87Å; R276-N280 VanDerWaalsContact O-N 3.12Å; R276-N280 PolarHBondContact O-ND2 3.04Å
277V92.4Very high88Confident4 Ų457.9 Ų57.92%0.02428%0.28CS..Hα-helixtrans-61.1-52.9172.9174.90000110.2L213 F248 M251 P259 A261 S273 T274 L275 Y279 N280 L281L213-V277 HydrophobicContact CD2-CG1 4.22Å; F248-V277 HydrophobicContact CE1-CG1 3.93Å; F248-V277 HydrophobicContact CE1-CG2 3.81Å; F248-V277 HydrophobicContact CZ-CG2 3.76Å; M251-V277 HydrophobicContact CE-CG1 3.71Å; M251-V277 HydrophobicContact SD-CG1 3.96Å; P259-V277 HydrophobicContact CB-CG2 4.25Å; A261-V277 HydrophobicContact CB-CG2 4.15Å; S273-V277 WeakPolarHBondContact O-CG2 3.32Å; S273-V277 PolarHBondContact O-N 2.92Å; T274-V277 WeakPolarHBondContact O-CB 3.47Å; T274-V277 PolarHBondContact O-N 2.65Å; L275-V277 VanDerWaalsContact C-N 3.35Å; V277-Y279 VanDerWaalsContact C-N 3.31Å; V277-Y279 PolarHBondContact O-N 3.34Å; V277-N280 PolarHBondContact O-N 3.23Å; V277-L281 PolarHBondContact O-N 3.42Å; V277-L281 VanDerWaalsContact O-N 3.15Å
278L91.4Very high86.8Confident32 Ų3261.9 Ų61.917%0.16831%0.305CS..Hα-helixtrans-62.1-37.4-178.8-64.8176.8000112.7V204 F207 L213 T274 L275 L281 F282V204-L278 HydrophobicContact CG1-CD1 4.38Å; F207-L278 HydrophobicContact CD1-CD2 3.92Å; F207-L278 HydrophobicContact CD2-CD1 3.93Å; F207-L278 HydrophobicContact CD2-CD2 4.3Å; F207-L278 HydrophobicContact CE1-CD2 3.74Å; F207-L278 HydrophobicContact CE2-CD1 3.94Å; F207-L278 HydrophobicContact CE2-CD2 4.15Å; F207-L278 HydrophobicContact CG-CD1 4.43Å; F207-L278 HydrophobicContact CG-CD2 4.18Å; F207-L278 HydrophobicContact CZ-CD1 4.44Å; F207-L278 HydrophobicContact CZ-CD2 3.85Å; L213-L278 HydrophobicContact CD2-CD2 3.89Å; T274-L278 HydrophobicContact CG2-CD1 4.27Å; T274-L278 WeakPolarHBondContact O-CG 3.44Å; T274-L278 PolarHBondContact O-N 3Å; L275-L278 PolarHBondContact O-N 2.75Å; L278-L281 HydrophobicContact CD2-CD1 4.46Å; L278-L281 WeakPolarHBondContact O-CB 3.48Å; L278-L281 PolarHBondContact O-N 2.76Å; L278-F282 WeakPolarHBondContact O-CB 3.35Å; L278-F282 PolarHBondContact O-N 2.88Å
279Y87.3Confident84.8Confident120 Ų12069.3 Ų69.347%0.47134%0.336SS..Hα-helixtrans-67.8-36.2177.3179.2-100.7000112.6F190 L275 V277 F282 T283F190-Y279 HydrophobicContact CZ-CD1 4.45Å; F190-Y279 HydrophobicContact CZ-CD2 4.12Å; F190-Y279 AromaticContact CZ-CG 3.84Å; F190-Y279 HydrophobicContact CZ-CG 3.84Å; L275-Y279 WeakPolarHBondContact O-CB 3.32Å; L275-Y279 PolarHBondContact O-N 3.33Å; V277-Y279 VanDerWaalsContact C-N 3.31Å; V277-Y279 PolarHBondContact O-N 3.34Å; Y279-F282 PolarHBondContact O-N 3.38Å; Y279-T283 WeakPolarHBondContact CE1-OG1 3.21Å; Y279-T283 VanDerWaalsContact O-CB 3.3Å; Y279-T283 WeakPolarHBondContact O-CB 3.05Å; Y279-T283 PolarHBondContact O-N 3.42Å; Y279-T283 PolarHBondContact O-OG1 3.17Å
280N87.9Confident84.6Confident75 Ų7568.5 Ų68.540%0.40133%0.33SS..Hα-helixtrans-64.9-43.9174.6-71.9-24.4000111.2L256 R276 V277 T283 K284L256-N280 HydrophobicContact CD2-CB 4.48Å; R276-N280 PolarHBondContact O-N 2.87Å; R276-N280 VanDerWaalsContact O-N 3.12Å; R276-N280 PolarHBondContact O-ND2 3.04Å; V277-N280 PolarHBondContact O-N 3.23Å; N280-T283 PolarHBondContact O-N 3.3Å; N280-K284 WeakPolarHBondContact O-CB 3.37Å; N280-K284 PolarHBondContact O-N 2.91Å
281L90Very high84.6Confident4 Ų469.3 Ų69.32%0.02133%0.333CS..Hα-helixtrans-57.4-55.1171.9-69.5171.5000110.5L213 L216 M217 L220 M251 L256 V277 L278 T283 K284 Y285L213-L281 HydrophobicContact CD2-CD1 4.46Å; L216-L281 HydrophobicContact CD2-CD1 3.82Å; M217-L281 HydrophobicContact SD-CD2 3.43Å; M217-L281 WeakPolarHBondContact SD-CD2 3.5Å; L220-L281 HydrophobicContact CD1-CD2 4.23Å; M251-L281 HydrophobicContact CE-CD1 3.88Å; M251-L281 HydrophobicContact CE-CD2 4.25Å; M251-L281 HydrophobicContact CE-CG 4.33Å; M251-L281 HydrophobicContact CG-CD2 3.98Å; M251-L281 HydrophobicContact SD-CD2 4.17Å; M251-L281 HydrophobicContact SD-CG 4.42Å; L256-L281 HydrophobicContact CD1-CD2 4.42Å; L256-L281 HydrophobicContact CD2-CD2 3.94Å; V277-L281 PolarHBondContact O-N 3.42Å; V277-L281 VanDerWaalsContact O-N 3.15Å; L278-L281 HydrophobicContact CD2-CD1 4.46Å; L278-L281 WeakPolarHBondContact O-CB 3.48Å; L278-L281 PolarHBondContact O-N 2.76Å; L281-T283 VanDerWaalsContact C-N 3.29Å; L281-T283 PolarHBondContact O-N 3.42Å; L281-K284 PolarHBondContact O-N 2.94Å; L281-K284 VanDerWaalsContact O-N 3.09Å; L281-Y285 HydrophobicContact CD2-CE2 4.07Å; L281-Y285 WeakPolarHBondContact O-CD2 3.42Å; L281-Y285 PolarHBondContact O-N 2.89Å
282F88.6Confident84.6Confident128 Ų12871.1 Ų71.156%0.56134%0.341SS*.Hα-helixtrans-54.1-46.8178.6175.1-101.2000111.8L278 Y279 K284 Y285 K286L278-F282 WeakPolarHBondContact O-CB 3.35Å; L278-F282 PolarHBondContact O-N 2.88Å; Y279-F282 PolarHBondContact O-N 3.38Å; F282-K284 VanDerWaalsContact C-N 3.28Å; F282-K284 PolarHBondContact O-N 3.49Å; F282-Y285 PolarHBondContact O-N 2.93Å; F282-K286 HydrophobicContact CD1-CB 4.47Å; F282-K286 HydrophobicContact CD1-CD 4.45Å; F282-K286 HydrophobicContact CD2-CB 4.2Å; F282-K286 HydrophobicContact CE1-CB 4.15Å; F282-K286 HydrophobicContact CE1-CD 3.95Å; F282-K286 HydrophobicContact CE2-CB 3.85Å; F282-K286 HydrophobicContact CZ-CB 3.82Å; F282-K286 HydrophobicContact CZ-CD 4.28Å; F282-K286 WeakPolarHBondContact O-CA 3.47Å; F282-K286 WeakPolarHBondContact O-CB 3.45Å; F282-K286 VanDerWaalsContact O-CG 3.29Å; F282-K286 WeakPolarHBondContact O-CG 3.42Å; F282-K286 PolarHBondContact O-N 3.23Å
283T86.3Confident84.8Confident54 Ų5473.2 Ų73.233%0.33135%0.352SS..Hα-helixtrans-62.9-35.5-178.3-60.40000112.6Y279 N280 L281Y279-T283 WeakPolarHBondContact CE1-OG1 3.21Å; Y279-T283 VanDerWaalsContact O-CB 3.3Å; Y279-T283 WeakPolarHBondContact O-CB 3.05Å; Y279-T283 PolarHBondContact O-N 3.42Å; Y279-T283 PolarHBondContact O-OG1 3.17Å; N280-T283 PolarHBondContact O-N 3.3Å; L281-T283 VanDerWaalsContact C-N 3.29Å; L281-T283 PolarHBondContact O-N 3.42Å
284K87.7Confident84.6Confident103 Ų10376.9 Ų76.945%0.44837%0.368SS..Hα-helixtrans-70.5-46.3177175.370.4175.9-163.90111.8G255 L256 N280 L281 F282G255-K284 PolarHBondContact O-NZ 3.25Å; L256-K284 HydrophobicContact CD1-CG 4.3Å; L256-K284 HydrophobicContact CD2-CB 4.04Å; L256-K284 HydrophobicContact CD2-CG 4.33Å; L256-K284 HydrophobicContact CG-CB 4.31Å; L256-K284 HydrophobicContact CG-CG 4.08Å; N280-K284 WeakPolarHBondContact O-CB 3.37Å; N280-K284 PolarHBondContact O-N 2.91Å; L281-K284 PolarHBondContact O-N 2.94Å; L281-K284 VanDerWaalsContact O-N 3.09Å; F282-K284 VanDerWaalsContact C-N 3.28Å; F282-K284 PolarHBondContact O-N 3.49Å
285Y88.6Confident84.2Confident24 Ų2481.9 Ų81.99%0.09439%0.391CS..Hα-helixtrans-102.1-6.5-169.4-60.1-83.2000115.2L220 E221 L256 L281 F282 N287 V288L220-Y285 HydrophobicContact CB-CD1 4.21Å; L220-Y285 HydrophobicContact CB-CD2 4.36Å; L220-Y285 HydrophobicContact CB-CE1 4.07Å; L220-Y285 HydrophobicContact CB-CE2 4.25Å; L220-Y285 HydrophobicContact CB-CG 4.37Å; L220-Y285 HydrophobicContact CD1-CD2 3.69Å; L220-Y285 HydrophobicContact CD1-CE2 3.87Å; L220-Y285 HydrophobicContact CD1-CG 4.25Å; L220-Y285 HydrophobicContact CD2-CD1 4.29Å; L220-Y285 HydrophobicContact CD2-CD2 4.17Å; L220-Y285 HydrophobicContact CD2-CG 3.88Å; L220-Y285 HydrophobicContact CG-CD2 4.3Å; L220-Y285 HydrophobicContact CG-CG 4.4Å; E221-Y285 VanDerWaalsContact OE1-CE1 3.25Å; E221-Y285 WeakPolarHBondContact OE1-CE1 3.39Å; E221-Y285 VanDerWaalsContact OE1-CZ 3.22Å; E221-Y285 PolarHBondContact OE1-OH 3.34Å; L256-Y285 HydrophobicContact CD1-CE2 3.95Å; L256-Y285 WeakPolarHBondContact CD1-OH 3.34Å; L281-Y285 HydrophobicContact CD2-CE2 4.07Å; L281-Y285 WeakPolarHBondContact O-CD2 3.42Å; L281-Y285 PolarHBondContact O-N 2.89Å; F282-Y285 PolarHBondContact O-N 2.93Å; Y285-N287 PolarHBondContact O-N 3.34Å; Y285-V288 HydrophobicContact CD1-CG2 4.17Å; Y285-V288 WeakPolarHBondContact O-CB 3.27Å; Y285-V288 PolarHBondContact O-N 3.3Å
286K86.6Confident83.9Confident110 Ų11086.5 Ų86.548%0.47841%0.412SS..THydrogen-bonded Turntrans-57.3-19.3-177.159.3174.8-175.1179.60115.8F282F282-K286 HydrophobicContact CD1-CB 4.47Å; F282-K286 HydrophobicContact CD1-CD 4.45Å; F282-K286 HydrophobicContact CD2-CB 4.2Å; F282-K286 HydrophobicContact CE1-CB 4.15Å; F282-K286 HydrophobicContact CE1-CD 3.95Å; F282-K286 HydrophobicContact CE2-CB 3.85Å; F282-K286 HydrophobicContact CZ-CB 3.82Å; F282-K286 HydrophobicContact CZ-CD 4.28Å; F282-K286 WeakPolarHBondContact O-CA 3.47Å; F282-K286 WeakPolarHBondContact O-CB 3.45Å; F282-K286 VanDerWaalsContact O-CG 3.29Å; F282-K286 WeakPolarHBondContact O-CG 3.42Å; F282-K286 PolarHBondContact O-N 3.23Å
287N81.1Confident83.7Confident135 Ų13588.5 Ų88.572%0.72243%0.426SS*.THydrogen-bonded Turntrans-113.69.3-178.2-61.2-23.2000112Y285Y285-N287 PolarHBondContact O-N 3.34Å
288V69.8Low82.9Confident99 Ų9995.5 Ų95.560%0.646%0.46SS*.  trans-86.9112.9174.5-177.80000105.8Y285Y285-V288 HydrophobicContact CD1-CG2 4.17Å; Y285-V288 WeakPolarHBondContact O-CB 3.27Å; Y285-V288 PolarHBondContact O-N 3.3Å
289E50.1Low82.2Confident262 Ų262101.3 Ų101.3100%1.22449%0.487SS*.  trans-75.30175.9-75.8-174.5158.800111.9

Retrieved 289 of 289 residues in 753 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).