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Hepatic sodium/bile acid cotransporter

As a major transporter of conjugated bile salts from plasma into the hepatocyte, it plays a key role in the enterohepatic circulation of bile salts necessary for the solubilization and absorption of dietary fat and fat-soluble vitamins. It is strictly dependent on the extracellular presence of sodium. It exhibits broad substrate specificity and transports various bile acids, such as taurocholate, cholate, as well as non-bile acid organic compounds, such as estrone sulfate. Works collaboratively with the ileal transporter (NTCP2), the organic solute transporter (OST), and the bile salt export pump (BSEP), to ensure efficacious biological recycling of bile acids during enterohepatic circulation.

AlphaFold DB , UniProt , Accession A0A096NVU6, Species PAPAN (Papio anubis, Olive baboon), Gene SLC10A1, Length 349 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M33.5Very low34.7Very low249 Ų249141 Ų141100%1.22781%0.806SS**  091.60-91.6176170.600107.2
2E33.5Very low36.3Very low188 Ų188135.5 Ų135.588%0.87977%0.766SS**  trans-76.1120.6173.5-68.8166.3135.900108
3A31.2Very low37.7Very low99 Ų99133.8 Ų133.882%0.81876%0.761SS**  trans-99.4101166.400000107.6N5A3-N5 PolarHBondContact O-N 2.84Å; A3-N5 VanDerWaalsContact O-N 3.08Å
4H33.3Very low39.2Very low180 Ų180127.7 Ų127.783%0.83372%0.724SS**  trans-53.7107.5162.3-91.4-84.3000109.4
5N30Very low40.5Very low154 Ų154120.9 Ų120.982%0.82469%0.687SS**  trans-107.384.8161.4-136.95.3000107.5A3 S7A3-N5 PolarHBondContact O-N 2.84Å; A3-N5 VanDerWaalsContact O-N 3.08Å; N5-S7 PolarHBondContact O-N 2.9Å
6A35.7Very low41.4Very low96 Ų96119.7 Ų119.779%0.79369%0.685SS**  trans-77.273.417500000109.7
7S33.4Very low42.4Very low97 Ų97119.5 Ų119.568%0.67868%0.682SS**  trans-87.197.4152.354.10000106.3N5 P9N5-S7 PolarHBondContact O-N 2.9Å; S7-P9 WeakPolarHBondContact O-CD 3.33Å; S7-P9 VanDerWaalsContact O-N 3.09Å
8A32.5Very low43.3Very low85 Ų85114 Ų11470%0.70265%0.649SS**  trans-51.8119.617100000108F10A8-F10 PolarHBondContact O-N 2.82Å
9P41.3Very low44.2Very low98 Ų98109.6 Ų109.664%0.63663%0.631SS**  trans-66.7115.8169.127.4-27.5000104.4S7 N11S7-P9 WeakPolarHBondContact O-CD 3.33Å; S7-P9 VanDerWaalsContact O-N 3.09Å; P9-N11 PolarHBondContact O-N 3.35Å
10F38.6Very low45.3Very low167 Ų167112.6 Ų112.673%0.73264%0.636SS**  trans-58.694.8159.2-105.4-86000105.1A8 F12A8-F10 PolarHBondContact O-N 2.82Å; F10-F12 PolarHBondContact O-N 3.47Å
11N38.7Very low46.7Very low138 Ų138110.3 Ų110.374%0.73862%0.618SS**  trans-63.195.5175-90.1-18.3000106.3P9 T13P9-N11 PolarHBondContact O-N 3.35Å; N11-T13 PolarHBondContact O-N 2.98Å; N11-T13 VanDerWaalsContact O-N 3.15Å
12F54.1Low49Very low75 Ų75103.6 Ų103.633%0.32959%0.593SS.*  trans-72.6101.8179.5169.4-108.5000108.1F10 L14 F216 P281F10-F12 PolarHBondContact O-N 3.47Å; F12-L14 HydrophobicContact CD1-CG 4.39Å; F12-L14 HydrophobicContact CE1-CD1 4.01Å; F12-L14 HydrophobicContact CE1-CD2 3.75Å; F12-L14 HydrophobicContact CE1-CG 3.43Å; F12-L14 VanDerWaalsContact CE1-CG 3.43Å; F12-L14 HydrophobicContact CE2-CD2 4.21Å; F12-L14 HydrophobicContact CE2-CG 4.48Å; F12-L14 HydrophobicContact CZ-CD1 4.39Å; F12-L14 HydrophobicContact CZ-CD2 3.26Å; F12-L14 HydrophobicContact CZ-CG 3.48Å; F12-L14 VanDerWaalsContact CZ-CG 3.48Å; F12-F216 HydrophobicContact CB-CE2 4.48Å; F12-F216 HydrophobicContact CD2-CD2 4.41Å; F12-F216 HydrophobicContact CD2-CG 4.48Å; F12-P281 VanDerWaalsContact CE2-CD 3.41Å; F12-P281 HydrophobicContact CE2-CG 3.79Å; F12-P281 HydrophobicContact CZ-CG 4.19Å
13T53.8Low51.1Low114 Ų11496.8 Ų96.870%0.69956%0.564SS**  trans-97.5109.5170.5-40.40000108N11N11-T13 PolarHBondContact O-N 2.98Å; N11-T13 VanDerWaalsContact O-N 3.15Å
14L58.9Low53.3Low48 Ų4892.6 Ų92.625%0.25153%0.528SS..PPolyproline II helixtrans-55.7142.5168.6-81.7165000109.6F12 F18F12-L14 HydrophobicContact CD1-CG 4.39Å; F12-L14 HydrophobicContact CE1-CD1 4.01Å; F12-L14 HydrophobicContact CE1-CD2 3.75Å; F12-L14 HydrophobicContact CE1-CG 3.43Å; F12-L14 VanDerWaalsContact CE1-CG 3.43Å; F12-L14 HydrophobicContact CE2-CD2 4.21Å; F12-L14 HydrophobicContact CE2-CG 4.48Å; F12-L14 HydrophobicContact CZ-CD1 4.39Å; F12-L14 HydrophobicContact CZ-CD2 3.26Å; F12-L14 HydrophobicContact CZ-CG 3.48Å; F12-L14 VanDerWaalsContact CZ-CG 3.48Å; L14-F18 HydrophobicContact CB-CB 4.34Å; L14-F18 HydrophobicContact CD2-CB 4.1Å; L14-F18 HydrophobicContact CD2-CD1 3.46Å; L14-F18 VanDerWaalsContact CD2-CD1 3.46Å; L14-F18 HydrophobicContact CD2-CE1 3.96Å; L14-F18 HydrophobicContact CD2-CG 3.81Å
15P59.2Low55.6Low25 Ų2589.3 Ų89.316%0.16252%0.516CS..PPolyproline II helixtrans-53.1140.4168.7-19.428.9000110N17 F18 N209P15-N17 PolarHBondContact O-N 3.34Å; P15-F18 HydrophobicContact CG-CD2 4.15Å; P15-F18 WeakPolarHBondContact O-CB 3.49Å; P15-F18 PolarHBondContact O-N 2.58Å; P15-N209 WeakPolarHBondContact CG-O 3.45Å
16P55.1Low58.2Low102 Ų10283.7 Ų83.766%0.66249%0.491SS*.THydrogen-bonded Turntrans-57.5132.9-179.920.7-31.4000110.8F18 R21P16-F18 VanDerWaalsContact C-N 3.34Å; P16-F18 PolarHBondContact O-N 3.12Å; P16-R21 VanDerWaalsContact O-CZ 3.23Å; P16-R21 PolarHBondContact O-NE 3.3Å; P16-R21 PolarHBondContact O-NH2 2.94Å
17N57.5Low60.4Low117 Ų11779.3 Ų79.363%0.62645%0.454SS*.THydrogen-bonded Turntrans66.218.9-174.2-59.8-38.3000116.5P15 G19 K20 R21P15-N17 PolarHBondContact O-N 3.34Å; N17-G19 PolarHBondContact O-N 3.37Å; N17-K20 HydrophobicContact CB-CB 4.41Å; N17-K20 WeakPolarHBondContact O-CA 3.32Å; N17-K20 PolarHBondContact O-N 3.33Å; N17-R21 HydrophobicContact CB-CG 4.3Å; N17-R21 WeakPolarHBondContact O-CG 2.99Å; N17-R21 PolarHBondContact O-N 2.67Å
18F59.6Low62.7Low20 Ų2076.1 Ų76.19%0.08843%0.432CS..THydrogen-bonded Turntrans-52.8129.6172.3-168.3-102.8000111.2L14 P15 P16 K20 V210 P276 F283L14-F18 HydrophobicContact CB-CB 4.34Å; L14-F18 HydrophobicContact CD2-CB 4.1Å; L14-F18 HydrophobicContact CD2-CD1 3.46Å; L14-F18 VanDerWaalsContact CD2-CD1 3.46Å; L14-F18 HydrophobicContact CD2-CE1 3.96Å; L14-F18 HydrophobicContact CD2-CG 3.81Å; P15-F18 HydrophobicContact CG-CD2 4.15Å; P15-F18 WeakPolarHBondContact O-CB 3.49Å; P15-F18 PolarHBondContact O-N 2.58Å; P16-F18 VanDerWaalsContact C-N 3.34Å; P16-F18 PolarHBondContact O-N 3.12Å; F18-K20 VanDerWaalsContact C-N 3.33Å; F18-V210 HydrophobicContact CE2-CG2 3.78Å; F18-V210 HydrophobicContact CZ-CG2 4.07Å; F18-P276 HydrophobicContact CD1-CB 4.03Å; F18-P276 HydrophobicContact CE1-CB 4.09Å; F18-F283 HydrophobicContact CZ-CE1 4.44Å
19G60.3Low65.4Low30 Ų3077 Ų7731%0.30942%0.423SS..THydrogen-bonded Turntrans90.5-19-172.400000114.8N17 D24N17-G19 PolarHBondContact O-N 3.37Å; G19-D24 PolarHBondContact N-OD2 3.42Å
20K66.4Low67.5Low169 Ų16974.1 Ų74.174%0.73540%0.403SS*.THydrogen-bonded Turntrans-109-3.3177.7-62.1-177.7-176.6176.70113.2N17 F18N17-K20 HydrophobicContact CB-CB 4.41Å; N17-K20 WeakPolarHBondContact O-CA 3.32Å; N17-K20 PolarHBondContact O-N 3.33Å; F18-K20 VanDerWaalsContact C-N 3.33Å
21R74.9Confident69.7Low65 Ų6566.4 Ų66.425%0.24537%0.369CS..SBendtrans-75.7147.6177.7-63.2164.9178.6-165.9-6110.2P16 N17 T23 D24 L25P16-R21 VanDerWaalsContact O-CZ 3.23Å; P16-R21 PolarHBondContact O-NE 3.3Å; P16-R21 PolarHBondContact O-NH2 2.94Å; N17-R21 HydrophobicContact CB-CG 4.3Å; N17-R21 WeakPolarHBondContact O-CG 2.99Å; N17-R21 PolarHBondContact O-N 2.67Å; R21-T23 WeakPolarHBondContact CB-OG1 3.44Å; R21-T23 PolarHBondContact O-N 3.39Å; R21-T23 VanDerWaalsContact O-N 3.15Å; R21-D24 WeakPolarHBondContact CB-OD2 3.26Å; R21-D24 PolarHBondContact O-N 3.36Å; R21-L25 PolarHBondContact O-N 2.91Å
22P80.2Confident72.1Confident108 Ų10862.9 Ų62.970%0.70135%0.352SS*.Hα-helixtrans-58.8-28.1173.323.8-33.2000112.2A26P22-A26 VanDerWaalsContact O-CB 3.3Å; P22-A26 WeakPolarHBondContact O-CB 2.98Å; P22-A26 PolarHBondContact O-N 2.86Å
23T78.6Confident73.8Confident45 Ų4564.4 Ų64.428%0.27636%0.359SS..Hα-helixtrans-71.4-31.717650.80000113.3R21 L27 N209R21-T23 WeakPolarHBondContact CB-OG1 3.44Å; R21-T23 PolarHBondContact O-N 3.39Å; R21-T23 VanDerWaalsContact O-N 3.15Å; T23-L27 WeakPolarHBondContact O-CB 3.36Å; T23-L27 PolarHBondContact O-N 2.94Å; T23-N209 WeakPolarHBondContact CB-OD1 3.06Å; T23-N209 PolarHBondContact O-ND2 3.18Å; T23-N209 PolarHBondContact OG1-OD1 2.99Å
24D76.6Confident75.4Confident12 Ų1259.8 Ų59.86%0.06433%0.329CS..Hα-helixtrans-74-39.5175.6-61.9-41.3000110.6G19 R21 L27 S28 N209G19-D24 PolarHBondContact N-OD2 3.42Å; R21-D24 WeakPolarHBondContact CB-OD2 3.26Å; R21-D24 PolarHBondContact O-N 3.36Å; D24-L27 PolarHBondContact O-N 3.49Å; D24-S28 PolarHBondContact O-N 3.13Å; D24-S28 PolarHBondContact O-OG 2.89Å; D24-N209 VanDerWaalsContact OD1-CG 3.3Å; D24-N209 PolarHBondContact OD1-ND2 2.95Å
25L81.7Confident76.8Confident110 Ų11057.9 Ų57.958%0.57632%0.319SS*.Hα-helixtrans-62.3-46.3171.7-17964.3000111.2R21 L27 S28 I29R21-L25 PolarHBondContact O-N 2.91Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L25-L27 PolarHBondContact O-N 2.87Å; L25-S28 PolarHBondContact O-N 3.44Å; L25-I29 HydrophobicContact CD1-CD1 4.23Å; L25-I29 HydrophobicContact CD1-CG1 4.49Å; L25-I29 HydrophobicContact CG-CD1 3.98Å; L25-I29 WeakPolarHBondContact O-CG1 3.32Å; L25-I29 PolarHBondContact O-N 3.09Å
26A84.7Confident78.3Confident36 Ų3660.2 Ų60.230%0.29833%0.327SS..Hα-helixtrans-60-43.3176.400000111.8P22 S28 I29 I30 L205P22-A26 VanDerWaalsContact O-CB 3.3Å; P22-A26 WeakPolarHBondContact O-CB 2.98Å; P22-A26 PolarHBondContact O-N 2.86Å; A26-S28 VanDerWaalsContact C-N 3.33Å; A26-S28 PolarHBondContact O-N 2.89Å; A26-I29 PolarHBondContact O-N 3.4Å; A26-I30 WeakPolarHBondContact O-CB 3.11Å; A26-I30 WeakPolarHBondContact O-CD1 3.29Å; A26-I30 WeakPolarHBondContact O-CG1 3.35Å; A26-I30 PolarHBondContact O-N 2.96Å; A26-L205 HydrophobicContact CB-CD2 3.78Å
27L81.9Confident79.9Confident4 Ų457 Ų572%0.02130%0.303CS..Hα-helixtrans-58.5-46.8175.4-174.2154.3000110.9T23 D24 L25 I29 I30 L31 L205 F283T23-L27 WeakPolarHBondContact O-CB 3.36Å; T23-L27 PolarHBondContact O-N 2.94Å; D24-L27 PolarHBondContact O-N 3.49Å; L25-L27 VanDerWaalsContact C-N 3.34Å; L25-L27 PolarHBondContact O-N 2.87Å; L27-I29 PolarHBondContact O-N 3.49Å; L27-I30 PolarHBondContact O-N 3.03Å; L27-L31 HydrophobicContact CD2-CD1 3.49Å; L27-L31 VanDerWaalsContact CD2-CD1 3.49Å; L27-L31 HydrophobicContact CD2-CG 4.04Å; L27-L31 WeakPolarHBondContact O-CG 3.34Å; L27-L31 PolarHBondContact O-N 3.3Å; L27-L205 HydrophobicContact CB-CD2 4.13Å; L27-L205 HydrophobicContact CD1-CB 4.45Å; L27-F283 HydrophobicContact CD1-CE2 4.27Å; L27-F283 HydrophobicContact CD1-CZ 4.12Å; L27-F283 HydrophobicContact CD2-CE2 4.13Å; L27-F283 HydrophobicContact CD2-CZ 4.49Å
28S83.1Confident81.4Confident31 Ų3152.2 Ų52.222%0.21728%0.278CS..Hα-helixtrans-61.4-45.2179.6-51.40000111.8D24 L25 A26 L31 V32 N271D24-S28 PolarHBondContact O-N 3.13Å; D24-S28 PolarHBondContact O-OG 2.89Å; L25-S28 PolarHBondContact O-N 3.44Å; A26-S28 VanDerWaalsContact C-N 3.33Å; A26-S28 PolarHBondContact O-N 2.89Å; S28-L31 PolarHBondContact O-N 2.92Å; S28-V32 WeakPolarHBondContact O-CG2 3.22Å; S28-V32 PolarHBondContact O-N 3.29Å; S28-V32 VanDerWaalsContact O-N 3.07Å; S28-N271 WeakPolarHBondContact CA-OD1 3.3Å; S28-N271 WeakPolarHBondContact CB-OD1 3.26Å; S28-N271 PolarHBondContact OG-OD1 3.45Å; S28-N271 VanDerWaalsContact OG-OD1 3.08Å
29I87.4Confident82.9Confident102 Ų10251.2 Ų51.252%0.52327%0.273SS..Hα-helixtrans-62.4-45.6177-68.2168.2000110.8L25 A26 L27 L31 V32 F33L25-I29 HydrophobicContact CD1-CD1 4.23Å; L25-I29 HydrophobicContact CD1-CG1 4.49Å; L25-I29 HydrophobicContact CG-CD1 3.98Å; L25-I29 WeakPolarHBondContact O-CG1 3.32Å; L25-I29 PolarHBondContact O-N 3.09Å; A26-I29 PolarHBondContact O-N 3.4Å; L27-I29 PolarHBondContact O-N 3.49Å; I29-L31 VanDerWaalsContact C-N 3.34Å; I29-L31 PolarHBondContact O-N 3.39Å; I29-V32 PolarHBondContact O-N 2.61Å; I29-F33 WeakPolarHBondContact O-CB 3.39Å; I29-F33 PolarHBondContact O-N 3.44Å
30I86.7Confident84.4Confident39 Ų3950.8 Ų50.820%0.226%0.264CS..Hα-helixtrans-64.1-40.4179.5-65.2163.4000110.6A26 L27 F33 M34 C198 A201 V202 L205A26-I30 WeakPolarHBondContact O-CB 3.11Å; A26-I30 WeakPolarHBondContact O-CD1 3.29Å; A26-I30 WeakPolarHBondContact O-CG1 3.35Å; A26-I30 PolarHBondContact O-N 2.96Å; L27-I30 PolarHBondContact O-N 3.03Å; I30-F33 PolarHBondContact O-N 3.16Å; I30-M34 WeakPolarHBondContact O-CB 3.44Å; I30-M34 PolarHBondContact O-N 3.4Å; I30-C198 HydrophobicContact CG2-CB 4.01Å; I30-A201 HydrophobicContact CD1-CB 4.31Å; I30-V202 HydrophobicContact CB-CG2 4.38Å; I30-V202 HydrophobicContact CG2-CG2 3.61Å; I30-L205 HydrophobicContact CD1-CD2 4.12Å
31L84.2Confident85.4Confident5 Ų543.3 Ų43.33%0.02623%0.233CC..Hα-helixtrans-61.8-44.5176.6-78.5-179.9000112.4L27 S28 I29 M34 L35 V202 Q264 N271L27-L31 HydrophobicContact CD2-CD1 3.49Å; L27-L31 VanDerWaalsContact CD2-CD1 3.49Å; L27-L31 HydrophobicContact CD2-CG 4.04Å; L27-L31 WeakPolarHBondContact O-CG 3.34Å; L27-L31 PolarHBondContact O-N 3.3Å; S28-L31 PolarHBondContact O-N 2.92Å; I29-L31 VanDerWaalsContact C-N 3.34Å; I29-L31 PolarHBondContact O-N 3.39Å; L31-M34 PolarHBondContact O-N 3.38Å; L31-L35 VanDerWaalsContact O-CB 3.3Å; L31-L35 WeakPolarHBondContact O-CB 3.4Å; L31-L35 PolarHBondContact O-N 3.24Å; L31-V202 HydrophobicContact CD2-CG1 4.01Å; L31-V202 HydrophobicContact CD2-CG2 3.9Å; L31-V202 HydrophobicContact CG-CG2 4.36Å; L31-Q264 PolarHBondContact O-NE2 3.07Å; L31-N271 HydrophobicContact CD1-CB 3.89Å
32V88.3Confident86Confident63 Ų6340.3 Ų40.338%0.38222%0.221SC..Hα-helixtrans-64.5-43.7176.6172.90000110.7S28 I29 L35 F36 T268 V272S28-V32 WeakPolarHBondContact O-CG2 3.22Å; S28-V32 PolarHBondContact O-N 3.29Å; S28-V32 VanDerWaalsContact O-N 3.07Å; I29-V32 PolarHBondContact O-N 2.61Å; V32-L35 PolarHBondContact O-N 2.97Å; V32-F36 PolarHBondContact O-N 3.04Å; V32-T268 HydrophobicContact CG2-CG2 3.94Å; V32-V272 HydrophobicContact CG2-CG2 3.95Å
33F89.9Confident86.4Confident108 Ų10835.1 Ų35.147%0.47419%0.188SC..Hα-helixtrans-64.2-45.3177.7-165-105.5000111.5I29 I30 L35 F36 F37 I194I29-F33 WeakPolarHBondContact O-CB 3.39Å; I29-F33 PolarHBondContact O-N 3.44Å; I30-F33 PolarHBondContact O-N 3.16Å; F33-L35 VanDerWaalsContact C-N 3.35Å; F33-L35 PolarHBondContact O-N 3.08Å; F33-F36 WeakPolarHBondContact O-CB 3.36Å; F33-F36 PolarHBondContact O-N 2.92Å; F33-F37 AromaticContact CD1-CD2 3.96Å; F33-F37 HydrophobicContact CD1-CD2 3.96Å; F33-F37 AromaticContact CD1-CE2 3.74Å; F33-F37 HydrophobicContact CD1-CE2 3.74Å; F33-F37 HydrophobicContact CD2-CE2 4.17Å; F33-F37 AromaticContact CE1-CD2 3.89Å; F33-F37 HydrophobicContact CE1-CD2 3.89Å; F33-F37 AromaticContact CE1-CE2 3.27Å; F33-F37 HydrophobicContact CE1-CE2 3.27Å; F33-F37 HydrophobicContact CE1-CZ 4.15Å; F33-F37 AromaticContact CE2-CE2 3.75Å; F33-F37 HydrophobicContact CE2-CE2 3.75Å; F33-F37 HydrophobicContact CE2-CZ 4.49Å; F33-F37 HydrophobicContact CG-CD2 4.44Å; F33-F37 HydrophobicContact CG-CE2 4.19Å; F33-F37 HydrophobicContact CZ-CD2 4.31Å; F33-F37 AromaticContact CZ-CE2 3.3Å; F33-F37 HydrophobicContact CZ-CE2 3.3Å; F33-F37 AromaticContact CZ-CZ 3.93Å; F33-F37 HydrophobicContact CZ-CZ 3.93Å; F33-F37 VanDerWaalsContact O-CD2 3.29Å; F33-F37 WeakPolarHBondContact O-CD2 3.1Å; F33-F37 PolarHBondContact O-N 3.39Å; F33-F37 VanDerWaalsContact O-N 3.16Å; F33-I194 HydrophobicContact CE1-CG2 4.11Å
34M87.5Confident86.9Confident16 Ų1633 Ų338%0.07918%0.175CC..Hα-helixtrans-59.8-45.4175.2-175.5178.5173.500111.2I30 L31 F36 F37 V38 I195 C198 Q264I30-M34 WeakPolarHBondContact O-CB 3.44Å; I30-M34 PolarHBondContact O-N 3.4Å; L31-M34 PolarHBondContact O-N 3.38Å; M34-F36 VanDerWaalsContact C-N 3.3Å; M34-F36 PolarHBondContact O-N 3.16Å; M34-F37 PolarHBondContact O-N 2.89Å; M34-V38 VanDerWaalsContact O-CG2 3.3Å; M34-V38 WeakPolarHBondContact O-CG2 3.47Å; M34-V38 PolarHBondContact O-N 2.65Å; M34-I195 HydrophobicContact CE-CG2 3.88Å; M34-C198 HydrophobicContact CB-CB 3.83Å; M34-C198 HydrophobicContact CG-CB 3.9Å; M34-C198 HydrophobicContact SD-CB 4.01Å; M34-Q264 PolarHBondContact SD-NE2 3.19Å
35L88.1Confident87.2Confident8 Ų835.1 Ų35.14%0.04219%0.189CC..Hα-helixtrans-58.6-42.3175.6-179.862.7000111.7L31 V32 F33 F37 V38 M39 V166 Q264 L265 T268L31-L35 VanDerWaalsContact O-CB 3.3Å; L31-L35 WeakPolarHBondContact O-CB 3.4Å; L31-L35 PolarHBondContact O-N 3.24Å; V32-L35 PolarHBondContact O-N 2.97Å; F33-L35 VanDerWaalsContact C-N 3.35Å; F33-L35 PolarHBondContact O-N 3.08Å; L35-F37 PolarHBondContact O-N 3.35Å; L35-V38 PolarHBondContact O-N 3.07Å; L35-M39 HydrophobicContact CD1-CE 3.47Å; L35-M39 VanDerWaalsContact CD1-CE 3.47Å; L35-M39 HydrophobicContact CD1-CG 4Å; L35-M39 HydrophobicContact CD1-SD 4.48Å; L35-M39 HydrophobicContact CG-CG 4.33Å; L35-M39 WeakPolarHBondContact O-CB 3.4Å; L35-M39 WeakPolarHBondContact O-CG 3.34Å; L35-M39 PolarHBondContact O-N 3.47Å; L35-V166 HydrophobicContact CD2-CG2 3.86Å; L35-V166 HydrophobicContact CG-CG2 4.42Å; L35-Q264 HydrophobicContact CB-CG 4.05Å; L35-Q264 HydrophobicContact CD1-CB 4.22Å; L35-Q264 HydrophobicContact CD1-CG 3.91Å; L35-L265 HydrophobicContact CD1-CB 4.05Å; L35-T268 HydrophobicContact CD2-CG2 3.67Å
36F91.1Very high87.2Confident75 Ų7530 Ų3033%0.32916%0.162SC..Hα-helixtrans-56.1-49.2176177.5-86.6000111.7V32 F33 M34 M39 L40 P169V32-F36 PolarHBondContact O-N 3.04Å; F33-F36 WeakPolarHBondContact O-CB 3.36Å; F33-F36 PolarHBondContact O-N 2.92Å; M34-F36 VanDerWaalsContact C-N 3.3Å; M34-F36 PolarHBondContact O-N 3.16Å; F36-M39 PolarHBondContact O-N 2.9Å; F36-L40 HydrophobicContact CE1-CD2 4.17Å; F36-L40 VanDerWaalsContact O-CB 3.25Å; F36-L40 WeakPolarHBondContact O-CB 3.49Å; F36-L40 PolarHBondContact O-N 2.79Å; F36-P169 HydrophobicContact CD2-CB 3.62Å; F36-P169 HydrophobicContact CD2-CG 3.78Å; F36-P169 HydrophobicContact CE2-CB 3.7Å; F36-P169 HydrophobicContact CE2-CG 4.23Å; F36-P169 HydrophobicContact CG-CB 4.12Å; F36-P169 HydrophobicContact CG-CG 4.39Å; F36-P169 HydrophobicContact CZ-CB 4.24Å; F36-P169 WeakPolarHBondContact O-CB 3.33Å
37F90.3Very high87Confident35 Ų3531.3 Ų31.315%0.15416%0.162CC..Hα-helixtrans-68.9-35178.7-77.8-81.7000113.2F33 M34 L35 S41 I194 I195F33-F37 AromaticContact CD1-CD2 3.96Å; F33-F37 HydrophobicContact CD1-CD2 3.96Å; F33-F37 AromaticContact CD1-CE2 3.74Å; F33-F37 HydrophobicContact CD1-CE2 3.74Å; F33-F37 HydrophobicContact CD2-CE2 4.17Å; F33-F37 AromaticContact CE1-CD2 3.89Å; F33-F37 HydrophobicContact CE1-CD2 3.89Å; F33-F37 AromaticContact CE1-CE2 3.27Å; F33-F37 HydrophobicContact CE1-CE2 3.27Å; F33-F37 HydrophobicContact CE1-CZ 4.15Å; F33-F37 AromaticContact CE2-CE2 3.75Å; F33-F37 HydrophobicContact CE2-CE2 3.75Å; F33-F37 HydrophobicContact CE2-CZ 4.49Å; F33-F37 HydrophobicContact CG-CD2 4.44Å; F33-F37 HydrophobicContact CG-CE2 4.19Å; F33-F37 HydrophobicContact CZ-CD2 4.31Å; F33-F37 AromaticContact CZ-CE2 3.3Å; F33-F37 HydrophobicContact CZ-CE2 3.3Å; F33-F37 AromaticContact CZ-CZ 3.93Å; F33-F37 HydrophobicContact CZ-CZ 3.93Å; F33-F37 VanDerWaalsContact O-CD2 3.29Å; F33-F37 WeakPolarHBondContact O-CD2 3.1Å; F33-F37 PolarHBondContact O-N 3.39Å; F33-F37 VanDerWaalsContact O-N 3.16Å; M34-F37 PolarHBondContact O-N 2.89Å; L35-F37 PolarHBondContact O-N 3.35Å; F37-S41 VanDerWaalsContact O-CB 3.26Å; F37-S41 WeakPolarHBondContact O-CB 3.39Å; F37-S41 PolarHBondContact O-N 3.38Å; F37-S41 PolarHBondContact O-OG 2.93Å; F37-I194 HydrophobicContact CD1-CD1 4.02Å; F37-I194 HydrophobicContact CD1-CG2 4.42Å; F37-I194 HydrophobicContact CD2-CG2 3.76Å; F37-I194 HydrophobicContact CE1-CD1 3.59Å; F37-I194 HydrophobicContact CE2-CG2 4.08Å; F37-I194 HydrophobicContact CG-CG2 3.98Å; F37-I194 HydrophobicContact CZ-CD1 3.89Å; F37-I194 HydrophobicContact CZ-CG2 4.49Å; F37-I195 HydrophobicContact CB-CD1 4.33Å; F37-I195 HydrophobicContact CB-CG1 3.98Å
38V88.4Confident86.7Confident15 Ų1537.4 Ų37.49%0.09119%0.188CC..Hα-helixtrans-62.8-47.2174.9172.60000110.4M34 L35 S41 L42 I195 Q264M34-V38 VanDerWaalsContact O-CG2 3.3Å; M34-V38 WeakPolarHBondContact O-CG2 3.47Å; M34-V38 PolarHBondContact O-N 2.65Å; L35-V38 PolarHBondContact O-N 3.07Å; V38-S41 PolarHBondContact O-N 2.91Å; V38-L42 PolarHBondContact O-N 3.32Å; V38-I195 HydrophobicContact CB-CD1 4.44Å; V38-I195 HydrophobicContact CG2-CD1 3.71Å; V38-I195 HydrophobicContact CG2-CG1 3.88Å; V38-I195 HydrophobicContact CG2-CG2 4.2Å; V38-Q264 HydrophobicContact CG2-CG 4.35Å
39M90.8Very high86.5Confident0 Ų039.8 Ų39.80%021%0.205CC..Hα-helixtrans-69.6-37.6179.3-67.3-49.9122.600112.4L35 F36 S41 L42 G43 V166 P169 C170 N262L35-M39 HydrophobicContact CD1-CE 3.47Å; L35-M39 VanDerWaalsContact CD1-CE 3.47Å; L35-M39 HydrophobicContact CD1-CG 4Å; L35-M39 HydrophobicContact CD1-SD 4.48Å; L35-M39 HydrophobicContact CG-CG 4.33Å; L35-M39 WeakPolarHBondContact O-CB 3.4Å; L35-M39 WeakPolarHBondContact O-CG 3.34Å; L35-M39 PolarHBondContact O-N 3.47Å; F36-M39 PolarHBondContact O-N 2.9Å; M39-S41 VanDerWaalsContact C-N 3.33Å; M39-L42 PolarHBondContact O-N 3.15Å; M39-L42 HydrophobicContact SD-CD2 4.36Å; M39-G43 PolarHBondContact O-N 2.89Å; M39-V166 HydrophobicContact CG-CB 4.34Å; M39-V166 HydrophobicContact CG-CG1 3.59Å; M39-V166 HydrophobicContact SD-CG1 3.5Å; M39-V166 VanDerWaalsContact SD-CG1 3.5Å; M39-P169 HydrophobicContact CB-CB 4.1Å; M39-P169 HydrophobicContact CB-CG 3.71Å; M39-C170 HydrophobicContact CB-CB 4.42Å; M39-C170 WeakPolarHBondContact O-CA 3.38Å; M39-N262 WeakPolarHBondContact CE-ND2 3.38Å
40L91.4Very high85.8Confident20 Ų2037.8 Ų37.811%0.10519%0.192CC..Hα-helixtrans-62-44.2173.3-17866.1000110.9F36 G43 C44 P169 I172F36-L40 HydrophobicContact CE1-CD2 4.17Å; F36-L40 VanDerWaalsContact O-CB 3.25Å; F36-L40 WeakPolarHBondContact O-CB 3.49Å; F36-L40 PolarHBondContact O-N 2.79Å; L40-G43 PolarHBondContact O-N 3.3Å; L40-C44 WeakPolarHBondContact O-CB 3.43Å; L40-C44 PolarHBondContact O-N 3.06Å; L40-C44 PolarHBondContact O-SG 2.78Å; L40-P169 HydrophobicContact CB-CB 4.12Å; L40-P169 WeakPolarHBondContact CD1-O 3.23Å; L40-I172 HydrophobicContact CD1-CB 4.24Å; L40-I172 HydrophobicContact CD1-CG2 3.87Å
41S88.4Confident85.2Confident12 Ų1237.1 Ų37.18%0.08419%0.189CC..Hα-helixtrans-63.2-43.7177.6-60.10000111.3F37 V38 M39 C44 T45F37-S41 VanDerWaalsContact O-CB 3.26Å; F37-S41 WeakPolarHBondContact O-CB 3.39Å; F37-S41 PolarHBondContact O-N 3.38Å; F37-S41 PolarHBondContact O-OG 2.93Å; V38-S41 PolarHBondContact O-N 2.91Å; M39-S41 VanDerWaalsContact C-N 3.33Å; S41-C44 PolarHBondContact O-N 3.37Å; S41-T45 WeakPolarHBondContact O-CG2 3.2Å; S41-T45 PolarHBondContact O-N 2.91Å
42L87.7Confident85Confident2 Ų242.9 Ų42.91%0.0121%0.214CC..Hα-helixtrans-56.1-51.7173174.359.8000110.7V38 M39 C44 T45 N103 T123V38-L42 PolarHBondContact O-N 3.32Å; M39-L42 PolarHBondContact O-N 3.15Å; M39-L42 HydrophobicContact SD-CD2 4.36Å; L42-C44 VanDerWaalsContact C-N 3.3Å; L42-C44 PolarHBondContact O-N 2.73Å; L42-T45 PolarHBondContact O-N 2.81Å; L42-T45 PolarHBondContact O-OG1 3.36Å; L42-N103 WeakPolarHBondContact CD1-OD1 3.39Å; L42-T123 HydrophobicContact CD1-CG2 3.93Å; L42-T123 HydrophobicContact CD2-CG2 3.95Å
43G87.9Confident84.3Confident0 Ų042.7 Ų42.70%022%0.219CC..Hα-helixtrans-57.8-40.2177.700000113.2M39 L40 T45 M46 C170 G173 I174M39-G43 PolarHBondContact O-N 2.89Å; L40-G43 PolarHBondContact O-N 3.3Å; G43-T45 PolarHBondContact O-N 3.42Å; G43-M46 WeakPolarHBondContact O-CB 3.5Å; G43-M46 PolarHBondContact O-N 3.48Å; G43-M46 VanDerWaalsContact O-N 3.12Å; G43-C170 WeakPolarHBondContact CA-O 3.48Å; G43-G173 CarbonylContact O-C 3.22Å; G43-I174 WeakPolarHBondContact O-CA 3.35Å; G43-I174 PolarHBondContact O-N 2.87Å
44C88Confident83.5Confident1 Ų139.4 Ų39.41%0.00721%0.205CC..Hα-helixtrans-66.4-19.1178-73.40000114.1L40 S41 L42 M46 K177 M184 I188L40-C44 WeakPolarHBondContact O-CB 3.43Å; L40-C44 PolarHBondContact O-N 3.06Å; L40-C44 PolarHBondContact O-SG 2.78Å; S41-C44 PolarHBondContact O-N 3.37Å; L42-C44 VanDerWaalsContact C-N 3.3Å; L42-C44 PolarHBondContact O-N 2.73Å; C44-M46 VanDerWaalsContact C-N 3.31Å; C44-K177 WeakPolarHBondContact O-CD 3.39Å; C44-K177 WeakPolarHBondContact O-CG 3.34Å; C44-M184 HydrophobicContact CB-SD 3.84Å; C44-I188 HydrophobicContact CB-CD1 4.33Å; C44-I188 HydrophobicContact CB-CG1 4.09Å
45T84Confident82.9Confident56 Ų5643.3 Ų43.334%0.34423%0.225SC..THydrogen-bonded Turntrans-83.2-9.5175.263.30000113.3S41 L42 G43 I188S41-T45 WeakPolarHBondContact O-CG2 3.2Å; S41-T45 PolarHBondContact O-N 2.91Å; L42-T45 PolarHBondContact O-N 2.81Å; L42-T45 PolarHBondContact O-OG1 3.36Å; G43-T45 PolarHBondContact O-N 3.42Å; T45-I188 HydrophobicContact CG2-CD1 4.11Å
46M81.6Confident82.1Confident2 Ų252.5 Ų52.51%0.0126%0.26CS..  trans-98.3132.9-169.4179.151.8117.400113.2G43 C44 I51 I120 V121 T124 I174 K177G43-M46 WeakPolarHBondContact O-CB 3.5Å; G43-M46 PolarHBondContact O-N 3.48Å; G43-M46 VanDerWaalsContact O-N 3.12Å; C44-M46 VanDerWaalsContact C-N 3.31Å; M46-I51 HydrophobicContact CE-CD1 3.64Å; M46-I51 HydrophobicContact CE-CG1 3.17Å; M46-I51 HydrophobicContact CG-CD1 3.55Å; M46-I51 HydrophobicContact CG-CG1 4Å; M46-I51 HydrophobicContact SD-CD1 3.8Å; M46-I51 HydrophobicContact SD-CG1 3.5Å; M46-I51 VanDerWaalsContact SD-CG1 3.5Å; M46-I120 HydrophobicContact CB-CG2 4.18Å; M46-I120 HydrophobicContact CE-CG2 3.87Å; M46-I120 WeakPolarHBondContact CE-O 3.33Å; M46-I120 HydrophobicContact CG-CG2 4.48Å; M46-I120 HydrophobicContact SD-CG2 3.66Å; M46-V121 HydrophobicContact CE-CB 4.27Å; M46-V121 HydrophobicContact CE-CG2 3.79Å; M46-T124 HydrophobicContact CE-CG2 3.91Å; M46-T124 VanDerWaalsContact CE-OG1 3.26Å; M46-T124 WeakPolarHBondContact CE-OG1 3.22Å; M46-I174 HydrophobicContact CB-CG1 4.08Å; M46-I174 HydrophobicContact CG-CG1 4.16Å; M46-K177 WeakPolarHBondContact O-CG 3.29Å
47E80Confident81.2Confident64 Ų6455 Ų5530%0.29927%0.27SS..  trans-107.7126.1176.5-72.8172.5-176.500110.8S49 K50 I51 K177E47-S49 PolarHBondContact O-N 2.91Å; E47-K50 HydrophobicContact CB-CB 4.43Å; E47-K50 HydrophobicContact CB-CD 4.08Å; E47-K50 HydrophobicContact CB-CG 4.06Å; E47-K50 WeakPolarHBondContact O-CB 3.41Å; E47-K50 PolarHBondContact O-N 3.14Å; E47-K50 WeakPolarHBondContact OE2-CE 3.28Å; E47-K50 IonicContact OE2-NZ 3.8Å; E47-K50 PolarHBondContact OE2-NZ 3.46Å; E47-I51 PolarHBondContact O-N 2.9Å; E47-K177 VanDerWaalsContact CG-CE 3.45Å; E47-K177 WeakPolarHBondContact OE1-CE 3.18Å; E47-K177 IonicContact OE1-NZ 3.12Å; E47-K177 PolarHBondContact OE1-NZ 2.78Å; E47-K177 VanDerWaalsContact OE1-NZ 3.12Å
48F76.9Confident80.6Confident131 Ų13156.8 Ų56.858%0.57529%0.286SS*.Hα-helixtrans-58.8-35.2-176.9-171.1-98.7000113.2K50 I51 K52F48-K50 VanDerWaalsContact C-N 3.27Å; F48-K50 PolarHBondContact O-N 3.45Å; F48-I51 PolarHBondContact O-N 2.8Å; F48-K52 PolarHBondContact O-N 3.15Å
49S77.3Confident80.3Confident81 Ų8164.1 Ų64.157%0.56632%0.316SS*.Hα-helixtrans-60-36.617551.90000112.6E47 A53E47-S49 PolarHBondContact O-N 2.91Å; S49-A53 WeakPolarHBondContact O-CB 3.48Å; S49-A53 PolarHBondContact O-N 3.39Å
50K74.1Confident79.8Confident60 Ų6064.6 Ų64.626%0.26132%0.321SS..Hα-helixtrans-74.3-39179.5-64.9-177.1176.8172.70112.3E47 F48 K52 A53 H54 N117E47-K50 HydrophobicContact CB-CB 4.43Å; E47-K50 HydrophobicContact CB-CD 4.08Å; E47-K50 HydrophobicContact CB-CG 4.06Å; E47-K50 WeakPolarHBondContact O-CB 3.41Å; E47-K50 PolarHBondContact O-N 3.14Å; E47-K50 WeakPolarHBondContact OE2-CE 3.28Å; E47-K50 IonicContact OE2-NZ 3.8Å; E47-K50 PolarHBondContact OE2-NZ 3.46Å; F48-K50 VanDerWaalsContact C-N 3.27Å; F48-K50 PolarHBondContact O-N 3.45Å; K50-K52 VanDerWaalsContact C-N 3.32Å; K50-K52 PolarHBondContact O-N 2.92Å; K50-A53 PolarHBondContact O-N 2.97Å; K50-H54 PolarHBondContact O-N 3.14Å; K50-H54 VanDerWaalsContact O-N 3.08Å; K50-N117 HydrophobicContact CD-CB 4.37Å; K50-N117 WeakPolarHBondContact CD-OD1 3.21Å; K50-N117 VanDerWaalsContact CE-OD1 3.24Å; K50-N117 WeakPolarHBondContact CE-OD1 3.48Å; K50-N117 PolarHBondContact NZ-OD1 3.44Å
51I74.3Confident79.5Confident25 Ų2564.1 Ų64.113%0.12832%0.319CS..Hα-helixtrans-56.1-52.8170.8-66.7166.1000109.2M46 E47 F48 A53 H54 L55M46-I51 HydrophobicContact CE-CD1 3.64Å; M46-I51 HydrophobicContact CE-CG1 3.17Å; M46-I51 HydrophobicContact CG-CD1 3.55Å; M46-I51 HydrophobicContact CG-CG1 4Å; M46-I51 HydrophobicContact SD-CD1 3.8Å; M46-I51 HydrophobicContact SD-CG1 3.5Å; M46-I51 VanDerWaalsContact SD-CG1 3.5Å; E47-I51 PolarHBondContact O-N 2.9Å; F48-I51 PolarHBondContact O-N 2.8Å; I51-A53 PolarHBondContact O-N 2.64Å; I51-H54 PolarHBondContact O-N 2.95Å; I51-L55 HydrophobicContact CG2-CD1 3.65Å; I51-L55 HydrophobicContact CG2-CG 4.13Å; I51-L55 VanDerWaalsContact O-CG 3.3Å; I51-L55 WeakPolarHBondContact O-CG 3.31Å; I51-L55 PolarHBondContact O-N 3.41Å
52K78.8Confident79.5Confident126 Ų12665.9 Ų65.955%0.54833%0.334SS..Hα-helixtrans-56.3-53-179.2-168.1176-179.4-179.20110.1F48 K50 H54 L55 W56F48-K52 PolarHBondContact O-N 3.15Å; K50-K52 VanDerWaalsContact C-N 3.32Å; K50-K52 PolarHBondContact O-N 2.92Å; K52-H54 VanDerWaalsContact C-N 3.32Å; K52-H54 PolarHBondContact O-N 3.45Å; K52-L55 PolarHBondContact O-N 3.43Å; K52-L55 VanDerWaalsContact O-N 3.14Å; K52-W56 PolarHBondContact O-N 3.45Å
53A74.8Confident79.5Confident59 Ų5966.6 Ų66.649%0.48834%0.338SS..Hα-helixtrans-56.3-40.5-178.400000114.1S49 K50 I51 W56S49-A53 WeakPolarHBondContact O-CB 3.48Å; S49-A53 PolarHBondContact O-N 3.39Å; K50-A53 PolarHBondContact O-N 2.97Å; I51-A53 PolarHBondContact O-N 2.64Å; A53-W56 PolarHBondContact O-N 3.3Å
54H72.5Confident79.4Confident39 Ų3966.8 Ų66.818%0.18134%0.339CS..Hα-helixtrans-79.2-26.7178.3-82.2-39.3000113.9K50 I51 K52 W56 K57 V121K50-H54 PolarHBondContact O-N 3.14Å; K50-H54 VanDerWaalsContact O-N 3.08Å; I51-H54 PolarHBondContact O-N 2.95Å; K52-H54 VanDerWaalsContact C-N 3.32Å; K52-H54 PolarHBondContact O-N 3.45Å; H54-W56 PolarHBondContact O-N 2.88Å; H54-K57 CarbonylContact O-C 3.39Å; H54-K57 VanDerWaalsContact O-C 3.22Å; H54-K57 PolarHBondContact O-N 2.85Å; H54-K57 VanDerWaalsContact O-N 3.08Å; H54-V121 HydrophobicContact CB-CB 4.41Å; H54-V121 HydrophobicContact CB-CG1 3.94Å; H54-V121 HydrophobicContact CB-CG2 4.17Å
55L73.8Confident79.6Confident98 Ų9868.7 Ų68.751%0.51335%0.349SS..Hα-helixtrans-62.6-29.2168.6-71.8173.2000112.1I51 K52 K57 L61I51-L55 HydrophobicContact CG2-CD1 3.65Å; I51-L55 HydrophobicContact CG2-CG 4.13Å; I51-L55 VanDerWaalsContact O-CG 3.3Å; I51-L55 WeakPolarHBondContact O-CG 3.31Å; I51-L55 PolarHBondContact O-N 3.41Å; K52-L55 PolarHBondContact O-N 3.43Å; K52-L55 VanDerWaalsContact O-N 3.14Å; L55-K57 VanDerWaalsContact C-N 3.35Å; L55-L61 HydrophobicContact CD2-CD2 3.95Å
56W71.8Confident80Confident202 Ų20270.3 Ų70.377%0.76536%0.359SS*.THydrogen-bonded Turntrans-78-14.4173.8-76.990.9000114.1K52 A53 H54K52-W56 PolarHBondContact O-N 3.45Å; A53-W56 PolarHBondContact O-N 3.3Å; H54-W56 PolarHBondContact O-N 2.88Å
57K72.5Confident80.5Confident127 Ų12770.2 Ų70.255%0.55236%0.358SS*.SBendtrans-123.970.2174.2-67.6-171.2-179.6-176.30110.2H54 L55 K59H54-K57 CarbonylContact O-C 3.39Å; H54-K57 VanDerWaalsContact O-C 3.22Å; H54-K57 PolarHBondContact O-N 2.85Å; H54-K57 VanDerWaalsContact O-N 3.08Å; L55-K57 VanDerWaalsContact C-N 3.35Å; K57-K59 VanDerWaalsContact C-N 3.3Å; K57-K59 PolarHBondContact O-N 3.17Å
58P78.3Confident81.2Confident73 Ų7367.3 Ų67.347%0.47435%0.345SS..Hα-helixtrans-74.1-12.7-161.529.4-37.2000114.7G60 L61 A62P58-G60 PolarHBondContact O-N 3.19Å; P58-L61 PolarHBondContact O-N 3.15Å; P58-A62 WeakPolarHBondContact O-CB 3.36Å; P58-A62 PolarHBondContact O-N 3.12Å
59K81.9Confident82.1Confident168 Ų16861.6 Ų61.673%0.7332%0.319SS*.Hα-helixtrans-54.1-52.5-172.5-66.8-170.9178.4-174.90112.3K57 L61 A62 I63K57-K59 VanDerWaalsContact C-N 3.3Å; K57-K59 PolarHBondContact O-N 3.17Å; K59-L61 PolarHBondContact O-N 2.91Å; K59-A62 PolarHBondContact O-N 2.72Å; K59-I63 WeakPolarHBondContact O-CD1 3.41Å; K59-I63 WeakPolarHBondContact O-CG1 3.39Å; K59-I63 PolarHBondContact O-N 2.99Å; K59-I63 VanDerWaalsContact O-N 3.07Å
60G79.4Confident82.9Confident10 Ų1059.2 Ų59.210%0.10331%0.308CS..Hα-helixtrans-64.2-42.2179.900000112.9P58 I63 A64 M122P58-G60 PolarHBondContact O-N 3.19Å; G60-I63 PolarHBondContact O-N 3.24Å; G60-A64 PolarHBondContact O-N 3.49Å; G60-M122 VanDerWaalsContact O-CE 3.28Å; G60-M122 WeakPolarHBondContact O-CE 3.16Å
61L84.9Confident83.9Confident11 Ų1157.4 Ų57.46%0.05830%0.301CS..Hα-helixtrans-64.2-45.4178.6179.458000112.1L55 P58 K59 A64 L65 V121 M122 C125L55-L61 HydrophobicContact CD2-CD2 3.95Å; P58-L61 PolarHBondContact O-N 3.15Å; K59-L61 PolarHBondContact O-N 2.91Å; L61-A64 PolarHBondContact O-N 3.1Å; L61-L65 HydrophobicContact CD1-CD1 4.39Å; L61-L65 HydrophobicContact CD1-CG 4.35Å; L61-L65 HydrophobicContact CG-CD1 4.28Å; L61-L65 WeakPolarHBondContact O-CG 3.42Å; L61-L65 PolarHBondContact O-N 2.87Å; L61-V121 HydrophobicContact CD1-CG1 4.14Å; L61-V121 HydrophobicContact CD2-CG1 4.27Å; L61-M122 HydrophobicContact CD1-CG 4.21Å; L61-C125 HydrophobicContact CD1-CB 3.81Å
62A88.6Confident85Confident49 Ų4956.2 Ų56.241%0.40529%0.294SS..Hα-helixtrans-62.2-44.5178.300000111.3P58 K59 A64 L65 V66P58-A62 WeakPolarHBondContact O-CB 3.36Å; P58-A62 PolarHBondContact O-N 3.12Å; K59-A62 PolarHBondContact O-N 2.72Å; A62-A64 VanDerWaalsContact C-N 3.31Å; A62-A64 PolarHBondContact O-N 2.74Å; A62-L65 PolarHBondContact O-N 3.37Å; A62-V66 WeakPolarHBondContact O-CG2 3.32Å; A62-V66 PolarHBondContact O-N 2.87Å
63I89Confident85.8Confident16 Ų1650.2 Ų50.28%0.08227%0.268CS..Hα-helixtrans-61.6-41.3177.3-66.3159.1000110.8K59 G60 V66 A67 L240 F244 L246K59-I63 WeakPolarHBondContact O-CD1 3.41Å; K59-I63 WeakPolarHBondContact O-CG1 3.39Å; K59-I63 PolarHBondContact O-N 2.99Å; K59-I63 VanDerWaalsContact O-N 3.07Å; G60-I63 PolarHBondContact O-N 3.24Å; I63-V66 PolarHBondContact O-N 3.4Å; I63-A67 WeakPolarHBondContact O-CB 3.38Å; I63-A67 PolarHBondContact O-N 2.94Å; I63-L240 HydrophobicContact CG2-CD2 4.27Å; I63-L240 HydrophobicContact CG2-CG 4.36Å; I63-F244 HydrophobicContact CD1-CB 3.4Å; I63-F244 HydrophobicContact CD1-CD1 4.46Å; I63-F244 HydrophobicContact CD1-CD2 4.34Å; I63-F244 HydrophobicContact CD1-CG 3.85Å; I63-F244 HydrophobicContact CG1-CB 4.13Å; I63-F244 HydrophobicContact CG1-CD2 4.13Å; I63-F244 HydrophobicContact CG1-CG 4.06Å; I63-F244 HydrophobicContact CG2-CD2 4.26Å; I63-L246 HydrophobicContact CB-CD1 4.16Å; I63-L246 HydrophobicContact CD1-CD1 3.49Å; I63-L246 VanDerWaalsContact CD1-CD1 3.49Å; I63-L246 HydrophobicContact CD1-CG 4.08Å; I63-L246 HydrophobicContact CG1-CD1 4.42Å; I63-L246 HydrophobicContact CG2-CD1 3.86Å
64A86Confident86.9Confident4 Ų451.4 Ų51.43%0.03327%0.266CS..Hα-helixtrans-69.3-37175.600000113.8G60 L61 A62 V66 A67 Q68 M122 V254G60-A64 PolarHBondContact O-N 3.49Å; L61-A64 PolarHBondContact O-N 3.1Å; A62-A64 VanDerWaalsContact C-N 3.31Å; A62-A64 PolarHBondContact O-N 2.74Å; A64-V66 VanDerWaalsContact C-N 3.32Å; A64-A67 WeakPolarHBondContact O-CB 3.47Å; A64-A67 PolarHBondContact O-N 3.34Å; A64-Q68 VanDerWaalsContact O-CB 3.27Å; A64-Q68 WeakPolarHBondContact O-CB 3.43Å; A64-Q68 PolarHBondContact O-N 2.92Å; A64-M122 HydrophobicContact CB-CB 4.26Å; A64-M122 HydrophobicContact CB-CE 3.36Å; A64-M122 HydrophobicContact CB-CG 3.55Å; A64-M122 HydrophobicContact CB-SD 3.35Å; A64-M122 WeakPolarHBondContact CB-SD 3.32Å; A64-V254 HydrophobicContact CB-CG1 4.47Å; A64-V254 HydrophobicContact CB-CG2 4.34Å
65L91.3Very high88Confident41 Ų4150.2 Ų50.222%0.21526%0.261CS..Hα-helixtrans-64.8-39.7174.8-73.4173.5000111.3L61 A62 Q68 Y69L61-L65 HydrophobicContact CD1-CD1 4.39Å; L61-L65 HydrophobicContact CD1-CG 4.35Å; L61-L65 HydrophobicContact CG-CD1 4.28Å; L61-L65 WeakPolarHBondContact O-CG 3.42Å; L61-L65 PolarHBondContact O-N 2.87Å; A62-L65 PolarHBondContact O-N 3.37Å; L65-Q68 PolarHBondContact O-N 3.2Å; L65-Y69 HydrophobicContact CD2-CD2 4.43Å; L65-Y69 HydrophobicContact CD2-CE2 4.31Å; L65-Y69 WeakPolarHBondContact O-CB 3.48Å; L65-Y69 PolarHBondContact O-N 3.3Å
66V93.1Very high89.1Confident91 Ų9145.5 Ų45.555%0.55224%0.237SC*.Hα-helixtrans-65.8-39.8173172.40000111.1A62 I63 A64 G70 L240A62-V66 WeakPolarHBondContact O-CG2 3.32Å; A62-V66 PolarHBondContact O-N 2.87Å; I63-V66 PolarHBondContact O-N 3.4Å; A64-V66 VanDerWaalsContact C-N 3.32Å; V66-G70 WeakPolarHBondContact O-CA 3.46Å; V66-G70 PolarHBondContact O-N 3.22Å; V66-L240 HydrophobicContact CG1-CD2 4.38Å
67A91.8Very high90.3Very high0 Ų038.1 Ų38.10%021%0.21CC..Iπ-helixtrans-62.1-50.9174.100000110.9I63 A64 I71 L240 V254 T258I63-A67 WeakPolarHBondContact O-CB 3.38Å; I63-A67 PolarHBondContact O-N 2.94Å; A64-A67 WeakPolarHBondContact O-CB 3.47Å; A64-A67 PolarHBondContact O-N 3.34Å; A67-I71 HydrophobicContact CB-CD1 3.97Å; A67-I71 WeakPolarHBondContact O-CA 3.35Å; A67-I71 WeakPolarHBondContact O-CB 3.43Å; A67-I71 PolarHBondContact O-N 2.93Å; A67-L240 HydrophobicContact CB-CD2 3.91Å; A67-V254 HydrophobicContact CB-CG1 4.21Å; A67-T258 HydrophobicContact CB-CG2 4.09Å; A67-T258 VanDerWaalsContact CB-OG1 3.3Å; A67-T258 WeakPolarHBondContact CB-OG1 3.4Å
68Q94.3Very high91.4Very high2 Ų235.2 Ų35.21%0.00920%0.203CC..Iπ-helixtrans-63-48.4-176.5-171.164.325.300112.4A64 L65 M72 P73 S99 E257 Q261A64-Q68 VanDerWaalsContact O-CB 3.27Å; A64-Q68 WeakPolarHBondContact O-CB 3.43Å; A64-Q68 PolarHBondContact O-N 2.92Å; L65-Q68 PolarHBondContact O-N 3.2Å; Q68-M72 WeakPolarHBondContact O-CB 3.34Å; Q68-P73 WeakPolarHBondContact O-CD 3.4Å; Q68-S99 PolarHBondContact NE2-O 2.86Å; Q68-E257 PolarHBondContact OE1-O 2.85Å; Q68-Q261 VanDerWaalsContact NE2-CD 3.33Å
69Y95.1Very high92.3Very high11 Ų1132.4 Ų32.44%0.04318%0.184CC..Iπ-helixtrans-98.4-7.5-174.2-72.7-59.5000114.3L65 P73 S126 C129 A130 M133 L137L65-Y69 HydrophobicContact CD2-CD2 4.43Å; L65-Y69 HydrophobicContact CD2-CE2 4.31Å; L65-Y69 WeakPolarHBondContact O-CB 3.48Å; L65-Y69 PolarHBondContact O-N 3.3Å; Y69-P73 WeakPolarHBondContact O-CG 3.33Å; Y69-S126 PolarHBondContact OH-O 3.41Å; Y69-C129 HydrophobicContact CE2-CB 3.83Å; Y69-A130 WeakPolarHBondContact OH-CA 3.43Å; Y69-A130 VanDerWaalsContact OH-CB 3.24Å; Y69-A130 WeakPolarHBondContact OH-CB 3.42Å; Y69-A130 PolarHBondContact OH-N 3.05Å; Y69-A130 VanDerWaalsContact OH-N 3.15Å; Y69-M133 HydrophobicContact CD1-CB 3.69Å; Y69-M133 HydrophobicContact CD1-CG 4.42Å; Y69-M133 HydrophobicContact CD2-CB 4.13Å; Y69-M133 HydrophobicContact CD2-CE 4.48Å; Y69-M133 HydrophobicContact CD2-CG 4Å; Y69-M133 HydrophobicContact CE1-CB 3.67Å; Y69-M133 HydrophobicContact CE2-CB 4.11Å; Y69-M133 HydrophobicContact CE2-CG 4.12Å; Y69-M133 HydrophobicContact CG-CB 3.93Å; Y69-M133 HydrophobicContact CG-CE 4.06Å; Y69-M133 HydrophobicContact CG-CG 4.15Å; Y69-L137 HydrophobicContact CD1-CD1 3.49Å; Y69-L137 VanDerWaalsContact CD1-CD1 3.49Å; Y69-L137 HydrophobicContact CE1-CD1 4.43Å; Y69-L137 HydrophobicContact CG-CD1 4.11Å
70G95Very high92.9Very high31 Ų3124.7 Ų24.732%0.3215%0.152SC..Iπ-helixtrans-98.5-60.9172.400000111.6V66 L74V66-G70 WeakPolarHBondContact O-CA 3.46Å; V66-G70 PolarHBondContact O-N 3.22Å; G70-L74 WeakPolarHBondContact O-CB 3.21Å; G70-L74 PolarHBondContact O-N 3.26Å
71I95.8Very high93.5Very high22 Ų2229.6 Ų29.611%0.11317%0.171CC..Iπ-helixtrans-67.4-49.5-171.7-61.9172.1000111A67 L74 T75 L236 L240 T258A67-I71 HydrophobicContact CB-CD1 3.97Å; A67-I71 WeakPolarHBondContact O-CA 3.35Å; A67-I71 WeakPolarHBondContact O-CB 3.43Å; A67-I71 PolarHBondContact O-N 2.93Å; I71-L74 PolarHBondContact O-N 3.45Å; I71-T75 VanDerWaalsContact O-CB 3.29Å; I71-T75 WeakPolarHBondContact O-CB 3.33Å; I71-T75 PolarHBondContact O-N 3.07Å; I71-T75 PolarHBondContact O-OG1 3.48Å; I71-L236 HydrophobicContact CD1-CB 3.89Å; I71-L236 HydrophobicContact CG2-CB 3.77Å; I71-L236 HydrophobicContact CG2-CD1 3.79Å; I71-L236 HydrophobicContact CG2-CG 4.41Å; I71-L240 HydrophobicContact CD1-CB 4.21Å; I71-L240 HydrophobicContact CD1-CD2 3.92Å; I71-T258 HydrophobicContact CB-CG2 4.39Å; I71-T258 HydrophobicContact CD1-CG2 4.45Å; I71-T258 HydrophobicContact CG2-CG2 4.47Å
72M95.8Very high94Very high0 Ų033.7 Ų33.70%020%0.196CC..Hα-helixtrans-69.7-46.4-170.4-81.5-70.7-166.700114.5Q68 L74 T75 A76 G97 M229 T258 G259 Y289Q68-M72 WeakPolarHBondContact O-CB 3.34Å; M72-L74 VanDerWaalsContact C-N 3.32Å; M72-L74 PolarHBondContact O-N 2.94Å; M72-T75 PolarHBondContact O-N 3.47Å; M72-A76 PolarHBondContact O-N 2.81Å; M72-G97 WeakPolarHBondContact CB-O 3.31Å; M72-M229 WeakPolarHBondContact CE-O 3.44Å; M72-T258 WeakPolarHBondContact CE-O 3.49Å; M72-T258 HydrophobicContact CG-CG2 4.1Å; M72-T258 WeakPolarHBondContact CG-O 3.47Å; M72-G259 VanDerWaalsContact CE-CA 3.44Å; M72-Y289 WeakPolarHBondContact CE-OH 3.39Å
73P96.8Very high94.3Very high0 Ų033.7 Ų33.70%019%0.187CC..Hα-helixtrans-60.4-41.6172.5-26.436.2000112.5Q68 Y69 T75 A76 F77 G97 L137 Y141Q68-P73 WeakPolarHBondContact O-CD 3.4Å; Y69-P73 WeakPolarHBondContact O-CG 3.33Å; P73-T75 VanDerWaalsContact C-N 3.35Å; P73-A76 PolarHBondContact O-N 2.81Å; P73-F77 WeakPolarHBondContact O-CB 3.35Å; P73-F77 PolarHBondContact O-N 2.83Å; P73-G97 WeakPolarHBondContact CD-O 3.38Å; P73-G97 WeakPolarHBondContact CG-O 3.32Å; P73-L137 HydrophobicContact CB-CD1 4.46Å; P73-L137 HydrophobicContact CG-CD1 3.79Å; P73-Y141 HydrophobicContact CB-CD2 4.12Å; P73-Y141 HydrophobicContact CB-CE2 3.61Å
74L96.8Very high94.4Very high85 Ų8541.1 Ų41.145%0.44522%0.221SC..Hα-helixtrans-63.3-43.5177.4-178.462.4000111.1G70 I71 M72 F77 V78 Y141G70-L74 WeakPolarHBondContact O-CB 3.21Å; G70-L74 PolarHBondContact O-N 3.26Å; I71-L74 PolarHBondContact O-N 3.45Å; M72-L74 VanDerWaalsContact C-N 3.32Å; M72-L74 PolarHBondContact O-N 2.94Å; L74-F77 PolarHBondContact O-N 3.24Å; L74-V78 HydrophobicContact CD1-CG2 4.06Å; L74-V78 HydrophobicContact CG-CG2 4.31Å; L74-V78 WeakPolarHBondContact O-CB 3.48Å; L74-V78 VanDerWaalsContact O-CG2 3.28Å; L74-V78 WeakPolarHBondContact O-CG2 3.33Å; L74-V78 PolarHBondContact O-N 3.42Å; L74-Y141 HydrophobicContact CD1-CE1 4.17Å
75T97.1Very high94.5Very high13 Ų1341.5 Ų41.58%0.0822%0.223CC..Hα-helixtrans-60.6-47.1177-600000110.6I71 M72 P73 F77 V78 L79 M229 I232I71-T75 VanDerWaalsContact O-CB 3.29Å; I71-T75 WeakPolarHBondContact O-CB 3.33Å; I71-T75 PolarHBondContact O-N 3.07Å; I71-T75 PolarHBondContact O-OG1 3.48Å; M72-T75 PolarHBondContact O-N 3.47Å; P73-T75 VanDerWaalsContact C-N 3.35Å; T75-F77 VanDerWaalsContact C-N 3.35Å; T75-F77 PolarHBondContact O-N 3.49Å; T75-V78 PolarHBondContact O-N 3.18Å; T75-L79 HydrophobicContact CG2-CD1 3.83Å; T75-L79 HydrophobicContact CG2-CG 4.34Å; T75-L79 WeakPolarHBondContact O-CB 3.28Å; T75-L79 VanDerWaalsContact O-CG 3.28Å; T75-L79 WeakPolarHBondContact O-CG 3.41Å; T75-L79 PolarHBondContact O-N 3.08Å; T75-M229 HydrophobicContact CG2-CG 4.32Å; T75-I232 HydrophobicContact CG2-CB 3.9Å; T75-I232 HydrophobicContact CG2-CD1 3.79Å; T75-I232 HydrophobicContact CG2-CG1 4.46Å; T75-I232 HydrophobicContact CG2-CG2 3.66Å; T75-I232 WeakPolarHBondContact OG1-CG2 3.15Å
76A96.7Very high94.4Very high0 Ų044.7 Ų44.70%024%0.24CC..Hα-helixtrans-58.9-46.1176.400000111.8M72 P73 G80 I93 L94 M229M72-A76 PolarHBondContact O-N 2.81Å; P73-A76 PolarHBondContact O-N 2.81Å; A76-G80 PolarHBondContact O-N 3.49Å; A76-I93 HydrophobicContact CB-CG1 4.45Å; A76-I93 WeakPolarHBondContact CB-O 3.14Å; A76-I93 WeakPolarHBondContact O-CD1 3.15Å; A76-L94 HydrophobicContact CB-CD1 4.23Å; A76-M229 HydrophobicContact CB-CE 3.6Å; A76-M229 HydrophobicContact CB-SD 4.22Å
77F96.4Very high94.2Very high46 Ų4643.9 Ų43.920%0.20223%0.232CC..Hα-helixtrans-64-47.2179.1178.2-102.5000112.6P73 L74 T75 G80 K81 L94 Y141 I145P73-F77 WeakPolarHBondContact O-CB 3.35Å; P73-F77 PolarHBondContact O-N 2.83Å; L74-F77 PolarHBondContact O-N 3.24Å; T75-F77 VanDerWaalsContact C-N 3.35Å; T75-F77 PolarHBondContact O-N 3.49Å; F77-G80 PolarHBondContact O-N 2.93Å; F77-K81 HydrophobicContact CE1-CG 4.33Å; F77-K81 HydrophobicContact CZ-CG 4.21Å; F77-K81 PolarHBondContact O-N 3.48Å; F77-L94 HydrophobicContact CB-CD1 4.44Å; F77-Y141 HydrophobicContact CB-CD1 3.5Å; F77-Y141 VanDerWaalsContact CB-CD1 3.5Å; F77-Y141 HydrophobicContact CB-CE1 3.81Å; F77-Y141 HydrophobicContact CB-CG 4.23Å; F77-Y141 AromaticContact CD1-CD1 3.84Å; F77-Y141 HydrophobicContact CD1-CD1 3.84Å; F77-Y141 HydrophobicContact CD1-CE1 4.03Å; F77-Y141 AromaticContact CD2-CD1 3.63Å; F77-Y141 HydrophobicContact CD2-CD1 3.63Å; F77-Y141 HydrophobicContact CD2-CG 4.28Å; F77-Y141 HydrophobicContact CE1-CD1 4.47Å; F77-Y141 HydrophobicContact CE2-CD1 4.28Å; F77-Y141 WeakPolarHBondContact CE2-O 3.35Å; F77-Y141 AromaticContact CG-CD1 3.36Å; F77-Y141 HydrophobicContact CG-CD1 3.36Å; F77-Y141 AromaticContact CG-CE1 3.89Å; F77-Y141 HydrophobicContact CG-CE1 3.89Å; F77-Y141 HydrophobicContact CG-CG 4.31Å; F77-I145 HydrophobicContact CD2-CD1 4.35Å; F77-I145 HydrophobicContact CD2-CG1 4.1Å; F77-I145 HydrophobicContact CE2-CG1 3.98Å
78V96.8Very high94Very high67 Ų6746.3 Ų46.341%0.40625%0.245SC..Hα-helixtrans-63.5-46.1179.7170.20000110.6L74 T75 G80 K81 V82L74-V78 HydrophobicContact CD1-CG2 4.06Å; L74-V78 HydrophobicContact CG-CG2 4.31Å; L74-V78 WeakPolarHBondContact O-CB 3.48Å; L74-V78 VanDerWaalsContact O-CG2 3.28Å; L74-V78 WeakPolarHBondContact O-CG2 3.33Å; L74-V78 PolarHBondContact O-N 3.42Å; T75-V78 PolarHBondContact O-N 3.18Å; V78-G80 VanDerWaalsContact C-N 3.31Å; V78-G80 PolarHBondContact O-N 3.33Å; V78-K81 PolarHBondContact O-N 3.18Å; V78-K81 VanDerWaalsContact O-N 3.16Å; V78-V82 HydrophobicContact CG1-CG2 3.98Å; V78-V82 WeakPolarHBondContact O-CB 3.42Å; V78-V82 VanDerWaalsContact O-CG2 3.28Å; V78-V82 WeakPolarHBondContact O-CG2 3.49Å; V78-V82 PolarHBondContact O-N 3.13Å
79L96.2Very high93.8Very high14 Ų1446.9 Ų46.97%0.07325%0.248CC..Hα-helixtrans-62.7-39.3176.8-70175000111.6T75 K81 V82 F83 T225 L228 M229 I232T75-L79 HydrophobicContact CG2-CD1 3.83Å; T75-L79 HydrophobicContact CG2-CG 4.34Å; T75-L79 WeakPolarHBondContact O-CB 3.28Å; T75-L79 VanDerWaalsContact O-CG 3.28Å; T75-L79 WeakPolarHBondContact O-CG 3.41Å; T75-L79 PolarHBondContact O-N 3.08Å; L79-K81 VanDerWaalsContact C-N 3.29Å; L79-K81 PolarHBondContact O-N 3.41Å; L79-V82 PolarHBondContact O-N 2.92Å; L79-F83 HydrophobicContact CB-CD2 4.36Å; L79-F83 HydrophobicContact CD2-CD2 4.43Å; L79-F83 HydrophobicContact CD2-CE2 3.87Å; L79-F83 HydrophobicContact CD2-CZ 4.4Å; L79-F83 WeakPolarHBondContact O-CB 3.28Å; L79-F83 PolarHBondContact O-N 3.42Å; L79-T225 HydrophobicContact CB-CG2 4.1Å; L79-T225 HydrophobicContact CD1-CG2 4.12Å; L79-L228 HydrophobicContact CD1-CB 3.99Å; L79-L228 HydrophobicContact CD2-CB 4.35Å; L79-L228 HydrophobicContact CD2-CD1 4.12Å; L79-M229 HydrophobicContact CD1-CB 4.46Å; L79-M229 HydrophobicContact CD1-CG 3.51Å; L79-I232 HydrophobicContact CD1-CD1 4.3Å; L79-I232 HydrophobicContact CD2-CD1 4.43Å
80G94.1Very high93.7Very high6 Ų646.6 Ų46.66%0.06225%0.248CC..Hα-helixtrans-58.3-39.6173.800000113.1A76 F77 V78 Q84 L85A76-G80 PolarHBondContact O-N 3.49Å; F77-G80 PolarHBondContact O-N 2.93Å; V78-G80 VanDerWaalsContact C-N 3.31Å; V78-G80 PolarHBondContact O-N 3.33Å; G80-Q84 PolarHBondContact O-N 2.82Å; G80-L85 PolarHBondContact O-N 2.7Å
81K93.2Very high93.5Very high112 Ų11245.1 Ų45.149%0.48723%0.233SC..Hα-helixtrans-75.1-45.5176.3-73.2-67.1-171.7-178.90113.2F77 V78 L79 F83 Q84 G144F77-K81 HydrophobicContact CE1-CG 4.33Å; F77-K81 HydrophobicContact CZ-CG 4.21Å; F77-K81 PolarHBondContact O-N 3.48Å; V78-K81 PolarHBondContact O-N 3.18Å; V78-K81 VanDerWaalsContact O-N 3.16Å; L79-K81 VanDerWaalsContact C-N 3.29Å; L79-K81 PolarHBondContact O-N 3.41Å; K81-F83 VanDerWaalsContact C-N 3.34Å; K81-F83 PolarHBondContact O-N 3.29Å; K81-Q84 PolarHBondContact O-N 2.82Å; K81-Q84 VanDerWaalsContact O-N 3.13Å; K81-G144 WeakPolarHBondContact CE-O 3.48Å; K81-G144 PolarHBondContact NZ-O 3.13Å
82V95.3Very high93.3Very high97 Ų9744.1 Ų44.159%0.58823%0.227SC*.Hα-helixtrans-63.5-41.9-178.1168.50000111V78 L79 Q84V78-V82 HydrophobicContact CG1-CG2 3.98Å; V78-V82 WeakPolarHBondContact O-CB 3.42Å; V78-V82 VanDerWaalsContact O-CG2 3.28Å; V78-V82 WeakPolarHBondContact O-CG2 3.49Å; V78-V82 PolarHBondContact O-N 3.13Å; L79-V82 PolarHBondContact O-N 2.92Å; V82-Q84 VanDerWaalsContact C-N 3.27Å; V82-Q84 PolarHBondContact O-N 3.16Å
83F93.4Very high93.3Very high50 Ų5044.1 Ų44.122%0.21923%0.228CC..THydrogen-bonded Turntrans-86.14.6176.9-65.5-38.6000114.1L79 K81 L85 L221 A224 T225 L228L79-F83 HydrophobicContact CB-CD2 4.36Å; L79-F83 HydrophobicContact CD2-CD2 4.43Å; L79-F83 HydrophobicContact CD2-CE2 3.87Å; L79-F83 HydrophobicContact CD2-CZ 4.4Å; L79-F83 WeakPolarHBondContact O-CB 3.28Å; L79-F83 PolarHBondContact O-N 3.42Å; K81-F83 VanDerWaalsContact C-N 3.34Å; K81-F83 PolarHBondContact O-N 3.29Å; F83-L85 HydrophobicContact CB-CD2 3.99Å; F83-L85 HydrophobicContact CB-CG 4.09Å; F83-L85 PolarHBondContact O-N 2.66Å; F83-L221 HydrophobicContact CB-CD2 4.15Å; F83-L221 HydrophobicContact CD1-CD2 4.23Å; F83-L221 HydrophobicContact CG-CD2 4.32Å; F83-A224 HydrophobicContact CE2-CB 4.16Å; F83-A224 HydrophobicContact CZ-CB 4.08Å; F83-T225 WeakPolarHBondContact CD2-OG1 3.29Å; F83-L228 HydrophobicContact CE2-CD1 3.91Å; F83-L228 HydrophobicContact CZ-CD1 3.6Å
84Q91.3Very high93.2Very high171 Ų17144.1 Ų44.180%0.79923%0.228SC*.THydrogen-bonded Turntrans49.443.5179.2-59.3-177.5-10.400112.3G80 K81 V82G80-Q84 PolarHBondContact O-N 2.82Å; K81-Q84 PolarHBondContact O-N 2.82Å; K81-Q84 VanDerWaalsContact O-N 3.13Å; V82-Q84 VanDerWaalsContact C-N 3.27Å; V82-Q84 PolarHBondContact O-N 3.16Å
85L88.9Confident93.1Very high13 Ų1340.1 Ų40.17%0.06821%0.206CC..  trans-65147.3180-62.6-172.8000110.3G80 F83 E89 A90 I93 L221 L222G80-L85 PolarHBondContact O-N 2.7Å; F83-L85 HydrophobicContact CB-CD2 3.99Å; F83-L85 HydrophobicContact CB-CG 4.09Å; F83-L85 PolarHBondContact O-N 2.66Å; L85-E89 HydrophobicContact CB-CB 3.93Å; L85-E89 HydrophobicContact CD1-CB 4.32Å; L85-A90 HydrophobicContact CB-CB 4.35Å; L85-I93 HydrophobicContact CD1-CD1 3.56Å; L85-I93 HydrophobicContact CD1-CG1 4.45Å; L85-I93 HydrophobicContact CD1-CG2 4.42Å; L85-L221 HydrophobicContact CD2-CB 3.83Å; L85-L221 HydrophobicContact CD2-CD1 4.28Å; L85-L222 HydrophobicContact CD1-CD2 4.44Å
86N89Confident93Very high107 Ų10739.5 Ų39.557%0.57220%0.203SC*.  trans-63.6157.4173.9-61.5-63.2000110.1I88 E89 A90N86-I88 PolarHBondContact O-N 2.95Å; N86-E89 HydrophobicContact CB-CG 4.4Å; N86-E89 WeakPolarHBondContact CB-OE2 3.5Å; N86-E89 PolarHBondContact N-OE2 3.04Å; N86-E89 PolarHBondContact ND2-OE2 2.87Å; N86-E89 WeakPolarHBondContact O-CB 3.46Å; N86-E89 PolarHBondContact O-N 3.42Å; N86-A90 PolarHBondContact O-N 3.42Å
87N88.7Confident93Very high74 Ų7439.5 Ų39.540%0.39620%0.203SC..Hα-helixtrans-57.6-33.4-172.6-62.3-16.2000113.9L91 I145 Y146N87-L91 VanDerWaalsContact O-CB 3.22Å; N87-L91 WeakPolarHBondContact O-CB 3.5Å; N87-L91 PolarHBondContact O-N 3.13Å; N87-I145 HydrophobicContact CB-CG2 3.96Å; N87-I145 PolarHBondContact OD1-O 3.44Å; N87-Y146 HydrophobicContact CB-CD1 3.84Å; N87-Y146 HydrophobicContact CB-CE1 3.3Å; N87-Y146 HydrophobicContact CB-CE2 4.32Å; N87-Y146 PolarHBondContact O-OH 3.31Å
88I87.4Confident92.9Very high52 Ų5237.3 Ų37.327%0.26719%0.193SC..Hα-helixtrans-72.2-41.6176.7-51.4-48.4000111.3N86 L91 A92 Y146 V278 I279 L282N86-I88 PolarHBondContact O-N 2.95Å; I88-L91 WeakPolarHBondContact O-CB 3.35Å; I88-L91 PolarHBondContact O-N 3.47Å; I88-A92 PolarHBondContact O-N 3.44Å; I88-Y146 WeakPolarHBondContact CD1-OH 3.48Å; I88-V278 HydrophobicContact CD1-CG1 3.67Å; I88-V278 HydrophobicContact CG1-CG1 4.44Å; I88-V278 HydrophobicContact CG2-CG1 4.37Å; I88-V278 WeakPolarHBondContact CG2-O 3.19Å; I88-I279 HydrophobicContact CG2-CD1 4.27Å; I88-L282 HydrophobicContact CB-CD1 4.18Å; I88-L282 HydrophobicContact CG2-CD1 3.48Å; I88-L282 VanDerWaalsContact CG2-CD1 3.48Å
89E90.2Very high92.8Very high13 Ų1334.1 Ų34.16%0.06117%0.174CC..Hα-helixtrans-64.6-47.7177.4-66.6171.9137.800110.5L85 N86 L91 A92 I93 L222 L282L85-E89 HydrophobicContact CB-CB 3.93Å; L85-E89 HydrophobicContact CD1-CB 4.32Å; N86-E89 HydrophobicContact CB-CG 4.4Å; N86-E89 WeakPolarHBondContact CB-OE2 3.5Å; N86-E89 PolarHBondContact N-OE2 3.04Å; N86-E89 PolarHBondContact ND2-OE2 2.87Å; N86-E89 WeakPolarHBondContact O-CB 3.46Å; N86-E89 PolarHBondContact O-N 3.42Å; E89-L91 VanDerWaalsContact C-N 3.27Å; E89-L91 PolarHBondContact O-N 3.49Å; E89-A92 PolarHBondContact O-N 3.31Å; E89-A92 VanDerWaalsContact O-N 3.12Å; E89-I93 WeakPolarHBondContact O-CG2 3.43Å; E89-I93 PolarHBondContact O-N 2.94Å; E89-L222 HydrophobicContact CB-CD2 4.34Å; E89-L282 HydrophobicContact CG-CD1 4.01Å; E89-L282 HydrophobicContact CG-CD2 4.05Å
90A92.2Very high92.7Very high6 Ų633.4 Ų33.45%0.0517%0.17CC..Hα-helixtrans-58-39.9175.100000111.7L85 N86 I93 L94 I145L85-A90 HydrophobicContact CB-CB 4.35Å; N86-A90 PolarHBondContact O-N 3.42Å; A90-I93 WeakPolarHBondContact O-CG1 3.21Å; A90-L94 WeakPolarHBondContact O-CB 3.3Å; A90-L94 PolarHBondContact O-N 3.41Å; A90-I145 HydrophobicContact CB-CD1 3.96Å; A90-I145 HydrophobicContact CB-CG1 4.33Å; A90-I145 HydrophobicContact CB-CG2 4.02Å
91L91.7Very high92.5Very high0 Ų033.1 Ų33.10%017%0.167CC..Hα-helixtrans-65.9-43.1174.8178.864.1000112N87 I88 E89 L94 V95 L138 T142 V154 F274N87-L91 VanDerWaalsContact O-CB 3.22Å; N87-L91 WeakPolarHBondContact O-CB 3.5Å; N87-L91 PolarHBondContact O-N 3.13Å; I88-L91 WeakPolarHBondContact O-CB 3.35Å; I88-L91 PolarHBondContact O-N 3.47Å; E89-L91 VanDerWaalsContact C-N 3.27Å; E89-L91 PolarHBondContact O-N 3.49Å; L91-L94 PolarHBondContact O-N 3.42Å; L91-V95 HydrophobicContact CD1-CG2 4.4Å; L91-V95 VanDerWaalsContact O-CG2 3.29Å; L91-V95 WeakPolarHBondContact O-CG2 3.27Å; L91-V95 PolarHBondContact O-N 3.38Å; L91-L138 HydrophobicContact CD1-CD2 4.34Å; L91-T142 HydrophobicContact CD1-CG2 3.89Å; L91-V154 HydrophobicContact CD1-CG2 4.08Å; L91-V154 HydrophobicContact CD2-CG2 4.49Å; L91-F274 HydrophobicContact CD1-CZ 4.42Å; L91-F274 HydrophobicContact CD2-CD1 4.31Å; L91-F274 HydrophobicContact CD2-CE1 3.65Å; L91-F274 HydrophobicContact CD2-CZ 4.22Å; L91-F274 HydrophobicContact CG-CE1 4.28Å; L91-F274 HydrophobicContact CG-CZ 4.37Å
92A92.5Very high92.2Very high0 Ų028 Ų280%015%0.145CC..Hα-helixtrans-63.4-44.8-179.800000112.2I88 E89 L94 V95 C96 L270 L282I88-A92 PolarHBondContact O-N 3.44Å; E89-A92 PolarHBondContact O-N 3.31Å; E89-A92 VanDerWaalsContact O-N 3.12Å; A92-L94 VanDerWaalsContact C-N 3.31Å; A92-L94 PolarHBondContact O-N 3.1Å; A92-V95 PolarHBondContact O-N 2.89Å; A92-C96 PolarHBondContact O-N 2.91Å; A92-L270 HydrophobicContact CB-CD1 4.38Å; A92-L270 HydrophobicContact CB-CD2 4.23Å; A92-L282 HydrophobicContact CB-CB 3.94Å; A92-L282 HydrophobicContact CB-CD1 4.33Å
93I94.8Very high91.7Very high1 Ų125.7 Ų25.71%0.00513%0.13CC..Hα-helixtrans-68.3-33.117670.4171000111.7A76 L85 E89 A90 C96 G97 L222 T225 M229 F285A76-I93 HydrophobicContact CB-CG1 4.45Å; A76-I93 WeakPolarHBondContact CB-O 3.14Å; A76-I93 WeakPolarHBondContact O-CD1 3.15Å; L85-I93 HydrophobicContact CD1-CD1 3.56Å; L85-I93 HydrophobicContact CD1-CG1 4.45Å; L85-I93 HydrophobicContact CD1-CG2 4.42Å; E89-I93 WeakPolarHBondContact O-CG2 3.43Å; E89-I93 PolarHBondContact O-N 2.94Å; A90-I93 WeakPolarHBondContact O-CG1 3.21Å; I93-C96 WeakPolarHBondContact O-CB 3.28Å; I93-C96 PolarHBondContact O-N 2.84Å; I93-G97 PolarHBondContact O-N 3.3Å; I93-L222 HydrophobicContact CG2-CD2 4.3Å; I93-T225 HydrophobicContact CB-CG2 4.32Å; I93-T225 HydrophobicContact CD1-CG2 3.76Å; I93-T225 HydrophobicContact CG2-CG2 4.01Å; I93-M229 HydrophobicContact CB-SD 4.12Å; I93-F285 HydrophobicContact CB-CE1 4.03Å; I93-F285 HydrophobicContact CB-CZ 3.95Å; I93-F285 HydrophobicContact CG2-CD1 4.13Å; I93-F285 HydrophobicContact CG2-CD2 3.95Å; I93-F285 HydrophobicContact CG2-CE1 3.71Å; I93-F285 HydrophobicContact CG2-CE2 3.48Å; I93-F285 VanDerWaalsContact CG2-CE2 3.48Å; I93-F285 HydrophobicContact CG2-CG 4.25Å; I93-F285 HydrophobicContact CG2-CZ 3.35Å
94L95.3Very high91.5Very high0 Ų025.8 Ų25.80%013%0.133CC..Hα-helixtrans-69.2-41177.5-176.767.8000111.5A76 F77 A90 L91 A92 C96 G97 C98 L138 Y141 T142 I145A76-L94 HydrophobicContact CB-CD1 4.23Å; F77-L94 HydrophobicContact CB-CD1 4.44Å; A90-L94 WeakPolarHBondContact O-CB 3.3Å; A90-L94 PolarHBondContact O-N 3.41Å; L91-L94 PolarHBondContact O-N 3.42Å; A92-L94 VanDerWaalsContact C-N 3.31Å; A92-L94 PolarHBondContact O-N 3.1Å; L94-C96 PolarHBondContact O-N 2.82Å; L94-G97 PolarHBondContact O-N 2.97Å; L94-G97 VanDerWaalsContact O-N 3.16Å; L94-C98 WeakPolarHBondContact O-CB 3.33Å; L94-C98 PolarHBondContact O-N 2.96Å; L94-C98 PolarHBondContact O-SG 2.88Å; L94-L138 HydrophobicContact CB-CD2 4.43Å; L94-L138 HydrophobicContact CD2-CD2 3.82Å; L94-L138 HydrophobicContact CG-CD2 3.81Å; L94-Y141 HydrophobicContact CD1-CD2 4.17Å; L94-Y141 HydrophobicContact CD1-CG 4.08Å; L94-T142 HydrophobicContact CD2-CG2 4.01Å; L94-I145 HydrophobicContact CD2-CD1 3.83Å
95V94.5Very high91.5Very high0 Ų017.7 Ų17.70%010%0.095CC..Hα-helixtrans-57.2-39.2171170.20000110.5L91 A92 S99 M134 L138 I269 L270 F274L91-V95 HydrophobicContact CD1-CG2 4.4Å; L91-V95 VanDerWaalsContact O-CG2 3.29Å; L91-V95 WeakPolarHBondContact O-CG2 3.27Å; L91-V95 PolarHBondContact O-N 3.38Å; A92-V95 PolarHBondContact O-N 2.89Å; V95-S99 PolarHBondContact O-N 3.31Å; V95-S99 PolarHBondContact O-OG 3.48Å; V95-M134 HydrophobicContact CB-CE 4.37Å; V95-M134 HydrophobicContact CG1-CE 3.59Å; V95-M134 WeakPolarHBondContact O-CE 3.43Å; V95-L138 HydrophobicContact CG2-CD1 4.24Å; V95-L138 HydrophobicContact CG2-CD2 3.85Å; V95-I269 HydrophobicContact CG1-CB 4.37Å; V95-I269 HydrophobicContact CG1-CG2 3.88Å; V95-L270 HydrophobicContact CB-CD2 3.97Å; V95-L270 HydrophobicContact CG1-CD2 3.89Å; V95-L270 HydrophobicContact CG1-CG 4.01Å; V95-L270 HydrophobicContact CG2-CD2 4.1Å; V95-F274 HydrophobicContact CG2-CE2 4.04Å; V95-F274 HydrophobicContact CG2-CZ 4.05Å
96C95.1Very high91.6Very high0 Ų017.9 Ų17.90%010%0.096CC..Hα-helixtrans-65.9-46.2174.3-163.70000112.3A92 I93 L94 C98 S99 C266 F285A92-C96 PolarHBondContact O-N 2.91Å; I93-C96 WeakPolarHBondContact O-CB 3.28Å; I93-C96 PolarHBondContact O-N 2.84Å; L94-C96 PolarHBondContact O-N 2.82Å; C96-C98 VanDerWaalsContact C-N 3.33Å; C96-C98 PolarHBondContact O-N 3.42Å; C96-S99 VanDerWaalsContact O-CB 3.26Å; C96-S99 WeakPolarHBondContact O-CB 3.49Å; C96-S99 PolarHBondContact O-N 3.39Å; C96-S99 PolarHBondContact O-OG 3.24Å; C96-C266 WeakPolarHBondContact CA-SG 3.49Å; C96-C266 VanDerWaalsContact CB-SG 3.55Å; C96-C266 PolarHBondContact N-SG 2.83Å; C96-F285 HydrophobicContact CB-CD1 4.17Å; C96-F285 HydrophobicContact CB-CE1 3.83Å
97G95.7Very high91.8Very high0 Ų017 Ų170%09%0.094CC..Hα-helixtrans-67.1-29.3177.900000114.3M72 P73 I93 L94 S99M72-G97 WeakPolarHBondContact CB-O 3.31Å; P73-G97 WeakPolarHBondContact CD-O 3.38Å; P73-G97 WeakPolarHBondContact CG-O 3.32Å; I93-G97 PolarHBondContact O-N 3.3Å; L94-G97 PolarHBondContact O-N 2.97Å; L94-G97 VanDerWaalsContact O-N 3.16Å; G97-S99 VanDerWaalsContact C-N 3.29Å
98C95.1Very high92.1Very high0 Ų013.8 Ų13.80%08%0.077CC..THydrogen-bonded Turntrans-83.4-2.1175.1-64.70000113.8L94 C96 M134 L138L94-C98 WeakPolarHBondContact O-CB 3.33Å; L94-C98 PolarHBondContact O-N 2.96Å; L94-C98 PolarHBondContact O-SG 2.88Å; C96-C98 VanDerWaalsContact C-N 3.33Å; C96-C98 PolarHBondContact O-N 3.42Å; C98-M134 HydrophobicContact CB-CB 4.49Å; C98-M134 HydrophobicContact CB-CG 3.9Å; C98-L138 HydrophobicContact CB-CG 4.49Å
99S94.1Very high92.4Very high0 Ų011.3 Ų11.30%06%0.064CC..SBendtrans-70154.3176.5-66.60000110.9Q68 V95 C96 G97 Q261Q68-S99 PolarHBondContact NE2-O 2.86Å; V95-S99 PolarHBondContact O-N 3.31Å; V95-S99 PolarHBondContact O-OG 3.48Å; C96-S99 VanDerWaalsContact O-CB 3.26Å; C96-S99 WeakPolarHBondContact O-CB 3.49Å; C96-S99 PolarHBondContact O-N 3.39Å; C96-S99 PolarHBondContact O-OG 3.24Å; G97-S99 VanDerWaalsContact C-N 3.29Å; S99-Q261 VanDerWaalsContact C-OE1 3.27Å; S99-Q261 PolarHBondContact O-OE1 3.02Å
100P94.3Very high92.5Very high0 Ų015.6 Ų15.60%09%0.087CC..PPolyproline II helixtrans-71.9170.6171.431.4-34.6000111.1A130 Q261 N262 L265P100-A130 HydrophobicContact CB-CB 4.27Å; P100-A130 HydrophobicContact CG-CB 4.08Å; P100-Q261 PolarHBondContact O-OE1 2.92Å; P100-N262 HydrophobicContact CG-CB 4.22Å; P100-N262 VanDerWaalsContact O-CB 3.23Å; P100-N262 WeakPolarHBondContact O-CB 3.48Å; P100-N262 PolarHBondContact O-N 2.83Å; P100-L265 HydrophobicContact CG-CD1 3.92Å
101G90.2Very high92.6Very high0 Ų016.5 Ų16.50%09%0.094CC..BIsolated β-bridgetrans-56.5149.7175.400000112.2T123 S126 C260G101-T123 WeakPolarHBondContact O-CG2 3.39Å; G101-S126 PolarHBondContact N-OG 3.5Å; G101-C260 WeakPolarHBondContact CA-O 3.33Å
102G86.7Confident92.7Very high3 Ų317.2 Ų17.23%0.03110%0.098CC..  trans-105.4154.5-177.900000113.8L104 S105 C260G102-L104 PolarHBondContact O-N 3.08Å; G102-S105 WeakPolarHBondContact O-CB 3.36Å; G102-S105 PolarHBondContact O-N 2.74Å; G102-S105 PolarHBondContact O-OG 3.49Å; G102-C260 PolarHBondContact N-O 2.88Å
103N84.3Confident92.7Very high50 Ų5021.7 Ų21.727%0.26712%0.117SC..THydrogen-bonded Turntrans-55.8-22-178.4-63.1-5.5000115.1L42 S105 N106L42-N103 WeakPolarHBondContact CD1-OD1 3.39Å; N103-S105 PolarHBondContact O-N 3.16Å; N103-N106 WeakPolarHBondContact O-CB 3.48Å; N103-N106 PolarHBondContact O-N 2.93Å
104L89.1Confident92.5Very high52 Ų5222.3 Ų22.327%0.27212%0.124SC..Hα-helixtrans-64.3-30175.6-71.2173.8000112.2G102 N106 V107 F108 Q293G102-L104 PolarHBondContact O-N 3.08Å; L104-N106 PolarHBondContact O-N 3.43Å; L104-V107 PolarHBondContact O-N 2.95Å; L104-F108 PolarHBondContact O-N 2.75Å; L104-Q293 HydrophobicContact CD1-CG 4.45Å
105S91.6Very high92.3Very high0 Ų024 Ų240%013%0.133CC..Hα-helixtrans-57.8-38.7175.668.80000111.5G102 N103 V107 F108 S109 T123 E257G102-S105 WeakPolarHBondContact O-CB 3.36Å; G102-S105 PolarHBondContact O-N 2.74Å; G102-S105 PolarHBondContact O-OG 3.49Å; N103-S105 PolarHBondContact O-N 3.16Å; S105-V107 VanDerWaalsContact C-N 3.34Å; S105-V107 PolarHBondContact O-N 2.79Å; S105-F108 PolarHBondContact O-N 2.82Å; S105-S109 WeakPolarHBondContact O-CB 3.28Å; S105-S109 PolarHBondContact O-N 2.97Å; S105-S109 PolarHBondContact O-OG 3.49Å; S105-T123 PolarHBondContact OG-OG1 2.96Å; S105-E257 WeakPolarHBondContact CB-OE2 3.44Å; S105-E257 PolarHBondContact OG-OE2 2.96Å
106N92.1Very high92Very high18 Ų1827.6 Ų27.610%0.09615%0.15CC..Hα-helixtrans-62.6-42.5179.9-64.8-35.5000111.6N103 L104 L110 S119 I120N103-N106 WeakPolarHBondContact O-CB 3.48Å; N103-N106 PolarHBondContact O-N 2.93Å; L104-N106 PolarHBondContact O-N 3.43Å; N106-L110 PolarHBondContact O-N 3.44Å; N106-L110 VanDerWaalsContact O-N 3.11Å; N106-S119 VanDerWaalsContact OD1-CB 3.26Å; N106-S119 WeakPolarHBondContact OD1-CB 3.48Å; N106-S119 PolarHBondContact OD1-OG 3.23Å; N106-S119 VanDerWaalsContact OD1-OG 3.12Å; N106-I120 PolarHBondContact OD1-N 3.14Å
107V92Very high91.7Very high88 Ų8830.3 Ų30.353%0.53317%0.165SC..Hα-helixtrans-69.2-44.5178.9-179.40000110.4L104 S105 L110 A111L104-V107 PolarHBondContact O-N 2.95Å; S105-V107 VanDerWaalsContact C-N 3.34Å; S105-V107 PolarHBondContact O-N 2.79Å; V107-L110 PolarHBondContact O-N 3.42Å; V107-A111 WeakPolarHBondContact O-CB 3.3Å; V107-A111 PolarHBondContact O-N 3.44Å
108F94.9Very high91.3Very high7 Ų730.6 Ų30.63%0.03117%0.167CC..Hα-helixtrans-68.5-40.5178.8-67.8-16000112.8L104 S105 L110 A111 M112 M256 C260 Q293 L294 L298 I301L104-F108 PolarHBondContact O-N 2.75Å; S105-F108 PolarHBondContact O-N 2.82Å; F108-L110 VanDerWaalsContact C-N 3.29Å; F108-L110 PolarHBondContact O-N 3.01Å; F108-A111 PolarHBondContact O-N 2.84Å; F108-A111 VanDerWaalsContact O-N 3.17Å; F108-M112 VanDerWaalsContact O-CB 3.3Å; F108-M112 WeakPolarHBondContact O-CB 3.43Å; F108-M112 VanDerWaalsContact O-CG 3.22Å; F108-M112 WeakPolarHBondContact O-CG 3.28Å; F108-M112 PolarHBondContact O-N 3.27Å; F108-M256 HydrophobicContact CB-CB 4.19Å; F108-M256 HydrophobicContact CB-CG 3.9Å; F108-M256 HydrophobicContact CB-SD 3.69Å; F108-M256 HydrophobicContact CD2-SD 4.25Å; F108-M256 HydrophobicContact CG-SD 4.38Å; F108-C260 VanDerWaalsContact CD2-SG 3.57Å; F108-Q293 WeakPolarHBondContact CE2-O 3.06Å; F108-L294 HydrophobicContact CZ-CD1 4.02Å; F108-L298 HydrophobicContact CE1-CD2 4.42Å; F108-I301 HydrophobicContact CB-CD1 4.4Å; F108-I301 HydrophobicContact CD1-CD1 3.55Å; F108-I301 HydrophobicContact CE1-CD1 4.03Å; F108-I301 HydrophobicContact CG-CD1 4.16Å
109S94.1Very high91.1Very high0 Ų030.6 Ų30.60%017%0.167CC..Hα-helixtrans-54.7-46.9171-73.20000110.7S105 M112 K113 G114 S119S105-S109 WeakPolarHBondContact O-CB 3.28Å; S105-S109 PolarHBondContact O-N 2.97Å; S105-S109 PolarHBondContact O-OG 3.49Å; S109-M112 PolarHBondContact O-N 3.17Å; S109-K113 PolarHBondContact O-N 3.39Å; S109-G114 WeakPolarHBondContact O-CA 3.31Å; S109-G114 PolarHBondContact O-N 2.9Å; S109-S119 PolarHBondContact OG-OG 3.23Å; S109-S119 VanDerWaalsContact OG-OG 3.08Å
110L92.9Very high90.9Very high102 Ų10231.4 Ų31.453%0.53417%0.171SC..Hα-helixtrans-63.1-46.3175.6-178.464.1000112.1N106 V107 F108 M112 K113 M116N106-L110 PolarHBondContact O-N 3.44Å; N106-L110 VanDerWaalsContact O-N 3.11Å; V107-L110 PolarHBondContact O-N 3.42Å; F108-L110 VanDerWaalsContact C-N 3.29Å; F108-L110 PolarHBondContact O-N 3.01Å; L110-M112 VanDerWaalsContact C-N 3.26Å; L110-M112 PolarHBondContact O-N 2.9Å; L110-K113 PolarHBondContact O-N 3.31Å; L110-M116 HydrophobicContact CB-SD 4.36Å; L110-M116 HydrophobicContact CD1-SD 4.13Å; L110-M116 HydrophobicContact CD2-SD 4.17Å; L110-M116 HydrophobicContact CG-SD 4.46Å
111A93.7Very high90.7Very high25 Ų2531.4 Ų31.421%0.20717%0.171CC..Hα-helixtrans-63.2-31.9-179.300000113V107 F108 K113 I301 R305V107-A111 WeakPolarHBondContact O-CB 3.3Å; V107-A111 PolarHBondContact O-N 3.44Å; F108-A111 PolarHBondContact O-N 2.84Å; F108-A111 VanDerWaalsContact O-N 3.17Å; A111-K113 VanDerWaalsContact C-N 3.26Å; A111-K113 PolarHBondContact O-N 3.11Å; A111-I301 HydrophobicContact CB-CD1 3.57Å; A111-I301 HydrophobicContact CB-CG1 3.93Å; A111-I301 HydrophobicContact CB-CG2 4.2Å; A111-R305 PolarHBondContact O-NE 3.32Å; A111-R305 PolarHBondContact O-NH2 2.77Å
112M93.3Very high90.7Very high15 Ų1531.5 Ų31.57%0.07417%0.171CC..THydrogen-bonded Turntrans-83.48.2174.9-68.7-66.9-78.400113.6F108 S109 L110 G114 R252 M256 I301 F304F108-M112 VanDerWaalsContact O-CB 3.3Å; F108-M112 WeakPolarHBondContact O-CB 3.43Å; F108-M112 VanDerWaalsContact O-CG 3.22Å; F108-M112 WeakPolarHBondContact O-CG 3.28Å; F108-M112 PolarHBondContact O-N 3.27Å; S109-M112 PolarHBondContact O-N 3.17Å; L110-M112 VanDerWaalsContact C-N 3.26Å; L110-M112 PolarHBondContact O-N 2.9Å; M112-G114 PolarHBondContact O-N 2.69Å; M112-G114 VanDerWaalsContact O-N 3.16Å; M112-R252 HydrophobicContact CB-CB 4.38Å; M112-R252 WeakPolarHBondContact O-CD 3.39Å; M112-R252 PolarHBondContact O-NE 3.24Å; M112-M256 HydrophobicContact CE-CE 3.81Å; M112-M256 HydrophobicContact CG-CE 3.51Å; M112-M256 HydrophobicContact CG-CG 4.32Å; M112-M256 HydrophobicContact CG-SD 4.48Å; M112-M256 HydrophobicContact SD-CE 3.96Å; M112-I301 HydrophobicContact CG-CG1 3.85Å; M112-I301 WeakPolarHBondContact SD-CA 3.34Å; M112-I301 HydrophobicContact SD-CB 4.16Å; M112-I301 HydrophobicContact SD-CG1 3.7Å; M112-F304 HydrophobicContact CE-CB 3.47Å; M112-F304 VanDerWaalsContact CE-CB 3.47Å; M112-F304 HydrophobicContact CE-CD1 4.36Å; M112-F304 HydrophobicContact CE-CD2 4.14Å; M112-F304 HydrophobicContact CE-CG 3.74Å; M112-F304 WeakPolarHBondContact O-CE1 3.29Å; M112-F304 WeakPolarHBondContact O-CZ 3.47Å; M112-F304 HydrophobicContact SD-CB 3.54Å; M112-F304 VanDerWaalsContact SD-CB 3.54Å; M112-F304 HydrophobicContact SD-CD1 3.95Å; M112-F304 HydrophobicContact SD-CG 3.84Å
113K93.1Very high90.9Very high95 Ų9531.4 Ų31.441%0.41317%0.17SC..THydrogen-bonded Turntrans52.933.2-172.2-56.2178.8178.3171.60112.5S109 L110 A111 R252 F304 E308S109-K113 PolarHBondContact O-N 3.39Å; L110-K113 PolarHBondContact O-N 3.31Å; A111-K113 VanDerWaalsContact C-N 3.26Å; A111-K113 PolarHBondContact O-N 3.11Å; K113-R252 PolarHBondContact O-NH2 2.87Å; K113-F304 HydrophobicContact CB-CE1 4.34Å; K113-F304 HydrophobicContact CB-CZ 4.48Å; K113-F304 HydrophobicContact CD-CE1 4.22Å; K113-F304 HydrophobicContact CD-CZ 4.46Å; K113-F304 HydrophobicContact CG-CE1 4.21Å; K113-E308 WeakPolarHBondContact CE-OE2 3.21Å; K113-E308 IonicContact NZ-OE1 2.78Å; K113-E308 PolarHBondContact NZ-OE1 2.85Å; K113-E308 IonicContact NZ-OE2 3.34Å; K113-E308 PolarHBondContact NZ-OE2 2.9Å
114G91.3Very high91.1Very high14 Ų1429.1 Ų29.114%0.14416%0.158CC..  trans-74.4-175.2172.700000111.9S109 M112 R249S109-G114 WeakPolarHBondContact O-CA 3.31Å; S109-G114 PolarHBondContact O-N 2.9Å; M112-G114 PolarHBondContact O-N 2.69Å; M112-G114 VanDerWaalsContact O-N 3.16Å; G114-R249 WeakPolarHBondContact CA-O 3.41Å
115D90.7Very high91.2Very high36 Ų3627.7 Ų27.719%0.19315%0.152CC..  trans-86.6106169.3-170.1-30.1000109.9N117 L118 S119 T253D115-N117 WeakPolarHBondContact OD1-CB 3.25Å; D115-N117 PolarHBondContact OD1-N 2.94Å; D115-L118 HydrophobicContact CB-CB 3.74Å; D115-L118 HydrophobicContact CB-CD2 4.36Å; D115-L118 PolarHBondContact OD1-N 3.37Å; D115-S119 PolarHBondContact O-N 3.46Å; D115-T253 WeakPolarHBondContact CA-OG1 3.48Å; D115-T253 PolarHBondContact N-OG1 3.47Å; D115-T253 VanDerWaalsContact O-CG2 3.28Å; D115-T253 WeakPolarHBondContact O-CG2 3.15Å; D115-T253 PolarHBondContact O-OG1 3.46Å
116M87.8Confident91.2Very high74 Ų7427.8 Ų27.837%0.36515%0.153SC..Hα-helixtrans-70.8-33179.6-174.6-179.768.400112.4L110 L118 S119 I120L110-M116 HydrophobicContact CB-SD 4.36Å; L110-M116 HydrophobicContact CD1-SD 4.13Å; L110-M116 HydrophobicContact CD2-SD 4.17Å; L110-M116 HydrophobicContact CG-SD 4.46Å; M116-L118 VanDerWaalsContact C-N 3.29Å; M116-L118 PolarHBondContact O-N 3.43Å; M116-S119 PolarHBondContact O-N 2.9Å; M116-I120 HydrophobicContact CG-CD1 4.1Å; M116-I120 WeakPolarHBondContact O-CG1 3.35Å; M116-I120 PolarHBondContact O-N 2.94Å; M116-I120 VanDerWaalsContact O-N 3.1Å
117N88.1Confident91.2Very high57 Ų5727 Ų2731%0.30515%0.149SC..Hα-helixtrans-66.6-40.1178.3-65-38000110.1K50 D115 I120 V121K50-N117 HydrophobicContact CD-CB 4.37Å; K50-N117 WeakPolarHBondContact CD-OD1 3.21Å; K50-N117 VanDerWaalsContact CE-OD1 3.24Å; K50-N117 WeakPolarHBondContact CE-OD1 3.48Å; K50-N117 PolarHBondContact NZ-OD1 3.44Å; D115-N117 WeakPolarHBondContact OD1-CB 3.25Å; D115-N117 PolarHBondContact OD1-N 2.94Å; N117-I120 PolarHBondContact O-N 3.26Å; N117-V121 WeakPolarHBondContact O-CG2 3.23Å; N117-V121 PolarHBondContact O-N 3.33Å; N117-V121 VanDerWaalsContact O-N 3.1Å
118L88.3Confident91.1Very high7 Ų726.8 Ų26.84%0.03714%0.141CC..Hα-helixtrans-62.6-43.6175.1-173.763000111.5D115 M116 V121 M122 C250 T253D115-L118 HydrophobicContact CB-CB 3.74Å; D115-L118 HydrophobicContact CB-CD2 4.36Å; D115-L118 PolarHBondContact OD1-N 3.37Å; M116-L118 VanDerWaalsContact C-N 3.29Å; M116-L118 PolarHBondContact O-N 3.43Å; L118-V121 PolarHBondContact O-N 2.93Å; L118-M122 HydrophobicContact CD1-CE 3.48Å; L118-M122 VanDerWaalsContact CD1-CE 3.48Å; L118-M122 HydrophobicContact CD1-CG 4.47Å; L118-M122 HydrophobicContact CD1-SD 4.44Å; L118-M122 HydrophobicContact CD2-CE 3.52Å; L118-M122 HydrophobicContact CG-CE 3.26Å; L118-M122 HydrophobicContact CG-CG 4.45Å; L118-M122 HydrophobicContact CG-SD 3.92Å; L118-M122 WeakPolarHBondContact O-CB 3.44Å; L118-M122 WeakPolarHBondContact O-CG 3.39Å; L118-M122 PolarHBondContact O-N 3.3Å; L118-C250 HydrophobicContact CD2-CB 3.69Å; L118-T253 HydrophobicContact CB-CG2 4.13Å; L118-T253 HydrophobicContact CD2-CG2 4.27Å; L118-T253 HydrophobicContact CG-CG2 4.15Å
119S91.3Very high91Very high0 Ų028.8 Ų28.80%016%0.155CC..Hα-helixtrans-56.8-52.6176.7-151.60000110.9N106 S109 D115 M116 V121 M122 T123 E257N106-S119 VanDerWaalsContact OD1-CB 3.26Å; N106-S119 WeakPolarHBondContact OD1-CB 3.48Å; N106-S119 PolarHBondContact OD1-OG 3.23Å; N106-S119 VanDerWaalsContact OD1-OG 3.12Å; S109-S119 PolarHBondContact OG-OG 3.23Å; S109-S119 VanDerWaalsContact OG-OG 3.08Å; D115-S119 PolarHBondContact O-N 3.46Å; M116-S119 PolarHBondContact O-N 2.9Å; S119-V121 VanDerWaalsContact C-N 3.31Å; S119-V121 PolarHBondContact O-N 3.29Å; S119-M122 WeakPolarHBondContact O-CB 3.08Å; S119-M122 PolarHBondContact O-N 3.36Å; S119-M122 VanDerWaalsContact O-N 3.08Å; S119-T123 PolarHBondContact O-N 3.35Å; S119-T123 PolarHBondContact O-OG1 3.41Å; S119-E257 PolarHBondContact OG-OE2 3.44Å
120I88.8Confident90.8Very high16 Ų1628.8 Ų28.88%0.08216%0.155CC..Hα-helixtrans-61.1-40.4-177.7-62.8166.3000111.2M46 N106 M116 N117 T124M46-I120 HydrophobicContact CB-CG2 4.18Å; M46-I120 HydrophobicContact CE-CG2 3.87Å; M46-I120 WeakPolarHBondContact CE-O 3.33Å; M46-I120 HydrophobicContact CG-CG2 4.48Å; M46-I120 HydrophobicContact SD-CG2 3.66Å; N106-I120 PolarHBondContact OD1-N 3.14Å; M116-I120 HydrophobicContact CG-CD1 4.1Å; M116-I120 WeakPolarHBondContact O-CG1 3.35Å; M116-I120 PolarHBondContact O-N 2.94Å; M116-I120 VanDerWaalsContact O-N 3.1Å; N117-I120 PolarHBondContact O-N 3.26Å; I120-T124 WeakPolarHBondContact O-CB 3.33Å; I120-T124 PolarHBondContact O-N 3.43Å; I120-T124 PolarHBondContact O-OG1 2.94Å
121V89.4Confident90.8Very high0 Ų026.9 Ų26.90%015%0.145CC..Hα-helixtrans-65-45.1174.7173.20000111.5M46 H54 L61 N117 L118 S119 T124 C125M46-V121 HydrophobicContact CE-CB 4.27Å; M46-V121 HydrophobicContact CE-CG2 3.79Å; H54-V121 HydrophobicContact CB-CB 4.41Å; H54-V121 HydrophobicContact CB-CG1 3.94Å; H54-V121 HydrophobicContact CB-CG2 4.17Å; L61-V121 HydrophobicContact CD1-CG1 4.14Å; L61-V121 HydrophobicContact CD2-CG1 4.27Å; N117-V121 WeakPolarHBondContact O-CG2 3.23Å; N117-V121 PolarHBondContact O-N 3.33Å; N117-V121 VanDerWaalsContact O-N 3.1Å; L118-V121 PolarHBondContact O-N 2.93Å; S119-V121 VanDerWaalsContact C-N 3.31Å; S119-V121 PolarHBondContact O-N 3.29Å; V121-T124 PolarHBondContact O-N 3.45Å; V121-C125 VanDerWaalsContact O-CB 3.26Å; V121-C125 WeakPolarHBondContact O-CB 3.32Å; V121-C125 PolarHBondContact O-N 3.25Å; V121-C125 PolarHBondContact O-SG 3.19Å; V121-C125 VanDerWaalsContact O-SG 3.33Å
122M90.3Very high90.6Very high3 Ų328 Ų282%0.01516%0.158CC..Hα-helixtrans-60.7-46.4177.1-68.9168.9173.300111.9G60 L61 A64 L118 S119 T124 C125 S126 T253 V254 E257G60-M122 VanDerWaalsContact O-CE 3.28Å; G60-M122 WeakPolarHBondContact O-CE 3.16Å; L61-M122 HydrophobicContact CD1-CG 4.21Å; A64-M122 HydrophobicContact CB-CB 4.26Å; A64-M122 HydrophobicContact CB-CE 3.36Å; A64-M122 HydrophobicContact CB-CG 3.55Å; A64-M122 HydrophobicContact CB-SD 3.35Å; A64-M122 WeakPolarHBondContact CB-SD 3.32Å; L118-M122 HydrophobicContact CD1-CE 3.48Å; L118-M122 VanDerWaalsContact CD1-CE 3.48Å; L118-M122 HydrophobicContact CD1-CG 4.47Å; L118-M122 HydrophobicContact CD1-SD 4.44Å; L118-M122 HydrophobicContact CD2-CE 3.52Å; L118-M122 HydrophobicContact CG-CE 3.26Å; L118-M122 HydrophobicContact CG-CG 4.45Å; L118-M122 HydrophobicContact CG-SD 3.92Å; L118-M122 WeakPolarHBondContact O-CB 3.44Å; L118-M122 WeakPolarHBondContact O-CG 3.39Å; L118-M122 PolarHBondContact O-N 3.3Å; S119-M122 WeakPolarHBondContact O-CB 3.08Å; S119-M122 PolarHBondContact O-N 3.36Å; S119-M122 VanDerWaalsContact O-N 3.08Å; M122-T124 VanDerWaalsContact C-N 3.35Å; M122-T124 PolarHBondContact O-N 2.93Å; M122-C125 PolarHBondContact O-N 2.78Å; M122-S126 VanDerWaalsContact O-CB 3.24Å; M122-S126 WeakPolarHBondContact O-CB 3.41Å; M122-S126 PolarHBondContact O-N 3.29Å; M122-S126 PolarHBondContact O-OG 3.08Å; M122-T253 HydrophobicContact SD-CG2 4.04Å; M122-V254 HydrophobicContact CE-CG2 3.54Å; M122-V254 HydrophobicContact SD-CG2 4.23Å; M122-E257 HydrophobicContact CB-CG 3.75Å; M122-E257 HydrophobicContact SD-CB 4.31Å; M122-E257 HydrophobicContact SD-CG 4.26Å
123T91.2Very high90.6Very high0 Ų030.2 Ų30.20%017%0.17CC..Hα-helixtrans-62.4-43.8178.8-49.70000111.2L42 G101 S105 S119 S126 T127 E257L42-T123 HydrophobicContact CD1-CG2 3.93Å; L42-T123 HydrophobicContact CD2-CG2 3.95Å; G101-T123 WeakPolarHBondContact O-CG2 3.39Å; S105-T123 PolarHBondContact OG-OG1 2.96Å; S119-T123 PolarHBondContact O-N 3.35Å; S119-T123 PolarHBondContact O-OG1 3.41Å; T123-S126 WeakPolarHBondContact CA-OG 3.24Å; T123-S126 PolarHBondContact O-OG 3.01Å; T123-T127 VanDerWaalsContact O-CB 3.29Å; T123-T127 WeakPolarHBondContact O-CB 3.32Å; T123-T127 PolarHBondContact O-N 3.05Å; T123-T127 PolarHBondContact O-OG1 3.3Å; T123-E257 WeakPolarHBondContact CA-OE1 3.25Å; T123-E257 WeakPolarHBondContact CB-OE1 3.47Å; T123-E257 PolarHBondContact N-OE1 3.43Å; T123-E257 VanDerWaalsContact OG1-CD 3.25Å; T123-E257 PolarHBondContact OG1-OE1 3.27Å; T123-E257 PolarHBondContact OG1-OE2 3.24Å; T123-E257 VanDerWaalsContact OG1-OE2 3.05Å
124T89.3Confident90.6Very high3 Ų325.7 Ų25.72%0.01815%0.15CC..Hα-helixtrans-67.6-51.2-179.6-58.60000110.6M46 I120 V121 M122 S126 T127 F128 I174M46-T124 HydrophobicContact CE-CG2 3.91Å; M46-T124 VanDerWaalsContact CE-OG1 3.26Å; M46-T124 WeakPolarHBondContact CE-OG1 3.22Å; I120-T124 WeakPolarHBondContact O-CB 3.33Å; I120-T124 PolarHBondContact O-N 3.43Å; I120-T124 PolarHBondContact O-OG1 2.94Å; V121-T124 PolarHBondContact O-N 3.45Å; M122-T124 VanDerWaalsContact C-N 3.35Å; M122-T124 PolarHBondContact O-N 2.93Å; T124-S126 VanDerWaalsContact C-N 3.34Å; T124-S126 PolarHBondContact O-N 3.4Å; T124-T127 WeakPolarHBondContact O-CB 3.45Å; T124-T127 PolarHBondContact O-N 2.7Å; T124-T127 VanDerWaalsContact O-N 3.16Å; T124-F128 HydrophobicContact CG2-CD2 3.84Å; T124-F128 HydrophobicContact CG2-CE2 3.66Å; T124-F128 VanDerWaalsContact O-CD2 3.23Å; T124-F128 WeakPolarHBondContact O-CD2 3.22Å; T124-F128 PolarHBondContact O-N 2.69Å; T124-I174 HydrophobicContact CG2-CD1 4.15Å
125C90.1Very high90.6Very high22 Ų2225.7 Ų25.715%0.14915%0.147CC..Hα-helixtrans-60.6-42.5178.7-72.30000111.9L61 V121 M122 T127 F128 C129L61-C125 HydrophobicContact CD1-CB 3.81Å; V121-C125 VanDerWaalsContact O-CB 3.26Å; V121-C125 WeakPolarHBondContact O-CB 3.32Å; V121-C125 PolarHBondContact O-N 3.25Å; V121-C125 PolarHBondContact O-SG 3.19Å; V121-C125 VanDerWaalsContact O-SG 3.33Å; M122-C125 PolarHBondContact O-N 2.78Å; C125-T127 VanDerWaalsContact C-N 3.34Å; C125-T127 PolarHBondContact O-N 3.08Å; C125-F128 PolarHBondContact O-N 2.88Å; C125-C129 WeakPolarHBondContact O-CB 3.3Å; C125-C129 PolarHBondContact O-N 3.08Å; C125-C129 PolarHBondContact O-SG 3.01Å
126S92.3Very high90.7Very high2 Ų228.9 Ų28.91%0.01416%0.164CC..Hα-helixtrans-63.3-41.3175.764.30000111.1Y69 G101 M122 T123 T124 F128 C129 A130Y69-S126 PolarHBondContact OH-O 3.41Å; G101-S126 PolarHBondContact N-OG 3.5Å; M122-S126 VanDerWaalsContact O-CB 3.24Å; M122-S126 WeakPolarHBondContact O-CB 3.41Å; M122-S126 PolarHBondContact O-N 3.29Å; M122-S126 PolarHBondContact O-OG 3.08Å; T123-S126 WeakPolarHBondContact CA-OG 3.24Å; T123-S126 PolarHBondContact O-OG 3.01Å; T124-S126 VanDerWaalsContact C-N 3.34Å; T124-S126 PolarHBondContact O-N 3.4Å; S126-F128 PolarHBondContact O-N 3Å; S126-C129 CarbonylContact O-C 3.43Å; S126-C129 PolarHBondContact O-N 2.7Å; S126-A130 PolarHBondContact O-N 3.23Å
127T91.6Very high91Very high2 Ų226 Ų261%0.01215%0.15CC..Hα-helixtrans-59-44.3175.4-60.10000112.2T123 T124 C125 A130 V166 L167T123-T127 VanDerWaalsContact O-CB 3.29Å; T123-T127 WeakPolarHBondContact O-CB 3.32Å; T123-T127 PolarHBondContact O-N 3.05Å; T123-T127 PolarHBondContact O-OG1 3.3Å; T124-T127 WeakPolarHBondContact O-CB 3.45Å; T124-T127 PolarHBondContact O-N 2.7Å; T124-T127 VanDerWaalsContact O-N 3.16Å; C125-T127 VanDerWaalsContact C-N 3.34Å; C125-T127 PolarHBondContact O-N 3.08Å; T127-A130 VanDerWaalsContact O-CB 3.26Å; T127-A130 WeakPolarHBondContact O-CB 3.45Å; T127-A130 PolarHBondContact O-N 2.59Å; T127-V166 HydrophobicContact CG2-CG1 3.91Å; T127-L167 HydrophobicContact CG2-CD2 4.21Å
128F90.4Very high91.2Very high82 Ų8223.3 Ų23.336%0.3614%0.136SC..Hα-helixtrans-67-41.2174.3-79.6-79.3000112.4T124 C125 S126 A130 L131 L167 I174T124-F128 HydrophobicContact CG2-CD2 3.84Å; T124-F128 HydrophobicContact CG2-CE2 3.66Å; T124-F128 VanDerWaalsContact O-CD2 3.23Å; T124-F128 WeakPolarHBondContact O-CD2 3.22Å; T124-F128 PolarHBondContact O-N 2.69Å; C125-F128 PolarHBondContact O-N 2.88Å; S126-F128 PolarHBondContact O-N 3Å; F128-A130 PolarHBondContact O-N 2.98Å; F128-L131 PolarHBondContact O-N 2.87Å; F128-L167 HydrophobicContact CD1-CD2 3.81Å; F128-L167 HydrophobicContact CE1-CD2 4.14Å; F128-L167 HydrophobicContact CG-CD2 4.24Å; F128-I174 HydrophobicContact CE2-CD1 4.03Å; F128-I174 HydrophobicContact CZ-CD1 4.25Å
129C91.9Very high91.2Very high49 Ų4927.9 Ų27.933%0.33115%0.153SC..Hα-helixtrans-65.6-24.1176.7-66.60000112.5Y69 C125 S126 L131 G132 M133Y69-C129 HydrophobicContact CE2-CB 3.83Å; C125-C129 WeakPolarHBondContact O-CB 3.3Å; C125-C129 PolarHBondContact O-N 3.08Å; C125-C129 PolarHBondContact O-SG 3.01Å; S126-C129 CarbonylContact O-C 3.43Å; S126-C129 PolarHBondContact O-N 2.7Å; C129-L131 PolarHBondContact O-N 3.29Å; C129-L131 VanDerWaalsContact O-N 3.17Å; C129-G132 PolarHBondContact O-N 3.49Å; C129-G132 VanDerWaalsContact O-N 3.12Å; C129-M133 HydrophobicContact CB-CG 4.14Å; C129-M133 WeakPolarHBondContact O-CB 3.49Å; C129-M133 WeakPolarHBondContact O-CG 3.39Å; C129-M133 PolarHBondContact O-N 3.27Å
130A91.9Very high91.2Very high1 Ų133.1 Ų33.11%0.00818%0.18CC..Hα-helixtrans-57.1-33.2-178.400000112.2Y69 P100 S126 T127 F128 G132 M134 P135 L163Y69-A130 WeakPolarHBondContact OH-CA 3.43Å; Y69-A130 VanDerWaalsContact OH-CB 3.24Å; Y69-A130 WeakPolarHBondContact OH-CB 3.42Å; Y69-A130 PolarHBondContact OH-N 3.05Å; Y69-A130 VanDerWaalsContact OH-N 3.15Å; P100-A130 HydrophobicContact CB-CB 4.27Å; P100-A130 HydrophobicContact CG-CB 4.08Å; S126-A130 PolarHBondContact O-N 3.23Å; T127-A130 VanDerWaalsContact O-CB 3.26Å; T127-A130 WeakPolarHBondContact O-CB 3.45Å; T127-A130 PolarHBondContact O-N 2.59Å; F128-A130 PolarHBondContact O-N 2.98Å; A130-G132 PolarHBondContact O-N 3.1Å; A130-M134 WeakPolarHBondContact O-CB 3.47Å; A130-M134 PolarHBondContact O-N 3.31Å; A130-P135 WeakPolarHBondContact O-CD 3.17Å; A130-L163 HydrophobicContact CB-CD2 4.3Å
131L91Very high91.4Very high62 Ų6234.1 Ų34.133%0.32518%0.184SC..Hα-helixtrans-54.8-37.1179.2-170.368.3000112.9F128 C129 P135 I160 L163 V164 L167F128-L131 PolarHBondContact O-N 2.87Å; C129-L131 PolarHBondContact O-N 3.29Å; C129-L131 VanDerWaalsContact O-N 3.17Å; L131-P135 WeakPolarHBondContact O-CD 2.98Å; L131-P135 WeakPolarHBondContact O-CG 3.37Å; L131-I160 HydrophobicContact CD1-CG2 4.28Å; L131-L163 HydrophobicContact CD1-CB 3.87Å; L131-V164 HydrophobicContact CD1-CG2 4.2Å; L131-L167 HydrophobicContact CB-CD1 4.17Å; L131-L167 HydrophobicContact CD1-CD1 4.29Å; L131-L167 HydrophobicContact CD2-CD1 3.89Å; L131-L167 HydrophobicContact CG-CD1 4.35Å
132G90.6Very high91.4Very high47 Ų4734.1 Ų34.149%0.48518%0.184SC..Hα-helixtrans-100.2-43.3177.200000113.1C129 A130 P135 L136C129-G132 PolarHBondContact O-N 3.49Å; C129-G132 VanDerWaalsContact O-N 3.12Å; A130-G132 PolarHBondContact O-N 3.1Å; G132-P135 WeakPolarHBondContact O-CD 3.43Å; G132-L136 WeakPolarHBondContact O-CB 3.36Å; G132-L136 PolarHBondContact O-N 3.18Å
133M93.1Very high91.2Very high62 Ų6241 Ų4131%0.30521%0.209SC..Hα-helixtrans-69.3-40.9-173.3-66.9-58.5-67.100112.4Y69 C129 L136 L137Y69-M133 HydrophobicContact CD1-CB 3.69Å; Y69-M133 HydrophobicContact CD1-CG 4.42Å; Y69-M133 HydrophobicContact CD2-CB 4.13Å; Y69-M133 HydrophobicContact CD2-CE 4.48Å; Y69-M133 HydrophobicContact CD2-CG 4Å; Y69-M133 HydrophobicContact CE1-CB 3.67Å; Y69-M133 HydrophobicContact CE2-CB 4.11Å; Y69-M133 HydrophobicContact CE2-CG 4.12Å; Y69-M133 HydrophobicContact CG-CB 3.93Å; Y69-M133 HydrophobicContact CG-CE 4.06Å; Y69-M133 HydrophobicContact CG-CG 4.15Å; C129-M133 HydrophobicContact CB-CG 4.14Å; C129-M133 WeakPolarHBondContact O-CB 3.49Å; C129-M133 WeakPolarHBondContact O-CG 3.39Å; C129-M133 PolarHBondContact O-N 3.27Å; M133-L136 PolarHBondContact O-N 3.34Å; M133-L136 HydrophobicContact SD-CD2 4.42Å; M133-L137 HydrophobicContact CB-CD1 4.27Å; M133-L137 HydrophobicContact CE-CD1 4.28Å; M133-L137 VanDerWaalsContact O-CB 3.3Å; M133-L137 WeakPolarHBondContact O-CB 3.28Å; M133-L137 WeakPolarHBondContact O-CD1 3.32Å; M133-L137 WeakPolarHBondContact O-CG 3.33Å; M133-L137 PolarHBondContact O-N 3.04Å
134M93.1Very high90.9Very high0 Ų042.4 Ų42.40%022%0.224CC..Hα-helixtrans-65.5-49.5-176.3-177.2176.5-168.900112.2V95 C98 A130 L136 L138 L163 L265 I269V95-M134 HydrophobicContact CB-CE 4.37Å; V95-M134 HydrophobicContact CG1-CE 3.59Å; V95-M134 WeakPolarHBondContact O-CE 3.43Å; C98-M134 HydrophobicContact CB-CB 4.49Å; C98-M134 HydrophobicContact CB-CG 3.9Å; A130-M134 WeakPolarHBondContact O-CB 3.47Å; A130-M134 PolarHBondContact O-N 3.31Å; M134-L136 VanDerWaalsContact C-N 3.34Å; M134-L136 PolarHBondContact O-N 3.49Å; M134-L138 HydrophobicContact CE-CD1 4.42Å; M134-L138 HydrophobicContact CG-CD1 4.04Å; M134-L138 WeakPolarHBondContact O-CB 3.32Å; M134-L138 VanDerWaalsContact O-CG 3.24Å; M134-L138 WeakPolarHBondContact O-CG 3.44Å; M134-L138 PolarHBondContact O-N 3.4Å; M134-L163 HydrophobicContact CB-CD1 4.25Å; M134-L163 HydrophobicContact SD-CD1 4.15Å; M134-L163 HydrophobicContact SD-CD2 4.12Å; M134-L265 HydrophobicContact SD-CD2 4.32Å; M134-I269 HydrophobicContact CE-CD1 3.51Å; M134-I269 HydrophobicContact CE-CG2 4.2Å; M134-I269 HydrophobicContact SD-CD1 3.53Å; M134-I269 VanDerWaalsContact SD-CD1 3.53Å
135P91.3Very high90.7Very high14 Ų1443 Ų439%0.09123%0.227CC..Hα-helixtrans-60.8-40.8173-21.531.7000113.1A130 L131 G132 Y139 I160 L163A130-P135 WeakPolarHBondContact O-CD 3.17Å; L131-P135 WeakPolarHBondContact O-CD 2.98Å; L131-P135 WeakPolarHBondContact O-CG 3.37Å; G132-P135 WeakPolarHBondContact O-CD 3.43Å; P135-Y139 VanDerWaalsContact O-CB 3.32Å; P135-Y139 WeakPolarHBondContact O-CB 3.27Å; P135-Y139 PolarHBondContact O-N 3.41Å; P135-I160 HydrophobicContact CB-CD1 4.32Å; P135-I160 HydrophobicContact CB-CG1 4.11Å; P135-I160 HydrophobicContact CG-CD1 4.17Å; P135-I160 HydrophobicContact CG-CG1 3.48Å; P135-I160 VanDerWaalsContact CG-CG1 3.48Å; P135-L163 HydrophobicContact CG-CD1 4.46Å
136L92.4Very high90.3Very high104 Ų10442.8 Ų42.855%0.54522%0.223SC..Hα-helixtrans-62.7-47.4-179.6179.569.9000112G132 M133 M134 Y139 L140G132-L136 WeakPolarHBondContact O-CB 3.36Å; G132-L136 PolarHBondContact O-N 3.18Å; M133-L136 PolarHBondContact O-N 3.34Å; M133-L136 HydrophobicContact SD-CD2 4.42Å; M134-L136 VanDerWaalsContact C-N 3.34Å; M134-L136 PolarHBondContact O-N 3.49Å; L136-Y139 WeakPolarHBondContact O-CB 3.48Å; L136-Y139 PolarHBondContact O-N 3.1Å; L136-L140 PolarHBondContact O-N 3.48Å
137L93.9Very high89.4Confident14 Ų1449.9 Ų49.97%0.07326%0.261CS..Hα-helixtrans-69.7-41.5-179.5-69.3163.5000111.2Y69 P73 M133 Y139 L140 Y141Y69-L137 HydrophobicContact CD1-CD1 3.49Å; Y69-L137 VanDerWaalsContact CD1-CD1 3.49Å; Y69-L137 HydrophobicContact CE1-CD1 4.43Å; Y69-L137 HydrophobicContact CG-CD1 4.11Å; P73-L137 HydrophobicContact CB-CD1 4.46Å; P73-L137 HydrophobicContact CG-CD1 3.79Å; M133-L137 HydrophobicContact CB-CD1 4.27Å; M133-L137 HydrophobicContact CE-CD1 4.28Å; M133-L137 VanDerWaalsContact O-CB 3.3Å; M133-L137 WeakPolarHBondContact O-CB 3.28Å; M133-L137 WeakPolarHBondContact O-CD1 3.32Å; M133-L137 WeakPolarHBondContact O-CG 3.33Å; M133-L137 PolarHBondContact O-N 3.04Å; L137-Y139 VanDerWaalsContact C-N 3.26Å; L137-Y139 PolarHBondContact O-N 2.88Å; L137-L140 PolarHBondContact O-N 3.06Å; L137-Y141 HydrophobicContact CB-CD2 4.4Å; L137-Y141 HydrophobicContact CD2-CE2 4.01Å; L137-Y141 VanDerWaalsContact O-CD2 3.27Å; L137-Y141 WeakPolarHBondContact O-CD2 3.37Å; L137-Y141 PolarHBondContact O-N 3.34Å
138L92Very high88.4Confident0 Ų052.9 Ų52.90%029%0.292CS..Hα-helixtrans-57.9-43.7172.4-74.4171.2000110.7L91 L94 V95 C98 M134 L140 T142 Y156 I159L91-L138 HydrophobicContact CD1-CD2 4.34Å; L94-L138 HydrophobicContact CB-CD2 4.43Å; L94-L138 HydrophobicContact CD2-CD2 3.82Å; L94-L138 HydrophobicContact CG-CD2 3.81Å; V95-L138 HydrophobicContact CG2-CD1 4.24Å; V95-L138 HydrophobicContact CG2-CD2 3.85Å; C98-L138 HydrophobicContact CB-CG 4.49Å; M134-L138 HydrophobicContact CE-CD1 4.42Å; M134-L138 HydrophobicContact CG-CD1 4.04Å; M134-L138 WeakPolarHBondContact O-CB 3.32Å; M134-L138 VanDerWaalsContact O-CG 3.24Å; M134-L138 WeakPolarHBondContact O-CG 3.44Å; M134-L138 PolarHBondContact O-N 3.4Å; L138-L140 VanDerWaalsContact C-N 3.34Å; L138-L140 PolarHBondContact O-N 2.95Å; L138-T142 WeakPolarHBondContact O-CB 3.19Å; L138-T142 WeakPolarHBondContact O-CG2 3.46Å; L138-T142 PolarHBondContact O-N 3Å; L138-T142 PolarHBondContact O-OG1 2.84Å; L138-Y156 HydrophobicContact CB-CE1 4.25Å; L138-I159 HydrophobicContact CD1-CD1 3.62Å; L138-I159 HydrophobicContact CD1-CG2 4.39Å
139Y89.8Confident87.3Confident103 Ų10354.4 Ų54.440%0.40430%0.304SS..Hα-helixtrans-61.1-42.8176.6-179.8-102.3000112.7P135 L136 L137 T142 R143 Y156P135-Y139 VanDerWaalsContact O-CB 3.32Å; P135-Y139 WeakPolarHBondContact O-CB 3.27Å; P135-Y139 PolarHBondContact O-N 3.41Å; L136-Y139 WeakPolarHBondContact O-CB 3.48Å; L136-Y139 PolarHBondContact O-N 3.1Å; L137-Y139 VanDerWaalsContact C-N 3.26Å; L137-Y139 PolarHBondContact O-N 2.88Å; Y139-T142 PolarHBondContact O-OG1 2.88Å; Y139-R143 PolarHBondContact OH-NH2 2.94Å; Y139-Y156 WeakPolarHBondContact CA-OH 3.33Å; Y139-Y156 HydrophobicContact CD2-CE1 4.26Å; Y139-Y156 HydrophobicContact CD2-CE2 4.25Å; Y139-Y156 AromaticContact CD2-CZ 3.83Å
140L91.7Very high86.2Confident109 Ų10952.8 Ų52.857%0.57129%0.292SS*.Hα-helixtrans-66.9-49.9-179.1-17268.6000112.1L136 L137 L138L136-L140 PolarHBondContact O-N 3.48Å; L137-L140 PolarHBondContact O-N 3.06Å; L138-L140 VanDerWaalsContact C-N 3.34Å; L138-L140 PolarHBondContact O-N 2.95Å
141Y91.7Very high84.7Confident38 Ų3860.8 Ų60.815%0.14933%0.326CS..Hα-helixtrans-79.8-28.9-173.5-76.5-72.5000113.4P73 L74 F77 L94 L137 R143 G144 I145P73-Y141 HydrophobicContact CB-CD2 4.12Å; P73-Y141 HydrophobicContact CB-CE2 3.61Å; L74-Y141 HydrophobicContact CD1-CE1 4.17Å; F77-Y141 HydrophobicContact CB-CD1 3.5Å; F77-Y141 VanDerWaalsContact CB-CD1 3.5Å; F77-Y141 HydrophobicContact CB-CE1 3.81Å; F77-Y141 HydrophobicContact CB-CG 4.23Å; F77-Y141 AromaticContact CD1-CD1 3.84Å; F77-Y141 HydrophobicContact CD1-CD1 3.84Å; F77-Y141 HydrophobicContact CD1-CE1 4.03Å; F77-Y141 AromaticContact CD2-CD1 3.63Å; F77-Y141 HydrophobicContact CD2-CD1 3.63Å; F77-Y141 HydrophobicContact CD2-CG 4.28Å; F77-Y141 HydrophobicContact CE1-CD1 4.47Å; F77-Y141 HydrophobicContact CE2-CD1 4.28Å; F77-Y141 WeakPolarHBondContact CE2-O 3.35Å; F77-Y141 AromaticContact CG-CD1 3.36Å; F77-Y141 HydrophobicContact CG-CD1 3.36Å; F77-Y141 AromaticContact CG-CE1 3.89Å; F77-Y141 HydrophobicContact CG-CE1 3.89Å; F77-Y141 HydrophobicContact CG-CG 4.31Å; L94-Y141 HydrophobicContact CD1-CD2 4.17Å; L94-Y141 HydrophobicContact CD1-CG 4.08Å; L137-Y141 HydrophobicContact CB-CD2 4.4Å; L137-Y141 HydrophobicContact CD2-CE2 4.01Å; L137-Y141 VanDerWaalsContact O-CD2 3.27Å; L137-Y141 WeakPolarHBondContact O-CD2 3.37Å; L137-Y141 PolarHBondContact O-N 3.34Å; Y141-R143 VanDerWaalsContact C-N 3.25Å; Y141-R143 PolarHBondContact O-N 2.83Å; Y141-G144 WeakPolarHBondContact O-CA 3.49Å; Y141-G144 PolarHBondContact O-N 3.37Å; Y141-I145 PolarHBondContact O-N 2.86Å
142T89.3Confident83.4Confident0 Ų065.1 Ų65.10%035%0.35CS..Hα-helixtrans-69-23.9179.356.30000113L91 L94 L138 Y139 G144 I145 Y146 V154 Y156L91-T142 HydrophobicContact CD1-CG2 3.89Å; L94-T142 HydrophobicContact CD2-CG2 4.01Å; L138-T142 WeakPolarHBondContact O-CB 3.19Å; L138-T142 WeakPolarHBondContact O-CG2 3.46Å; L138-T142 PolarHBondContact O-N 3Å; L138-T142 PolarHBondContact O-OG1 2.84Å; Y139-T142 PolarHBondContact O-OG1 2.88Å; T142-G144 PolarHBondContact O-N 3.41Å; T142-I145 PolarHBondContact O-N 2.92Å; T142-Y146 PolarHBondContact O-N 3.12Å; T142-V154 HydrophobicContact CG2-CG2 3.88Å; T142-Y156 PolarHBondContact OG1-OH 3.18Å; T142-Y156 VanDerWaalsContact OG1-OH 3.05Å
143R86.8Confident82.4Confident146 Ų14666.4 Ų66.455%0.55134%0.342SS*.THydrogen-bonded Turntrans-58.3-30.4166.7-72.1178172.9-153.6-1.8113Y139 Y141 L150Y139-R143 PolarHBondContact OH-NH2 2.94Å; Y141-R143 VanDerWaalsContact C-N 3.25Å; Y141-R143 PolarHBondContact O-N 2.83Å; R143-L150 HydrophobicContact CB-CD1 4.29Å; R143-L150 HydrophobicContact CG-CD1 3.38Å
144G84.4Confident81.6Confident30 Ų3063.5 Ų63.531%0.30933%0.328SS..THydrogen-bonded Turntrans-85-13.2175.100000113.5K81 Y141 T142K81-G144 WeakPolarHBondContact CE-O 3.48Å; K81-G144 PolarHBondContact NZ-O 3.13Å; Y141-G144 WeakPolarHBondContact O-CA 3.49Å; Y141-G144 PolarHBondContact O-N 3.37Å; T142-G144 PolarHBondContact O-N 3.41Å
145I84.6Confident81.1Confident15 Ų1565 Ų658%0.07734%0.338CS..THydrogen-bonded Turntrans-96.8-42.2-179.4-63.8171.5000110.8F77 N87 A90 L94 Y141 T142F77-I145 HydrophobicContact CD2-CD1 4.35Å; F77-I145 HydrophobicContact CD2-CG1 4.1Å; F77-I145 HydrophobicContact CE2-CG1 3.98Å; N87-I145 HydrophobicContact CB-CG2 3.96Å; N87-I145 PolarHBondContact OD1-O 3.44Å; A90-I145 HydrophobicContact CB-CD1 3.96Å; A90-I145 HydrophobicContact CB-CG1 4.33Å; A90-I145 HydrophobicContact CB-CG2 4.02Å; L94-I145 HydrophobicContact CD2-CD1 3.83Å; Y141-I145 PolarHBondContact O-N 2.86Å; T142-I145 PolarHBondContact O-N 2.92Å
146Y82.1Confident80.6Confident19 Ų1966.5 Ų66.58%0.07534%0.342CS..SBendtrans-112.8132.8-175.7-68.1-82.8000111.9N87 I88 T142 L150 K153N87-Y146 HydrophobicContact CB-CD1 3.84Å; N87-Y146 HydrophobicContact CB-CE1 3.3Å; N87-Y146 HydrophobicContact CB-CE2 4.32Å; N87-Y146 PolarHBondContact O-OH 3.31Å; I88-Y146 WeakPolarHBondContact CD1-OH 3.48Å; T142-Y146 PolarHBondContact O-N 3.12Å; Y146-L150 HydrophobicContact CD2-CD2 4.24Å; Y146-L150 HydrophobicContact CG-CD2 4.44Å; Y146-K153 HydrophobicContact CD1-CD 3.45Å; Y146-K153 VanDerWaalsContact CD1-CD 3.45Å; Y146-K153 HydrophobicContact CD2-CD 4.39Å; Y146-K153 HydrophobicContact CE1-CD 3.99Å; Y146-K153 HydrophobicContact CG-CD 3.64Å
147D74.7Confident80.1Confident150 Ų15064.2 Ų64.280%0.80234%0.343SS*.SBendtrans-81.6133167.7-58.7-46.7000110.3K153D147-K153 PolarHBondContact O-NZ 2.96Å
148G69.8Low79.6Confident65 Ų6570.2 Ų70.267%0.6737%0.365SS*.SBendtrans97.3-162.5176.100000116L150G148-L150 PolarHBondContact O-N 3.29Å
149D67.1Low79.2Confident115 Ų11570.2 Ų70.262%0.61537%0.365SS*.  trans-66.1132.4-177.9-164.20.1000111.4K151D149-K151 PolarHBondContact OD1-N 3.35Å
150L68.1Low79.1Confident15 Ų1568.8 Ų68.88%0.07936%0.364CS..  trans-92.8-11.4-176-71.5167.6000112.6R143 Y146 G148 D152 K153 V154R143-L150 HydrophobicContact CB-CD1 4.29Å; R143-L150 HydrophobicContact CG-CD1 3.38Å; Y146-L150 HydrophobicContact CD2-CD2 4.24Å; Y146-L150 HydrophobicContact CG-CD2 4.44Å; G148-L150 PolarHBondContact O-N 3.29Å; L150-D152 PolarHBondContact O-N 2.86Å; L150-K153 PolarHBondContact O-N 3.18Å; L150-V154 PolarHBondContact O-N 3.42Å
151K60.6Low78.7Confident168 Ų16869.5 Ų69.573%0.7337%0.367SS*.THydrogen-bonded Turntrans-58.6-33.3-169.8-145.8176.5-175.4-176.30113.4D149D149-K151 PolarHBondContact OD1-N 3.35Å
152D64.8Low78.3Confident154 Ų15468.5 Ų68.582%0.82437%0.366SS*.THydrogen-bonded Turntrans-98.8-7-179.6-58.3-40.7000113.6L150L150-D152 PolarHBondContact O-N 2.86Å
153K69.6Low78.1Confident74 Ų7468.7 Ų68.732%0.32237%0.367SS..THydrogen-bonded Turntrans-96.4-31.6-172.8-60.6-174.3179.9177.50113.1Y146 D147 L150Y146-K153 HydrophobicContact CD1-CD 3.45Å; Y146-K153 VanDerWaalsContact CD1-CD 3.45Å; Y146-K153 HydrophobicContact CD2-CD 4.39Å; Y146-K153 HydrophobicContact CE1-CD 3.99Å; Y146-K153 HydrophobicContact CG-CD 3.64Å; D147-K153 PolarHBondContact O-NZ 2.96Å; L150-K153 PolarHBondContact O-N 3.18Å
154V76.8Confident77.9Confident1 Ų164.6 Ų64.61%0.00636%0.358CS..SBendtrans-129.3117.8-179.6-177.70000109.5L91 T142 L150 Y156 I159 F274L91-V154 HydrophobicContact CD1-CG2 4.08Å; L91-V154 HydrophobicContact CD2-CG2 4.49Å; T142-V154 HydrophobicContact CG2-CG2 3.88Å; L150-V154 PolarHBondContact O-N 3.42Å; V154-Y156 VanDerWaalsContact C-N 3.26Å; V154-Y156 HydrophobicContact CB-CD2 4.31Å; V154-Y156 HydrophobicContact CB-CE1 4.1Å; V154-Y156 HydrophobicContact CB-CE2 3.72Å; V154-Y156 HydrophobicContact CG1-CD1 3.94Å; V154-Y156 HydrophobicContact CG1-CD2 4.37Å; V154-Y156 HydrophobicContact CG1-CE1 3.61Å; V154-Y156 HydrophobicContact CG1-CE2 4.07Å; V154-Y156 HydrophobicContact CG1-CG 4.3Å; V154-Y156 WeakPolarHBondContact O-CD2 3.39Å; V154-Y156 WeakPolarHBondContact O-CE2 3.44Å; V154-Y156 PolarHBondContact O-N 3.41Å; V154-I159 HydrophobicContact CG1-CD1 3.87Å; V154-F274 HydrophobicContact CG1-CE1 4.48Å
155P81.4Confident77.8Confident32 Ų3266.1 Ų66.121%0.20836%0.362CS..  trans-82.368.4-175.734-33.4000111G157 R158 I159 A273 F274P155-G157 VanDerWaalsContact C-N 3.26Å; P155-G157 PolarHBondContact O-N 2.88Å; P155-G157 VanDerWaalsContact O-N 3.16Å; P155-R158 HydrophobicContact CB-CB 4.04Å; P155-R158 HydrophobicContact CB-CG 4.12Å; P155-R158 WeakPolarHBondContact O-CA 3.37Å; P155-R158 WeakPolarHBondContact O-CB 3.32Å; P155-R158 PolarHBondContact O-N 3.22Å; P155-I159 WeakPolarHBondContact O-CG1 3.26Å; P155-I159 PolarHBondContact O-N 3.15Å; P155-A273 WeakPolarHBondContact CG-O 3.48Å; P155-F274 HydrophobicContact CG-CD1 3.84Å; P155-F274 HydrophobicContact CG-CE1 3.96Å; P155-F274 HydrophobicContact CG-CG 4.28Å
156Y82.3Confident77.8Confident45 Ų4565.5 Ų65.518%0.17636%0.359CS..Hα-helixtrans-51.2-42.1-176.3-60.8-77.8000113.4L138 Y139 T142 V154 R158 I159 I160L138-Y156 HydrophobicContact CB-CE1 4.25Å; Y139-Y156 WeakPolarHBondContact CA-OH 3.33Å; Y139-Y156 HydrophobicContact CD2-CE1 4.26Å; Y139-Y156 HydrophobicContact CD2-CE2 4.25Å; Y139-Y156 AromaticContact CD2-CZ 3.83Å; T142-Y156 PolarHBondContact OG1-OH 3.18Å; T142-Y156 VanDerWaalsContact OG1-OH 3.05Å; V154-Y156 VanDerWaalsContact C-N 3.26Å; V154-Y156 HydrophobicContact CB-CD2 4.31Å; V154-Y156 HydrophobicContact CB-CE1 4.1Å; V154-Y156 HydrophobicContact CB-CE2 3.72Å; V154-Y156 HydrophobicContact CG1-CD1 3.94Å; V154-Y156 HydrophobicContact CG1-CD2 4.37Å; V154-Y156 HydrophobicContact CG1-CE1 3.61Å; V154-Y156 HydrophobicContact CG1-CE2 4.07Å; V154-Y156 HydrophobicContact CG1-CG 4.3Å; V154-Y156 WeakPolarHBondContact O-CD2 3.39Å; V154-Y156 WeakPolarHBondContact O-CE2 3.44Å; V154-Y156 PolarHBondContact O-N 3.41Å; Y156-R158 VanDerWaalsContact C-N 3.34Å; Y156-R158 PolarHBondContact O-N 3.07Å; Y156-I159 PolarHBondContact O-N 2.99Å; Y156-I160 WeakPolarHBondContact O-CG1 3.31Å; Y156-I160 PolarHBondContact O-N 3.44Å
157G81.6Confident78.1Confident55 Ų5565.9 Ų65.957%0.56736%0.362SS*.Hα-helixtrans-61.7-39.7176.600000112.8P155 L161P155-G157 VanDerWaalsContact C-N 3.26Å; P155-G157 PolarHBondContact O-N 2.88Å; P155-G157 VanDerWaalsContact O-N 3.16Å; G157-L161 VanDerWaalsContact O-CB 3.3Å; G157-L161 WeakPolarHBondContact O-CB 2.84Å; G157-L161 PolarHBondContact O-N 3Å
158R82.4Confident78.9Confident141 Ų14163 Ų6353%0.53235%0.346SS..Hα-helixtrans-71.2-33.4175.7-62.9-172.2177.5-169.52112.1P155 Y156 L161 S162 A273P155-R158 HydrophobicContact CB-CB 4.04Å; P155-R158 HydrophobicContact CB-CG 4.12Å; P155-R158 WeakPolarHBondContact O-CA 3.37Å; P155-R158 WeakPolarHBondContact O-CB 3.32Å; P155-R158 PolarHBondContact O-N 3.22Å; Y156-R158 VanDerWaalsContact C-N 3.34Å; Y156-R158 PolarHBondContact O-N 3.07Å; R158-L161 PolarHBondContact O-N 3.4Å; R158-S162 VanDerWaalsContact O-CB 3.26Å; R158-S162 WeakPolarHBondContact O-CB 3.32Å; R158-S162 PolarHBondContact O-N 3.29Å; R158-S162 PolarHBondContact O-OG 2.97Å; R158-A273 HydrophobicContact CB-CB 4.13Å; R158-A273 VanDerWaalsContact CD-O 3.23Å; R158-A273 WeakPolarHBondContact CD-O 3.02Å
159I84.8Confident79.9Confident0 Ų060 Ų600%032%0.315CS..Hα-helixtrans-64.9-48.6175.2-63.3174.5000110.1L138 V154 P155 Y156 L161 S162 L163 I269 A273 F274L138-I159 HydrophobicContact CD1-CD1 3.62Å; L138-I159 HydrophobicContact CD1-CG2 4.39Å; V154-I159 HydrophobicContact CG1-CD1 3.87Å; P155-I159 WeakPolarHBondContact O-CG1 3.26Å; P155-I159 PolarHBondContact O-N 3.15Å; Y156-I159 PolarHBondContact O-N 2.99Å; I159-L161 VanDerWaalsContact C-N 3.33Å; I159-L161 PolarHBondContact O-N 3.34Å; I159-S162 PolarHBondContact O-N 2.96Å; I159-S162 VanDerWaalsContact O-N 3.16Å; I159-L163 HydrophobicContact CG2-CD1 4.11Å; I159-L163 WeakPolarHBondContact O-CG 3.15Å; I159-L163 PolarHBondContact O-N 2.92Å; I159-I269 HydrophobicContact CG1-CG2 4.38Å; I159-I269 HydrophobicContact CG2-CG2 4.48Å; I159-A273 HydrophobicContact CG1-CB 3.8Å; I159-F274 HydrophobicContact CD1-CE2 4.23Å; I159-F274 HydrophobicContact CD1-CZ 3.85Å; I159-F274 HydrophobicContact CG1-CE2 4.45Å; I159-F274 HydrophobicContact CG1-CZ 4.49Å
160I85.7Confident81Confident73 Ų7354.5 Ų54.537%0.37429%0.285SS..Hα-helixtrans-58.5-47.6174.9-66.6166.9000110.3L131 P135 Y156 S162 L163 V164L131-I160 HydrophobicContact CD1-CG2 4.28Å; P135-I160 HydrophobicContact CB-CD1 4.32Å; P135-I160 HydrophobicContact CB-CG1 4.11Å; P135-I160 HydrophobicContact CG-CD1 4.17Å; P135-I160 HydrophobicContact CG-CG1 3.48Å; P135-I160 VanDerWaalsContact CG-CG1 3.48Å; Y156-I160 WeakPolarHBondContact O-CG1 3.31Å; Y156-I160 PolarHBondContact O-N 3.44Å; I160-S162 VanDerWaalsContact C-N 3.26Å; I160-S162 PolarHBondContact O-N 3.19Å; I160-L163 PolarHBondContact O-N 2.97Å; I160-L163 VanDerWaalsContact O-N 3.1Å; I160-V164 PolarHBondContact O-N 3.46Å
161L84.6Confident82.1Confident124 Ų12456.4 Ų56.465%0.64930%0.297SS*.Hα-helixtrans-62.3-33.3178.5-170.566.4000112.3G157 R158 I159 L163 P165G157-L161 VanDerWaalsContact O-CB 3.3Å; G157-L161 WeakPolarHBondContact O-CB 2.84Å; G157-L161 PolarHBondContact O-N 3Å; R158-L161 PolarHBondContact O-N 3.4Å; I159-L161 VanDerWaalsContact C-N 3.33Å; I159-L161 PolarHBondContact O-N 3.34Å; L161-L163 VanDerWaalsContact C-N 3.34Å; L161-P165 WeakPolarHBondContact O-CD 3.36Å
162S82.9Confident83.6Confident16 Ų1652.2 Ų52.211%0.11228%0.282CS..Hα-helixtrans-75.2-22.8176.9-58.30000113R158 I159 I160 P165R158-S162 VanDerWaalsContact O-CB 3.26Å; R158-S162 WeakPolarHBondContact O-CB 3.32Å; R158-S162 PolarHBondContact O-N 3.29Å; R158-S162 PolarHBondContact O-OG 2.97Å; I159-S162 PolarHBondContact O-N 2.96Å; I159-S162 VanDerWaalsContact O-N 3.16Å; I160-S162 VanDerWaalsContact C-N 3.26Å; I160-S162 PolarHBondContact O-N 3.19Å; S162-P165 WeakPolarHBondContact O-CD 3.35Å
163L84.9Confident84.8Confident4 Ų444.9 Ų44.92%0.02124%0.243CC..Hα-helixtrans-80.5-27.8175.9-74.7164.4000112.7A130 L131 M134 P135 I159 I160 L161 V166 L167 L265 I269A130-L163 HydrophobicContact CB-CD2 4.3Å; L131-L163 HydrophobicContact CD1-CB 3.87Å; M134-L163 HydrophobicContact CB-CD1 4.25Å; M134-L163 HydrophobicContact SD-CD1 4.15Å; M134-L163 HydrophobicContact SD-CD2 4.12Å; P135-L163 HydrophobicContact CG-CD1 4.46Å; I159-L163 HydrophobicContact CG2-CD1 4.11Å; I159-L163 WeakPolarHBondContact O-CG 3.15Å; I159-L163 PolarHBondContact O-N 2.92Å; I160-L163 PolarHBondContact O-N 2.97Å; I160-L163 VanDerWaalsContact O-N 3.1Å; L161-L163 VanDerWaalsContact C-N 3.34Å; L163-V166 VanDerWaalsContact O-CB 3.23Å; L163-V166 WeakPolarHBondContact O-CB 3.22Å; L163-V166 PolarHBondContact O-N 3.39Å; L163-L167 PolarHBondContact O-N 3Å; L163-L265 HydrophobicContact CD2-CD1 4.12Å; L163-L265 HydrophobicContact CD2-CD2 4.4Å; L163-I269 HydrophobicContact CD2-CD1 3.84Å; L163-I269 HydrophobicContact CG-CD1 4.16Å
164V83.4Confident85.8Confident61 Ų6142.2 Ų42.237%0.3723%0.232SC..Hα-helixtrans-58.6-46.4177.5172.80000112.5L131 I160 V166 L167 I168L131-V164 HydrophobicContact CD1-CG2 4.2Å; I160-V164 PolarHBondContact O-N 3.46Å; V164-V166 PolarHBondContact O-N 3.32Å; V164-V166 VanDerWaalsContact O-N 3.09Å; V164-L167 PolarHBondContact O-N 3.28Å; V164-L167 VanDerWaalsContact O-N 3.12Å; V164-I168 HydrophobicContact CG1-CD1 3.94Å; V164-I168 HydrophobicContact CG1-CG1 4.49Å; V164-I168 WeakPolarHBondContact O-CG1 3.42Å; V164-I168 PolarHBondContact O-N 2.85Å
165P80.9Confident86.5Confident61 Ų6146.1 Ų46.140%0.39625%0.252SS..Hα-helixtrans-60.9-12.6173.1-2532.7000115.6L161 S162 P169L161-P165 WeakPolarHBondContact O-CD 3.36Å; S162-P165 WeakPolarHBondContact O-CD 3.35Å; P165-P169 WeakPolarHBondContact O-CD 3.01Å; P165-P169 WeakPolarHBondContact O-CG 3.39Å
166V85.2Confident87Confident2 Ų247.5 Ų47.51%0.01226%0.257CS..Hα-helixtrans-81.8-43.2173.9178.90000110.2L35 M39 T127 L163 V164 P169 C170 L265L35-V166 HydrophobicContact CD2-CG2 3.86Å; L35-V166 HydrophobicContact CG-CG2 4.42Å; M39-V166 HydrophobicContact CG-CB 4.34Å; M39-V166 HydrophobicContact CG-CG1 3.59Å; M39-V166 HydrophobicContact SD-CG1 3.5Å; M39-V166 VanDerWaalsContact SD-CG1 3.5Å; T127-V166 HydrophobicContact CG2-CG1 3.91Å; L163-V166 VanDerWaalsContact O-CB 3.23Å; L163-V166 WeakPolarHBondContact O-CB 3.22Å; L163-V166 PolarHBondContact O-N 3.39Å; V164-V166 PolarHBondContact O-N 3.32Å; V164-V166 VanDerWaalsContact O-N 3.09Å; V166-P169 WeakPolarHBondContact O-CD 3.24Å; V166-P169 WeakPolarHBondContact O-CG 3.4Å; V166-C170 WeakPolarHBondContact O-CB 3.36Å; V166-C170 PolarHBondContact O-N 3.23Å; V166-L265 HydrophobicContact CB-CD1 4.29Å; V166-L265 HydrophobicContact CG1-CD1 3.62Å; V166-L265 HydrophobicContact CG2-CD1 3.81Å; V166-L265 HydrophobicContact CG2-CG 4.33Å
167L87.9Confident87.3Confident27 Ų2747.3 Ų47.314%0.14126%0.258CS..Hα-helixtrans-71.7-35.2-175.7-62.2-176.7000112.8T127 F128 L131 L163 V164 C170 T171T127-L167 HydrophobicContact CG2-CD2 4.21Å; F128-L167 HydrophobicContact CD1-CD2 3.81Å; F128-L167 HydrophobicContact CE1-CD2 4.14Å; F128-L167 HydrophobicContact CG-CD2 4.24Å; L131-L167 HydrophobicContact CB-CD1 4.17Å; L131-L167 HydrophobicContact CD1-CD1 4.29Å; L131-L167 HydrophobicContact CD2-CD1 3.89Å; L131-L167 HydrophobicContact CG-CD1 4.35Å; L163-L167 PolarHBondContact O-N 3Å; V164-L167 PolarHBondContact O-N 3.28Å; V164-L167 VanDerWaalsContact O-N 3.12Å; L167-C170 PolarHBondContact O-N 3.11Å; L167-T171 VanDerWaalsContact O-CB 3.31Å; L167-T171 WeakPolarHBondContact O-CB 3.33Å; L167-T171 PolarHBondContact O-N 3.34Å; L167-T171 PolarHBondContact O-OG1 2.88Å
168I91.6Very high87.6Confident91 Ų9148.6 Ų48.647%0.46726%0.258SS..Hα-helixtrans-58.2-60.6180-65.8166.7000111.8V164 C170 T171 I172V164-I168 HydrophobicContact CG1-CD1 3.94Å; V164-I168 HydrophobicContact CG1-CG1 4.49Å; V164-I168 WeakPolarHBondContact O-CG1 3.42Å; V164-I168 PolarHBondContact O-N 2.85Å; I168-C170 VanDerWaalsContact C-N 3.31Å; I168-C170 PolarHBondContact O-N 3.5Å; I168-T171 PolarHBondContact O-N 2.88Å; I168-I172 HydrophobicContact CG2-CD1 3.78Å; I168-I172 VanDerWaalsContact O-CG1 3.3Å; I168-I172 WeakPolarHBondContact O-CG1 3.23Å; I168-I172 PolarHBondContact O-N 3.06Å
169P91.6Very high88Confident1 Ų149.5 Ų49.51%0.00627%0.265CS..Hα-helixtrans-61.9-36.8178.520.8-30.7000112.9F36 M39 L40 P165 V166 T171 I172 G173F36-P169 HydrophobicContact CD2-CB 3.62Å; F36-P169 HydrophobicContact CD2-CG 3.78Å; F36-P169 HydrophobicContact CE2-CB 3.7Å; F36-P169 HydrophobicContact CE2-CG 4.23Å; F36-P169 HydrophobicContact CG-CB 4.12Å; F36-P169 HydrophobicContact CG-CG 4.39Å; F36-P169 HydrophobicContact CZ-CB 4.24Å; F36-P169 WeakPolarHBondContact O-CB 3.33Å; M39-P169 HydrophobicContact CB-CB 4.1Å; M39-P169 HydrophobicContact CB-CG 3.71Å; L40-P169 HydrophobicContact CB-CB 4.12Å; L40-P169 WeakPolarHBondContact CD1-O 3.23Å; P165-P169 WeakPolarHBondContact O-CD 3.01Å; P165-P169 WeakPolarHBondContact O-CG 3.39Å; V166-P169 WeakPolarHBondContact O-CD 3.24Å; V166-P169 WeakPolarHBondContact O-CG 3.4Å; P169-T171 PolarHBondContact O-N 3.33Å; P169-I172 PolarHBondContact O-N 2.96Å; P169-G173 PolarHBondContact O-N 2.88Å
170C90.4Very high88.3Confident0 Ų055.9 Ų55.90%029%0.29CS..Hα-helixtrans-60.2-46.6175.3-173.60000111.2M39 G43 V166 L167 I168 G173 I174M39-C170 HydrophobicContact CB-CB 4.42Å; M39-C170 WeakPolarHBondContact O-CA 3.38Å; G43-C170 WeakPolarHBondContact CA-O 3.48Å; V166-C170 WeakPolarHBondContact O-CB 3.36Å; V166-C170 PolarHBondContact O-N 3.23Å; L167-C170 PolarHBondContact O-N 3.11Å; I168-C170 VanDerWaalsContact C-N 3.31Å; I168-C170 PolarHBondContact O-N 3.5Å; C170-G173 PolarHBondContact O-N 3.49Å; C170-I174 WeakPolarHBondContact O-CG1 3.44Å; C170-I174 PolarHBondContact O-N 2.83Å
171T90.5Very high88.4Confident54 Ų5456 Ų5633%0.33130%0.296SS..Hα-helixtrans-65.1-42.3178.2-55.60000111.4L167 I168 P169 G173 I174 I175L167-T171 VanDerWaalsContact O-CB 3.31Å; L167-T171 WeakPolarHBondContact O-CB 3.33Å; L167-T171 PolarHBondContact O-N 3.34Å; L167-T171 PolarHBondContact O-OG1 2.88Å; I168-T171 PolarHBondContact O-N 2.88Å; P169-T171 PolarHBondContact O-N 3.33Å; T171-G173 VanDerWaalsContact C-N 3.3Å; T171-G173 PolarHBondContact O-N 3.03Å; T171-I174 PolarHBondContact O-N 3.35Å; T171-I175 HydrophobicContact CG2-CD1 3.98Å; T171-I175 WeakPolarHBondContact O-CG1 3.22Å; T171-I175 PolarHBondContact O-N 3.02Å
172I92Very high88.6Confident80 Ų8055.9 Ų55.941%0.4129%0.291SS..Hα-helixtrans-57.7-45.4173.9-68.7167.1000110.4L40 I168 P169 I174 I175 L176L40-I172 HydrophobicContact CD1-CB 4.24Å; L40-I172 HydrophobicContact CD1-CG2 3.87Å; I168-I172 HydrophobicContact CG2-CD1 3.78Å; I168-I172 VanDerWaalsContact O-CG1 3.3Å; I168-I172 WeakPolarHBondContact O-CG1 3.23Å; I168-I172 PolarHBondContact O-N 3.06Å; P169-I172 PolarHBondContact O-N 2.96Å; I172-I174 PolarHBondContact O-N 3.43Å; I172-I175 PolarHBondContact O-N 3.5Å; I172-L176 VanDerWaalsContact O-CB 3.24Å; I172-L176 WeakPolarHBondContact O-CB 3.49Å; I172-L176 PolarHBondContact O-N 3.25Å
173G91.1Very high88.8Confident0 Ų060.6 Ų60.60%031%0.307CS..Hα-helixtrans-60.2-44.317800000112.7G43 P169 C170 T171 L176 K177G43-G173 CarbonylContact O-C 3.22Å; P169-G173 PolarHBondContact O-N 2.88Å; C170-G173 PolarHBondContact O-N 3.49Å; T171-G173 VanDerWaalsContact C-N 3.3Å; T171-G173 PolarHBondContact O-N 3.03Å; G173-L176 PolarHBondContact O-N 2.88Å; G173-K177 WeakPolarHBondContact O-CB 3.44Å; G173-K177 PolarHBondContact O-N 3.23Å
174I90.3Very high89Confident19 Ų1960.7 Ų60.710%0.09731%0.308CS..Hα-helixtrans-61.3-47177-66164.5000110.7G43 M46 T124 F128 C170 T171 I172 L176 K177 S178G43-I174 WeakPolarHBondContact O-CA 3.35Å; G43-I174 PolarHBondContact O-N 2.87Å; M46-I174 HydrophobicContact CB-CG1 4.08Å; M46-I174 HydrophobicContact CG-CG1 4.16Å; T124-I174 HydrophobicContact CG2-CD1 4.15Å; F128-I174 HydrophobicContact CE2-CD1 4.03Å; F128-I174 HydrophobicContact CZ-CD1 4.25Å; C170-I174 WeakPolarHBondContact O-CG1 3.44Å; C170-I174 PolarHBondContact O-N 2.83Å; T171-I174 PolarHBondContact O-N 3.35Å; I172-I174 PolarHBondContact O-N 3.43Å; I174-L176 VanDerWaalsContact C-N 3.34Å; I174-L176 PolarHBondContact O-N 3.16Å; I174-K177 PolarHBondContact O-N 3.33Å; I174-S178 WeakPolarHBondContact O-CB 3.27Å; I174-S178 PolarHBondContact O-N 2.79Å
175I90.9Very high89.1Confident82 Ų8266.4 Ų66.442%0.42132%0.323SS..Hα-helixtrans-63.5-42.8178.6-67.2168.6000110.5T171 I172 S178 K179T171-I175 HydrophobicContact CG2-CD1 3.98Å; T171-I175 WeakPolarHBondContact O-CG1 3.22Å; T171-I175 PolarHBondContact O-N 3.02Å; I172-I175 PolarHBondContact O-N 3.5Å; I175-S178 PolarHBondContact O-N 3.29Å; I175-K179 HydrophobicContact CG2-CD 3.98Å; I175-K179 HydrophobicContact CG2-CG 4.33Å; I175-K179 WeakPolarHBondContact O-CB 3.17Å; I175-K179 PolarHBondContact O-N 3.2Å
176L91.2Very high89.4Confident61 Ų6171.7 Ų71.732%0.31934%0.336SS..Hα-helixtrans-66.2-41.5-178.3-167.965.9000111.4I172 G173 I174 S178 K179 R180 M184 V187I172-L176 VanDerWaalsContact O-CB 3.24Å; I172-L176 WeakPolarHBondContact O-CB 3.49Å; I172-L176 PolarHBondContact O-N 3.25Å; G173-L176 PolarHBondContact O-N 2.88Å; I174-L176 VanDerWaalsContact C-N 3.34Å; I174-L176 PolarHBondContact O-N 3.16Å; L176-S178 VanDerWaalsContact C-N 3.34Å; L176-K179 PolarHBondContact O-N 3.18Å; L176-R180 CarbonylContact O-C 3.58Å; L176-R180 WeakPolarHBondContact O-CA 3.3Å; L176-R180 PolarHBondContact O-N 2.96Å; L176-M184 HydrophobicContact CB-CE 4.15Å; L176-M184 HydrophobicContact CD2-CE 3.62Å; L176-M184 HydrophobicContact CG-CE 3.43Å; L176-M184 VanDerWaalsContact CG-CE 3.43Å; L176-V187 HydrophobicContact CD2-CG2 4.21Å
177K90.1Very high89.5Confident42 Ų4273.5 Ų73.518%0.18335%0.347CS..Hα-helixtrans-62.2-40.3172.2174.160.7177.8-174.50112C44 M46 E47 G173 I174 M184C44-K177 WeakPolarHBondContact O-CD 3.39Å; C44-K177 WeakPolarHBondContact O-CG 3.34Å; M46-K177 WeakPolarHBondContact O-CG 3.29Å; E47-K177 VanDerWaalsContact CG-CE 3.45Å; E47-K177 WeakPolarHBondContact OE1-CE 3.18Å; E47-K177 IonicContact OE1-NZ 3.12Å; E47-K177 PolarHBondContact OE1-NZ 2.78Å; E47-K177 VanDerWaalsContact OE1-NZ 3.12Å; G173-K177 WeakPolarHBondContact O-CB 3.44Å; G173-K177 PolarHBondContact O-N 3.23Å; I174-K177 PolarHBondContact O-N 3.33Å; K177-M184 WeakPolarHBondContact CA-SD 3.3Å; K177-M184 HydrophobicContact CB-CG 4.29Å; K177-M184 HydrophobicContact CB-SD 3.72Å; K177-M184 HydrophobicContact CD-CB 4.42Å; K177-M184 HydrophobicContact CD-CG 3.6Å; K177-M184 HydrophobicContact CD-SD 4.16Å; K177-M184 HydrophobicContact CG-SD 4.5Å
178S88.2Confident89.5Confident82 Ų8274.8 Ų74.857%0.57335%0.354SS*.Hα-helixtrans-69.2-40.2178.1-171.90000113I174 I175 L176I174-S178 WeakPolarHBondContact O-CB 3.27Å; I174-S178 PolarHBondContact O-N 2.79Å; I175-S178 PolarHBondContact O-N 3.29Å; L176-S178 VanDerWaalsContact C-N 3.34Å
179K90Very high89.3Confident159 Ų15976.2 Ų76.269%0.69136%0.357SS*.Hα-helixtrans-87.4-34.8-175.3-71.3-171.8176.1-175.60113.2I175 L176I175-K179 HydrophobicContact CG2-CD 3.98Å; I175-K179 HydrophobicContact CG2-CG 4.33Å; I175-K179 WeakPolarHBondContact O-CB 3.17Å; I175-K179 PolarHBondContact O-N 3.2Å; L176-K179 PolarHBondContact O-N 3.18Å
180R90.7Very high89.2Confident134 Ų13477.6 Ų77.651%0.50637%0.371SS..  trans-140.563.7-171.8-61.5-66.6-171.4128.34.3111.9L176 Q182 Y183L176-R180 CarbonylContact O-C 3.58Å; L176-R180 WeakPolarHBondContact O-CA 3.3Å; L176-R180 PolarHBondContact O-N 2.96Å; R180-Q182 PolarHBondContact O-N 3.32Å; R180-Q182 VanDerWaalsContact O-N 3.07Å; R180-Y183 HydrophobicContact CB-CD2 3.86Å; R180-Y183 HydrophobicContact CB-CE2 4.44Å; R180-Y183 HydrophobicContact CG-CD2 4.42Å; R180-Y183 PolarHBondContact O-N 2.98Å
181P87.9Confident89Confident77 Ų7777.8 Ų77.850%0.537%0.373SS..G310 helixtrans-59-26.3-177.623.9-34.3000113.6Y183 M184P181-Y183 VanDerWaalsContact C-N 3.29Å; P181-Y183 PolarHBondContact O-N 2.92Å; P181-M184 WeakPolarHBondContact O-CB 3.38Å; P181-M184 VanDerWaalsContact O-CG 3.25Å; P181-M184 WeakPolarHBondContact O-CG 3.38Å; P181-M184 PolarHBondContact O-N 2.82Å
182Q89.7Confident88.8Confident120 Ų12080.9 Ų80.956%0.56139%0.385SS*.G310 helixtrans-60.2-31.2179.467.1-171.212.600114.3R180R180-Q182 PolarHBondContact O-N 3.32Å; R180-Q182 VanDerWaalsContact O-N 3.07Å
183Y87.1Confident88.6Confident115 Ų11582 Ų8245%0.45139%0.391SS..G310 helixtrans-88.1-8-178.3-62.7-64.3000113.5R180 P181 R185 Y186 V187R180-Y183 HydrophobicContact CB-CD2 3.86Å; R180-Y183 HydrophobicContact CB-CE2 4.44Å; R180-Y183 HydrophobicContact CG-CD2 4.42Å; R180-Y183 PolarHBondContact O-N 2.98Å; P181-Y183 VanDerWaalsContact C-N 3.29Å; P181-Y183 PolarHBondContact O-N 2.92Å; Y183-R185 VanDerWaalsContact C-N 3.26Å; Y183-R185 PolarHBondContact O-N 2.86Å; Y183-Y186 PolarHBondContact O-N 2.62Å; Y183-V187 PolarHBondContact O-N 3.44Å
184M87.7Confident88.6Confident7 Ų784.6 Ų84.63%0.03440%0.404CS..Hα-helixtrans-62.9-34.7-169.8-63.8-6497.900112.7C44 L176 K177 P181 Y186 V187 I188C44-M184 HydrophobicContact CB-SD 3.84Å; L176-M184 HydrophobicContact CB-CE 4.15Å; L176-M184 HydrophobicContact CD2-CE 3.62Å; L176-M184 HydrophobicContact CG-CE 3.43Å; L176-M184 VanDerWaalsContact CG-CE 3.43Å; K177-M184 WeakPolarHBondContact CA-SD 3.3Å; K177-M184 HydrophobicContact CB-CG 4.29Å; K177-M184 HydrophobicContact CB-SD 3.72Å; K177-M184 HydrophobicContact CD-CB 4.42Å; K177-M184 HydrophobicContact CD-CG 3.6Å; K177-M184 HydrophobicContact CD-SD 4.16Å; K177-M184 HydrophobicContact CG-SD 4.5Å; P181-M184 WeakPolarHBondContact O-CB 3.38Å; P181-M184 VanDerWaalsContact O-CG 3.25Å; P181-M184 WeakPolarHBondContact O-CG 3.38Å; P181-M184 PolarHBondContact O-N 2.82Å; M184-Y186 VanDerWaalsContact C-N 3.27Å; M184-Y186 PolarHBondContact O-N 3.41Å; M184-V187 HydrophobicContact CE-CG2 4.19Å; M184-V187 PolarHBondContact O-N 3.5Å; M184-I188 WeakPolarHBondContact O-CB 3.46Å; M184-I188 VanDerWaalsContact O-CG1 3.25Å; M184-I188 WeakPolarHBondContact O-CG1 3.34Å; M184-I188 PolarHBondContact O-N 3.39Å
185R85.4Confident88.4Confident180 Ų18085.1 Ų85.168%0.67941%0.406SS*.Hα-helixtrans-61.6-37.7176.4-165177.3-167.4-169.63112Y183 K189Y183-R185 VanDerWaalsContact C-N 3.26Å; Y183-R185 PolarHBondContact O-N 2.86Å; R185-K189 VanDerWaalsContact O-CB 3.3Å; R185-K189 WeakPolarHBondContact O-CB 3.21Å; R185-K189 VanDerWaalsContact O-CG 3.22Å; R185-K189 WeakPolarHBondContact O-CG 3.32Å; R185-K189 PolarHBondContact O-N 3.01Å; R185-K189 VanDerWaalsContact O-N 3.16Å
186Y88.3Confident88.2Confident172 Ų17286.5 Ų86.568%0.67541%0.414SS*.Hα-helixtrans-75.5-43.4178.7-59.7-80000111.3Y183 M184 K189 G190Y183-Y186 PolarHBondContact O-N 2.62Å; M184-Y186 VanDerWaalsContact C-N 3.27Å; M184-Y186 PolarHBondContact O-N 3.41Å; Y186-K189 PolarHBondContact O-N 2.71Å; Y186-G190 PolarHBondContact O-N 2.92Å
187V87.8Confident88.1Confident41 Ų4189.2 Ų89.225%0.24843%0.428CS..Hα-helixtrans-61.2-47.1178177.50000111.1L176 Y183 M184 G191L176-V187 HydrophobicContact CD2-CG2 4.21Å; Y183-V187 PolarHBondContact O-N 3.44Å; M184-V187 HydrophobicContact CE-CG2 4.19Å; M184-V187 PolarHBondContact O-N 3.5Å; V187-G191 PolarHBondContact O-N 3.45Å
188I86.5Confident87.9Confident54 Ų5488 Ų8828%0.27743%0.425SS..Hα-helixtrans-65.2-44.7178.7-66.5167.6000110.6C44 T45 M184 G191 M192C44-I188 HydrophobicContact CB-CD1 4.33Å; C44-I188 HydrophobicContact CB-CG1 4.09Å; T45-I188 HydrophobicContact CG2-CD1 4.11Å; M184-I188 WeakPolarHBondContact O-CB 3.46Å; M184-I188 VanDerWaalsContact O-CG1 3.25Å; M184-I188 WeakPolarHBondContact O-CG1 3.34Å; M184-I188 PolarHBondContact O-N 3.39Å; I188-G191 PolarHBondContact O-N 3.33Å; I188-M192 HydrophobicContact CG2-CG 4.47Å; I188-M192 VanDerWaalsContact O-CG 3.25Å; I188-M192 WeakPolarHBondContact O-CG 3.4Å; I188-M192 PolarHBondContact O-N 3.37Å
189K87.9Confident87.6Confident121 Ų12185.9 Ų85.953%0.52641%0.41SS..Hα-helixtrans-62.5-46.2177.7-80-178.2175.6-169.40112.5R185 Y186 M192 I193R185-K189 VanDerWaalsContact O-CB 3.3Å; R185-K189 WeakPolarHBondContact O-CB 3.21Å; R185-K189 VanDerWaalsContact O-CG 3.22Å; R185-K189 WeakPolarHBondContact O-CG 3.32Å; R185-K189 PolarHBondContact O-N 3.01Å; R185-K189 VanDerWaalsContact O-N 3.16Å; Y186-K189 PolarHBondContact O-N 2.71Å; K189-M192 PolarHBondContact O-N 2.97Å; K189-I193 WeakPolarHBondContact O-CG1 3.15Å; K189-I193 PolarHBondContact O-N 2.91Å
190G89Confident87.4Confident30 Ų3082.2 Ų82.231%0.30940%0.401SS..Hα-helixtrans-63.1-44.4176.600000111.6Y186 M192 I193 I194Y186-G190 PolarHBondContact O-N 2.92Å; G190-M192 VanDerWaalsContact C-N 3.35Å; G190-M192 PolarHBondContact O-N 3.22Å; G190-I193 PolarHBondContact O-N 3.03Å; G190-I194 WeakPolarHBondContact O-CG1 3.24Å; G190-I194 PolarHBondContact O-N 3.46Å
191G86.4Confident87.1Confident3 Ų377.5 Ų77.53%0.03139%0.391CS..Hα-helixtrans-56.8-45.9174.800000112.3V187 I188 I193 I194 I195V187-G191 PolarHBondContact O-N 3.45Å; I188-G191 PolarHBondContact O-N 3.33Å; G191-I193 VanDerWaalsContact C-N 3.34Å; G191-I193 PolarHBondContact O-N 3.06Å; G191-I194 PolarHBondContact O-N 3.37Å; G191-I195 WeakPolarHBondContact O-CB 3.24Å; G191-I195 WeakPolarHBondContact O-CD1 3.29Å; G191-I195 WeakPolarHBondContact O-CG1 3.26Å; G191-I195 PolarHBondContact O-N 3.25Å
192M85.9Confident86.9Confident119 Ų11974.4 Ų74.459%0.58637%0.37SS*.Hα-helixtrans-59-41.9176.4-74-66.5-6300112.8I188 K189 G190 L196I188-M192 HydrophobicContact CG2-CG 4.47Å; I188-M192 VanDerWaalsContact O-CG 3.25Å; I188-M192 WeakPolarHBondContact O-CG 3.4Å; I188-M192 PolarHBondContact O-N 3.37Å; K189-M192 PolarHBondContact O-N 2.97Å; G190-M192 VanDerWaalsContact C-N 3.35Å; G190-M192 PolarHBondContact O-N 3.22Å; M192-L196 WeakPolarHBondContact O-CB 3.42Å; M192-L196 PolarHBondContact O-N 3.16Å
193I89.3Confident86.3Confident104 Ų10472.8 Ų72.853%0.53337%0.369SS..Hα-helixtrans-65.5-44.9177-65.1167.5000110.5K189 G190 G191 L196 L197K189-I193 WeakPolarHBondContact O-CG1 3.15Å; K189-I193 PolarHBondContact O-N 2.91Å; G190-I193 PolarHBondContact O-N 3.03Å; G191-I193 VanDerWaalsContact C-N 3.34Å; G191-I193 PolarHBondContact O-N 3.06Å; I193-L196 WeakPolarHBondContact O-CB 3.46Å; I193-L196 PolarHBondContact O-N 3.49Å; I193-L197 HydrophobicContact CG2-CD1 4.14Å; I193-L197 WeakPolarHBondContact O-CG 3.48Å; I193-L197 PolarHBondContact O-N 2.81Å
194I89.4Confident86.1Confident54 Ų5471 Ų7128%0.27737%0.369SS..Hα-helixtrans-62.2-46.8178.2-67.1167.3000110.5F33 F37 G190 G191 L196 L197 C198F33-I194 HydrophobicContact CE1-CG2 4.11Å; F37-I194 HydrophobicContact CD1-CD1 4.02Å; F37-I194 HydrophobicContact CD1-CG2 4.42Å; F37-I194 HydrophobicContact CD2-CG2 3.76Å; F37-I194 HydrophobicContact CE1-CD1 3.59Å; F37-I194 HydrophobicContact CE2-CG2 4.08Å; F37-I194 HydrophobicContact CG-CG2 3.98Å; F37-I194 HydrophobicContact CZ-CD1 3.89Å; F37-I194 HydrophobicContact CZ-CG2 4.49Å; G190-I194 WeakPolarHBondContact O-CG1 3.24Å; G190-I194 PolarHBondContact O-N 3.46Å; G191-I194 PolarHBondContact O-N 3.37Å; I194-L196 VanDerWaalsContact C-N 3.29Å; I194-L196 PolarHBondContact O-N 2.96Å; I194-L197 PolarHBondContact O-N 3.06Å; I194-C198 WeakPolarHBondContact O-CB 3.37Å; I194-C198 PolarHBondContact O-N 2.76Å; I194-C198 PolarHBondContact O-SG 3.48Å; I194-C198 VanDerWaalsContact O-SG 3.32Å
195I86.8Confident85.7Confident30 Ų3072.3 Ų72.315%0.15438%0.377CS..Hα-helixtrans-58.7-43177.4-68.8162.8000110.3M34 F37 V38 G191 C198 S199M34-I195 HydrophobicContact CE-CG2 3.88Å; F37-I195 HydrophobicContact CB-CD1 4.33Å; F37-I195 HydrophobicContact CB-CG1 3.98Å; V38-I195 HydrophobicContact CB-CD1 4.44Å; V38-I195 HydrophobicContact CG2-CD1 3.71Å; V38-I195 HydrophobicContact CG2-CG1 3.88Å; V38-I195 HydrophobicContact CG2-CG2 4.2Å; G191-I195 WeakPolarHBondContact O-CB 3.24Å; G191-I195 WeakPolarHBondContact O-CD1 3.29Å; G191-I195 WeakPolarHBondContact O-CG1 3.26Å; G191-I195 PolarHBondContact O-N 3.25Å; I195-C198 PolarHBondContact O-N 2.93Å; I195-S199 WeakPolarHBondContact O-CB 3.4Å; I195-S199 PolarHBondContact O-N 2.93Å; I195-S199 PolarHBondContact O-OG 3.27Å
196L86.9Confident85.1Confident111 Ų11164 Ų6458%0.58135%0.346SS*.Hα-helixtrans-61.2-50.3176.4-177.965.9000111.3M192 I193 I194 C198 S199 V200M192-L196 WeakPolarHBondContact O-CB 3.42Å; M192-L196 PolarHBondContact O-N 3.16Å; I193-L196 WeakPolarHBondContact O-CB 3.46Å; I193-L196 PolarHBondContact O-N 3.49Å; I194-L196 VanDerWaalsContact C-N 3.29Å; I194-L196 PolarHBondContact O-N 2.96Å; L196-C198 PolarHBondContact O-N 3.48Å; L196-S199 PolarHBondContact O-N 3.47Å; L196-S199 PolarHBondContact O-OG 3.42Å; L196-V200 WeakPolarHBondContact O-CG2 3.26Å; L196-V200 PolarHBondContact O-N 2.84Å; L196-V200 VanDerWaalsContact O-N 3.1Å
197L89.1Confident84.5Confident118 Ų11858.8 Ų58.862%0.61834%0.338SS*.Hα-helixtrans-60.5-45178.2-69.3173000112I193 I194 S199 V200 A201I193-L197 HydrophobicContact CG2-CD1 4.14Å; I193-L197 WeakPolarHBondContact O-CG 3.48Å; I193-L197 PolarHBondContact O-N 2.81Å; I194-L197 PolarHBondContact O-N 3.06Å; L197-S199 VanDerWaalsContact C-N 3.33Å; L197-S199 PolarHBondContact O-N 3.11Å; L197-V200 PolarHBondContact O-N 3.36Å; L197-A201 PolarHBondContact O-N 2.91Å
198C86.4Confident84Confident16 Ų1662.3 Ų62.311%0.10836%0.355CS..Hα-helixtrans-61.8-40.3175.7-70.40000111.8I30 M34 I194 I195 L196 V200 A201 V202I30-C198 HydrophobicContact CG2-CB 4.01Å; M34-C198 HydrophobicContact CB-CB 3.83Å; M34-C198 HydrophobicContact CG-CB 3.9Å; M34-C198 HydrophobicContact SD-CB 4.01Å; I194-C198 WeakPolarHBondContact O-CB 3.37Å; I194-C198 PolarHBondContact O-N 2.76Å; I194-C198 PolarHBondContact O-SG 3.48Å; I194-C198 VanDerWaalsContact O-SG 3.32Å; I195-C198 PolarHBondContact O-N 2.93Å; L196-C198 PolarHBondContact O-N 3.48Å; C198-V200 VanDerWaalsContact C-N 3.34Å; C198-V200 PolarHBondContact O-N 2.86Å; C198-A201 PolarHBondContact O-N 2.94Å; C198-V202 WeakPolarHBondContact O-CB 3.37Å; C198-V202 VanDerWaalsContact O-CG2 3.26Å; C198-V202 WeakPolarHBondContact O-CG2 3.48Å; C198-V202 PolarHBondContact O-N 3.34Å
199S82Confident83.1Confident38 Ų3859.9 Ų59.927%0.26634%0.342SS..Hα-helixtrans-63.2-39.8178.473.20000112.5I195 L196 L197 T203I195-S199 WeakPolarHBondContact O-CB 3.4Å; I195-S199 PolarHBondContact O-N 2.93Å; I195-S199 PolarHBondContact O-OG 3.27Å; L196-S199 PolarHBondContact O-N 3.47Å; L196-S199 PolarHBondContact O-OG 3.42Å; L197-S199 VanDerWaalsContact C-N 3.33Å; L197-S199 PolarHBondContact O-N 3.11Å; S199-T203 WeakPolarHBondContact O-CB 3.26Å; S199-T203 PolarHBondContact O-N 3.42Å; S199-T203 PolarHBondContact O-OG1 3.27Å
200V84.9Confident82Confident83 Ų8354.5 Ų54.550%0.50332%0.319SS..Hα-helixtrans-64.9-46.6174.4174.50000110.1L196 L197 C198 V202 T203 V204L196-V200 WeakPolarHBondContact O-CG2 3.26Å; L196-V200 PolarHBondContact O-N 2.84Å; L196-V200 VanDerWaalsContact O-N 3.1Å; L197-V200 PolarHBondContact O-N 3.36Å; C198-V200 VanDerWaalsContact C-N 3.34Å; C198-V200 PolarHBondContact O-N 2.86Å; V200-V202 PolarHBondContact O-N 3.12Å; V200-T203 PolarHBondContact O-N 3.23Å; V200-V204 HydrophobicContact CG1-CG2 4.42Å; V200-V204 VanDerWaalsContact O-CG2 3.29Å; V200-V204 WeakPolarHBondContact O-CG2 3.23Å; V200-V204 PolarHBondContact O-N 3.12Å
201A85.4Confident80.9Confident35 Ų3554.9 Ų54.929%0.28932%0.324SS..Hα-helixtrans-60.6-45.7178.100000112.1I30 L197 C198 T203 V204 L205I30-A201 HydrophobicContact CD1-CB 4.31Å; L197-A201 PolarHBondContact O-N 2.91Å; C198-A201 PolarHBondContact O-N 2.94Å; A201-T203 VanDerWaalsContact C-N 3.32Å; A201-T203 PolarHBondContact O-N 3.09Å; A201-V204 PolarHBondContact O-N 3.14Å; A201-L205 WeakPolarHBondContact O-CB 3.24Å; A201-L205 PolarHBondContact O-N 2.75Å
202V82Confident79.6Confident11 Ų1163.6 Ų63.67%0.06736%0.361CS..Hα-helixtrans-58.1-46175.3169.40000110.1I30 L31 C198 V200 V204 S206I30-V202 HydrophobicContact CB-CG2 4.38Å; I30-V202 HydrophobicContact CG2-CG2 3.61Å; L31-V202 HydrophobicContact CD2-CG1 4.01Å; L31-V202 HydrophobicContact CD2-CG2 3.9Å; L31-V202 HydrophobicContact CG-CG2 4.36Å; C198-V202 WeakPolarHBondContact O-CB 3.37Å; C198-V202 VanDerWaalsContact O-CG2 3.26Å; C198-V202 WeakPolarHBondContact O-CG2 3.48Å; C198-V202 PolarHBondContact O-N 3.34Å; V200-V202 PolarHBondContact O-N 3.12Å; V202-V204 PolarHBondContact O-N 3.48Å; V202-S206 WeakPolarHBondContact O-CB 3.05Å; V202-S206 PolarHBondContact O-N 2.76Å; V202-S206 PolarHBondContact O-OG 2.64Å
203T78.1Confident78.5Confident87 Ų8759.4 Ų59.453%0.53434%0.343SS..Hα-helixtrans-61.4-44.6-179.9-56.40000111.7S199 V200 A201 S206 A207S199-T203 WeakPolarHBondContact O-CB 3.26Å; S199-T203 PolarHBondContact O-N 3.42Å; S199-T203 PolarHBondContact O-OG1 3.27Å; V200-T203 PolarHBondContact O-N 3.23Å; A201-T203 VanDerWaalsContact C-N 3.32Å; A201-T203 PolarHBondContact O-N 3.09Å; T203-S206 WeakPolarHBondContact O-CB 3.37Å; T203-A207 WeakPolarHBondContact O-CB 3.42Å; T203-A207 PolarHBondContact O-N 3.1Å
204V82.9Confident77.3Confident76 Ų7657.2 Ų57.246%0.46133%0.332SS..Hα-helixtrans-67.1-50.2179.4173.90000111.2V200 A201 V202 S206 A207 I208V200-V204 HydrophobicContact CG1-CG2 4.42Å; V200-V204 VanDerWaalsContact O-CG2 3.29Å; V200-V204 WeakPolarHBondContact O-CG2 3.23Å; V200-V204 PolarHBondContact O-N 3.12Å; A201-V204 PolarHBondContact O-N 3.14Å; V202-V204 PolarHBondContact O-N 3.48Å; V204-S206 VanDerWaalsContact C-N 3.27Å; V204-S206 PolarHBondContact O-N 3.05Å; V204-A207 PolarHBondContact O-N 2.9Å; V204-I208 HydrophobicContact CG1-CD1 3.88Å; V204-I208 WeakPolarHBondContact O-CG1 3.35Å; V204-I208 PolarHBondContact O-N 3.45Å
205L79.8Confident76Confident36 Ų3660.3 Ų60.319%0.18835%0.346CS..Hα-helixtrans-62-38.1178.5-11663000111.7A26 L27 I30 A201 I208 N209A26-L205 HydrophobicContact CB-CD2 3.78Å; L27-L205 HydrophobicContact CB-CD2 4.13Å; L27-L205 HydrophobicContact CD1-CB 4.45Å; I30-L205 HydrophobicContact CD1-CD2 4.12Å; A201-L205 WeakPolarHBondContact O-CB 3.24Å; A201-L205 PolarHBondContact O-N 2.75Å; L205-I208 PolarHBondContact O-N 3.35Å; L205-N209 VanDerWaalsContact O-CB 3.27Å; L205-N209 WeakPolarHBondContact O-CB 3.5Å; L205-N209 VanDerWaalsContact O-CG 3.3Å; L205-N209 PolarHBondContact O-N 2.88Å; L205-N209 PolarHBondContact O-ND2 3.25Å
206S73.3Confident74.9Confident4 Ų461.4 Ų61.43%0.02835%0.35CS..Hα-helixtrans-60.8-46.9174.5-73.10000112.4V202 T203 V204 I208 N209 V210 F284V202-S206 WeakPolarHBondContact O-CB 3.05Å; V202-S206 PolarHBondContact O-N 2.76Å; V202-S206 PolarHBondContact O-OG 2.64Å; T203-S206 WeakPolarHBondContact O-CB 3.37Å; V204-S206 VanDerWaalsContact C-N 3.27Å; V204-S206 PolarHBondContact O-N 3.05Å; S206-I208 VanDerWaalsContact C-N 3.3Å; S206-I208 PolarHBondContact O-N 3.22Å; S206-N209 PolarHBondContact O-N 3.12Å; S206-V210 WeakPolarHBondContact O-CB 3.34Å; S206-V210 PolarHBondContact O-N 3.17Å; S206-F284 WeakPolarHBondContact OG-CE1 3.38Å; S206-F284 WeakPolarHBondContact OG-CZ 3.14Å
207A74.6Confident73.8Confident63 Ų6356.1 Ų56.152%0.52132%0.323SS..Hα-helixtrans-62.1-38.8176.600000111.9T203 V204 G211T203-A207 WeakPolarHBondContact O-CB 3.42Å; T203-A207 PolarHBondContact O-N 3.1Å; V204-A207 PolarHBondContact O-N 2.9Å; A207-G211 VanDerWaalsContact O-CA 3.24Å; A207-G211 WeakPolarHBondContact O-CA 3.34Å; A207-G211 PolarHBondContact O-N 3.3Å
208I76.7Confident72.8Confident115 Ų11554.1 Ų54.159%0.5931%0.311SS*.Hα-helixtrans-70.1-45.6177.4-64.9165.3000111.5V204 L205 S206V204-I208 HydrophobicContact CG1-CD1 3.88Å; V204-I208 WeakPolarHBondContact O-CG1 3.35Å; V204-I208 PolarHBondContact O-N 3.45Å; L205-I208 PolarHBondContact O-N 3.35Å; S206-I208 VanDerWaalsContact C-N 3.3Å; S206-I208 PolarHBondContact O-N 3.22Å
209N68.1Low72.7Confident4 Ų455.4 Ų55.42%0.02132%0.318CS..Hα-helixtrans-73.2-41.2-174.3-78-25.3000112.7P15 T23 D24 L205 S206P15-N209 WeakPolarHBondContact CG-O 3.45Å; T23-N209 WeakPolarHBondContact CB-OD1 3.06Å; T23-N209 PolarHBondContact O-ND2 3.18Å; T23-N209 PolarHBondContact OG1-OD1 2.99Å; D24-N209 VanDerWaalsContact OD1-CG 3.3Å; D24-N209 PolarHBondContact OD1-ND2 2.95Å; L205-N209 VanDerWaalsContact O-CB 3.27Å; L205-N209 WeakPolarHBondContact O-CB 3.5Å; L205-N209 VanDerWaalsContact O-CG 3.3Å; L205-N209 PolarHBondContact O-N 2.88Å; L205-N209 PolarHBondContact O-ND2 3.25Å; S206-N209 PolarHBondContact O-N 3.12Å
210V65.4Low72.9Confident7 Ų758.4 Ų58.44%0.04234%0.337CS..Hα-helixtrans-103.9-23.5-170.9-175.40000112.1F18 S206 K212 S213 I214 P281 F283 F284F18-V210 HydrophobicContact CE2-CG2 3.78Å; F18-V210 HydrophobicContact CZ-CG2 4.07Å; S206-V210 WeakPolarHBondContact O-CB 3.34Å; S206-V210 PolarHBondContact O-N 3.17Å; V210-K212 PolarHBondContact O-N 3.5Å; V210-S213 VanDerWaalsContact O-CB 3.27Å; V210-S213 WeakPolarHBondContact O-CB 3.42Å; V210-S213 PolarHBondContact O-N 3.34Å; V210-I214 HydrophobicContact CG1-CB 4.47Å; V210-P281 HydrophobicContact CG1-CB 4.06Å; V210-F283 HydrophobicContact CG2-CE1 4.11Å; V210-F283 HydrophobicContact CG2-CZ 4.31Å; V210-F284 HydrophobicContact CB-CE2 3.76Å; V210-F284 HydrophobicContact CB-CZ 4.26Å; V210-F284 HydrophobicContact CG1-CE2 3.82Å; V210-F284 HydrophobicContact CG2-CE2 3.61Å; V210-F284 HydrophobicContact CG2-CZ 4.01Å
211G65.6Low73.2Confident39 Ų3958 Ų5840%0.40233%0.332SS..G310 helixtrans49.4-125.9172.800000112.9A207 S213 I214A207-G211 VanDerWaalsContact O-CA 3.24Å; A207-G211 WeakPolarHBondContact O-CA 3.34Å; A207-G211 PolarHBondContact O-N 3.3Å; G211-S213 PolarHBondContact O-N 2.85Å; G211-I214 WeakPolarHBondContact O-CG2 3.37Å
212K59Low73.4Confident186 Ų18656.4 Ų56.481%0.80932%0.318SS*.G310 helixtrans-68.2-17.9178.4-65.2-178.8-179.2177.70113.9V210 I214 M215V210-K212 PolarHBondContact O-N 3.5Å; K212-I214 PolarHBondContact O-N 3.15Å; K212-M215 WeakPolarHBondContact O-CB 3.09Å; K212-M215 VanDerWaalsContact O-CG 3.31Å; K212-M215 WeakPolarHBondContact O-CG 3.46Å; K212-M215 PolarHBondContact O-N 3.18Å; K212-M215 VanDerWaalsContact O-N 3.14Å
213S63.1Low73.8Confident30 Ų3058.8 Ų58.821%0.2133%0.33CS..G310 helixtrans-71.5-9.3-178.4-55.30000113.2V210 G211 M215 F216V210-S213 VanDerWaalsContact O-CB 3.27Å; V210-S213 WeakPolarHBondContact O-CB 3.42Å; V210-S213 PolarHBondContact O-N 3.34Å; G211-S213 PolarHBondContact O-N 2.85Å; S213-M215 PolarHBondContact O-N 2.91Å; S213-F216 VanDerWaalsContact O-CB 3.3Å; S213-F216 WeakPolarHBondContact O-CB 3.33Å; S213-F216 PolarHBondContact O-N 3.12Å; S213-F216 VanDerWaalsContact O-N 3.09Å
214I63.4Low74.6Confident59 Ų5956.3 Ų56.330%0.30332%0.318SS..Hα-helixtrans-62.9-23.8170.3-157.4150.4000111.7V210 G211 K212 F216 A217 M218 F284V210-I214 HydrophobicContact CG1-CB 4.47Å; G211-I214 WeakPolarHBondContact O-CG2 3.37Å; K212-I214 PolarHBondContact O-N 3.15Å; I214-F216 PolarHBondContact O-N 2.89Å; I214-F216 VanDerWaalsContact O-N 3.16Å; I214-A217 WeakPolarHBondContact O-CB 3.48Å; I214-A217 PolarHBondContact O-N 3.16Å; I214-M218 HydrophobicContact CG1-CE 4.4Å; I214-M218 WeakPolarHBondContact O-CG 3.48Å; I214-M218 PolarHBondContact O-N 3.25Å; I214-F284 HydrophobicContact CD1-CD1 4.3Å; I214-F284 HydrophobicContact CD1-CD2 4.01Å; I214-F284 HydrophobicContact CD1-CE1 4.35Å; I214-F284 HydrophobicContact CD1-CE2 4.05Å; I214-F284 HydrophobicContact CD1-CG 4.13Å; I214-F284 HydrophobicContact CD1-CZ 4.23Å; I214-F284 HydrophobicContact CG1-CD2 4.08Å; I214-F284 HydrophobicContact CG1-CE2 4.4Å; I214-F284 HydrophobicContact CG1-CG 4.43Å
215M62.2Low75.2Confident118 Ų11852.7 Ų52.758%0.58130%0.296SS*.Hα-helixtrans-57.2-28.1173.3-68.6-176.865.700112.5K212 S213 M218 T219K212-M215 WeakPolarHBondContact O-CB 3.09Å; K212-M215 VanDerWaalsContact O-CG 3.31Å; K212-M215 WeakPolarHBondContact O-CG 3.46Å; K212-M215 PolarHBondContact O-N 3.18Å; K212-M215 VanDerWaalsContact O-N 3.14Å; S213-M215 PolarHBondContact O-N 2.91Å; M215-M218 CarbonylContact O-C 3.38Å; M215-M218 WeakPolarHBondContact O-CA 3.44Å; M215-M218 WeakPolarHBondContact O-CB 3.26Å; M215-M218 PolarHBondContact O-N 3.01Å; M215-M218 VanDerWaalsContact O-N 3.09Å; M215-T219 PolarHBondContact O-N 3.16Å
216F64.5Low75.8Confident54 Ų5451 Ų5124%0.23729%0.287CS..Hα-helixtrans-65.6-41.2175.7-171.1-89.8000111.8F12 S213 I214 M218 T219 P281 L282F12-F216 HydrophobicContact CB-CE2 4.48Å; F12-F216 HydrophobicContact CD2-CD2 4.41Å; F12-F216 HydrophobicContact CD2-CG 4.48Å; S213-F216 VanDerWaalsContact O-CB 3.3Å; S213-F216 WeakPolarHBondContact O-CB 3.33Å; S213-F216 PolarHBondContact O-N 3.12Å; S213-F216 VanDerWaalsContact O-N 3.09Å; I214-F216 PolarHBondContact O-N 2.89Å; I214-F216 VanDerWaalsContact O-N 3.16Å; F216-M218 PolarHBondContact O-N 3.47Å; F216-T219 PolarHBondContact O-N 2.87Å; F216-T219 PolarHBondContact O-OG1 3.21Å; F216-P281 HydrophobicContact CB-CG 3.85Å; F216-P281 HydrophobicContact CD1-CG 3.64Å; F216-P281 HydrophobicContact CG-CG 4.04Å; F216-L282 HydrophobicContact CE1-CD2 4.29Å; F216-L282 HydrophobicContact CE1-CG 4.44Å
217A62.7Low76.9Confident0 Ų052.3 Ų52.30%030%0.297CS..Hα-helixtrans-67.7-22.1172.900000112.1I214 T219 L222 F284 L288I214-A217 WeakPolarHBondContact O-CB 3.48Å; I214-A217 PolarHBondContact O-N 3.16Å; A217-T219 VanDerWaalsContact C-N 3.3Å; A217-T219 PolarHBondContact O-N 2.99Å; A217-L222 WeakPolarHBondContact O-CB 3.17Å; A217-F284 HydrophobicContact CB-CB 4.12Å; A217-L288 WeakPolarHBondContact O-CD1 3.38Å
218M69.1Low78Confident76 Ų7652.2 Ų52.237%0.37429%0.287SS..THydrogen-bonded Turntrans-90.519.1177.8-56.7-71.614200113.2I214 M215 F216 I223 L288I214-M218 HydrophobicContact CG1-CE 4.4Å; I214-M218 WeakPolarHBondContact O-CG 3.48Å; I214-M218 PolarHBondContact O-N 3.25Å; M215-M218 CarbonylContact O-C 3.38Å; M215-M218 WeakPolarHBondContact O-CA 3.44Å; M215-M218 WeakPolarHBondContact O-CB 3.26Å; M215-M218 PolarHBondContact O-N 3.01Å; M215-M218 VanDerWaalsContact O-N 3.09Å; F216-M218 PolarHBondContact O-N 3.47Å; M218-I223 HydrophobicContact CB-CD1 4.3Å; M218-I223 VanDerWaalsContact O-CD1 3.23Å; M218-I223 WeakPolarHBondContact O-CD1 3.32Å; M218-L288 HydrophobicContact CE-CD1 3.7Å; M218-L288 HydrophobicContact CE-CD2 3.37Å; M218-L288 HydrophobicContact CE-CG 3.54Å; M218-L288 HydrophobicContact SD-CD1 4.08Å; M218-L288 HydrophobicContact SD-CD2 3.62Å; M218-L288 HydrophobicContact SD-CG 4.24Å
219T83.6Confident79Confident42 Ų4246.8 Ų46.826%0.25826%0.259SS..  trans-60.8140173.9-60.20000109.7M215 F216 A217 L221 L222 I223M215-T219 PolarHBondContact O-N 3.16Å; F216-T219 PolarHBondContact O-N 2.87Å; F216-T219 PolarHBondContact O-OG1 3.21Å; A217-T219 VanDerWaalsContact C-N 3.3Å; A217-T219 PolarHBondContact O-N 2.99Å; T219-L221 PolarHBondContact O-N 3.28Å; T219-L222 PolarHBondContact O-N 2.93Å; T219-I223 PolarHBondContact O-N 3.34Å
220P86.9Confident80.4Confident102 Ų10246.6 Ų46.666%0.66226%0.258SS*.Hα-helixtrans-51.3-35.6-177.3-30.235.6000114.4A224P220-A224 VanDerWaalsContact O-CB 3.31Å; P220-A224 WeakPolarHBondContact O-CB 2.98Å; P220-A224 PolarHBondContact O-N 3.48Å
221L90.4Very high81.9Confident75 Ų7551 Ų5139%0.39328%0.277SS..Hα-helixtrans-67.1-41.2177.4-61.3172.5000112.6F83 L85 T219 A224 T225F83-L221 HydrophobicContact CB-CD2 4.15Å; F83-L221 HydrophobicContact CD1-CD2 4.23Å; F83-L221 HydrophobicContact CG-CD2 4.32Å; L85-L221 HydrophobicContact CD2-CB 3.83Å; L85-L221 HydrophobicContact CD2-CD1 4.28Å; T219-L221 PolarHBondContact O-N 3.28Å; L221-A224 PolarHBondContact O-N 3.03Å; L221-T225 WeakPolarHBondContact O-CB 3.42Å; L221-T225 PolarHBondContact O-N 2.97Å; L221-T225 PolarHBondContact O-OG1 3.1Å
222L89.4Confident83.4Confident0 Ų051 Ų510%027%0.268CS..Hα-helixtrans-71.7-36.5177-71.6173.8000111.6L85 E89 I93 A217 T219 T225 S226 L282 F285L85-L222 HydrophobicContact CD1-CD2 4.44Å; E89-L222 HydrophobicContact CB-CD2 4.34Å; I93-L222 HydrophobicContact CG2-CD2 4.3Å; A217-L222 WeakPolarHBondContact O-CB 3.17Å; T219-L222 PolarHBondContact O-N 2.93Å; L222-T225 PolarHBondContact O-N 3.21Å; L222-S226 VanDerWaalsContact O-CB 3.31Å; L222-S226 WeakPolarHBondContact O-CB 3.45Å; L222-S226 PolarHBondContact O-N 3.3Å; L222-S226 PolarHBondContact O-OG 3.12Å; L222-L282 HydrophobicContact CD1-CD2 3.68Å; L222-L282 HydrophobicContact CD2-CD2 4.46Å; L222-F285 HydrophobicContact CD2-CD2 4.06Å; L222-F285 HydrophobicContact CD2-CE2 4.32Å
223I91.6Very high85.2Confident61 Ų6142.2 Ų42.231%0.31323%0.229SC..Hα-helixtrans-61.8-49.5171.7-64.9178.7000110.2M218 T219 T225 S226 S227 F292M218-I223 HydrophobicContact CB-CD1 4.3Å; M218-I223 VanDerWaalsContact O-CD1 3.23Å; M218-I223 WeakPolarHBondContact O-CD1 3.32Å; T219-I223 PolarHBondContact O-N 3.34Å; I223-T225 VanDerWaalsContact C-N 3.32Å; I223-T225 PolarHBondContact O-N 2.9Å; I223-S226 WeakPolarHBondContact CA-OG 3.18Å; I223-S226 PolarHBondContact O-N 3.25Å; I223-S226 PolarHBondContact O-OG 2.73Å; I223-S227 PolarHBondContact O-N 2.79Å; I223-F292 HydrophobicContact CG2-CE2 3.95Å; I223-F292 HydrophobicContact CG2-CZ 3.68Å
224A94.3Very high86.9Confident35 Ų3540.9 Ų40.929%0.28922%0.22SC..Hα-helixtrans-58.8-44.2176.100000111.8F83 P220 L221 S227 L228F83-A224 HydrophobicContact CE2-CB 4.16Å; F83-A224 HydrophobicContact CZ-CB 4.08Å; P220-A224 VanDerWaalsContact O-CB 3.31Å; P220-A224 WeakPolarHBondContact O-CB 2.98Å; P220-A224 PolarHBondContact O-N 3.48Å; L221-A224 PolarHBondContact O-N 3.03Å; A224-S227 PolarHBondContact O-N 3.32Å; A224-L228 WeakPolarHBondContact O-CB 3.21Å; A224-L228 VanDerWaalsContact O-CG 3.28Å; A224-L228 WeakPolarHBondContact O-CG 3.49Å; A224-L228 PolarHBondContact O-N 3.33Å
225T94.5Very high88.5Confident0 Ų042.3 Ų42.30%023%0.227CC..Hα-helixtrans-64.4-45.6178.6-54.70000111.9L79 F83 I93 L221 L222 I223 S227 L228 M229 F285L79-T225 HydrophobicContact CB-CG2 4.1Å; L79-T225 HydrophobicContact CD1-CG2 4.12Å; F83-T225 WeakPolarHBondContact CD2-OG1 3.29Å; I93-T225 HydrophobicContact CB-CG2 4.32Å; I93-T225 HydrophobicContact CD1-CG2 3.76Å; I93-T225 HydrophobicContact CG2-CG2 4.01Å; L221-T225 WeakPolarHBondContact O-CB 3.42Å; L221-T225 PolarHBondContact O-N 2.97Å; L221-T225 PolarHBondContact O-OG1 3.1Å; L222-T225 PolarHBondContact O-N 3.21Å; I223-T225 VanDerWaalsContact C-N 3.32Å; I223-T225 PolarHBondContact O-N 2.9Å; T225-S227 VanDerWaalsContact C-N 3.28Å; T225-S227 PolarHBondContact O-N 3.04Å; T225-L228 PolarHBondContact O-N 2.94Å; T225-M229 HydrophobicContact CG2-CG 4.1Å; T225-M229 HydrophobicContact CG2-SD 3.97Å; T225-M229 WeakPolarHBondContact O-CB 3.26Å; T225-M229 WeakPolarHBondContact O-CG 3.23Å; T225-M229 PolarHBondContact O-N 3.24Å; T225-F285 HydrophobicContact CG2-CE2 4.42Å; T225-F285 HydrophobicContact CG2-CZ 4.3Å
226S94.1Very high90.1Very high0 Ų040 Ų400%022%0.217CC..Hα-helixtrans-67-24.9-179.955.70000113.8L222 I223 P230 F292L222-S226 VanDerWaalsContact O-CB 3.31Å; L222-S226 WeakPolarHBondContact O-CB 3.45Å; L222-S226 PolarHBondContact O-N 3.3Å; L222-S226 PolarHBondContact O-OG 3.12Å; I223-S226 WeakPolarHBondContact CA-OG 3.18Å; I223-S226 PolarHBondContact O-N 3.25Å; I223-S226 PolarHBondContact O-OG 2.73Å; S226-P230 WeakPolarHBondContact O-CD 3.34Å; S226-P230 WeakPolarHBondContact O-CG 3.24Å; S226-F292 WeakPolarHBondContact O-CB 3.45Å; S226-F292 WeakPolarHBondContact OG-CD2 3.12Å; S226-F292 WeakPolarHBondContact OG-CE2 3.5Å
227S96.1Very high91.6Very high33 Ų3337.4 Ų37.423%0.23121%0.206CC..Hα-helixtrans-81.7-45.2168.8-176.60000112.4I223 A224 T225 M229 P230 F231 F292 E296I223-S227 PolarHBondContact O-N 2.79Å; A224-S227 PolarHBondContact O-N 3.32Å; T225-S227 VanDerWaalsContact C-N 3.28Å; T225-S227 PolarHBondContact O-N 3.04Å; S227-M229 PolarHBondContact O-N 3.3Å; S227-P230 VanDerWaalsContact O-CD 3.25Å; S227-P230 WeakPolarHBondContact O-CD 3.12Å; S227-P230 WeakPolarHBondContact O-CG 3.22Å; S227-F231 WeakPolarHBondContact O-CB 3.29Å; S227-F231 PolarHBondContact O-N 3.44Å; S227-F292 VanDerWaalsContact CB-CD1 3.43Å; S227-E296 PolarHBondContact OG-OE1 3.37Å
228L97.3Very high93.2Very high61 Ų6142.1 Ų42.132%0.31922%0.224SC..Hα-helixtrans-68.8-36-175.2-73.9172.2000113.3L79 F83 A224 T225 F231 I232L79-L228 HydrophobicContact CD1-CB 3.99Å; L79-L228 HydrophobicContact CD2-CB 4.35Å; L79-L228 HydrophobicContact CD2-CD1 4.12Å; F83-L228 HydrophobicContact CE2-CD1 3.91Å; F83-L228 HydrophobicContact CZ-CD1 3.6Å; A224-L228 WeakPolarHBondContact O-CB 3.21Å; A224-L228 VanDerWaalsContact O-CG 3.28Å; A224-L228 WeakPolarHBondContact O-CG 3.49Å; A224-L228 PolarHBondContact O-N 3.33Å; T225-L228 PolarHBondContact O-N 2.94Å; L228-F231 PolarHBondContact O-N 2.66Å; L228-I232 HydrophobicContact CB-CD1 4.19Å; L228-I232 VanDerWaalsContact O-CB 3.27Å; L228-I232 WeakPolarHBondContact O-CB 3.42Å; L228-I232 WeakPolarHBondContact O-CD1 3.37Å; L228-I232 WeakPolarHBondContact O-CG1 3.41Å; L228-I232 PolarHBondContact O-N 3.05Å
229M97.1Very high94.5Very high0 Ų041.4 Ų41.40%022%0.224CC..Hα-helixtrans-57.3-57179.5-75-176.567.100113.4M72 T75 A76 L79 I93 T225 S227 F231 I232 G233 F285 Y289M72-M229 WeakPolarHBondContact CE-O 3.44Å; T75-M229 HydrophobicContact CG2-CG 4.32Å; A76-M229 HydrophobicContact CB-CE 3.6Å; A76-M229 HydrophobicContact CB-SD 4.22Å; L79-M229 HydrophobicContact CD1-CB 4.46Å; L79-M229 HydrophobicContact CD1-CG 3.51Å; I93-M229 HydrophobicContact CB-SD 4.12Å; T225-M229 HydrophobicContact CG2-CG 4.1Å; T225-M229 HydrophobicContact CG2-SD 3.97Å; T225-M229 WeakPolarHBondContact O-CB 3.26Å; T225-M229 WeakPolarHBondContact O-CG 3.23Å; T225-M229 PolarHBondContact O-N 3.24Å; S227-M229 PolarHBondContact O-N 3.3Å; M229-F231 VanDerWaalsContact C-N 3.33Å; M229-F231 PolarHBondContact O-N 3.25Å; M229-I232 PolarHBondContact O-N 3.09Å; M229-G233 PolarHBondContact O-N 3.25Å; M229-F285 HydrophobicContact SD-CE1 4.39Å; M229-F285 HydrophobicContact SD-CZ 4.04Å; M229-Y289 HydrophobicContact CB-CD2 4.26Å; M229-Y289 HydrophobicContact CB-CE2 3.6Å; M229-Y289 HydrophobicContact CE-CE2 4.18Å; M229-Y289 HydrophobicContact SD-CE2 4.44Å
230P97.1Very high95.1Very high0 Ų041.1 Ų41.10%022%0.221CC..Hα-helixtrans-61.3-41.4177.921-29000111.8S226 S227 I232 G233 F234 Y289 F292 Q293 E296S226-P230 WeakPolarHBondContact O-CD 3.34Å; S226-P230 WeakPolarHBondContact O-CG 3.24Å; S227-P230 VanDerWaalsContact O-CD 3.25Å; S227-P230 WeakPolarHBondContact O-CD 3.12Å; S227-P230 WeakPolarHBondContact O-CG 3.22Å; P230-I232 PolarHBondContact O-N 3.16Å; P230-G233 CarbonylContact O-C 3.56Å; P230-G233 WeakPolarHBondContact O-CA 3.09Å; P230-G233 PolarHBondContact O-N 3.14Å; P230-G233 VanDerWaalsContact O-N 3.13Å; P230-F234 HydrophobicContact CB-CE2 4Å; P230-F234 WeakPolarHBondContact O-CD2 3.27Å; P230-F234 WeakPolarHBondContact O-CG 3.33Å; P230-F234 PolarHBondContact O-N 3.06Å; P230-Y289 WeakPolarHBondContact CA-OH 3.49Å; P230-Y289 HydrophobicContact CB-CE1 4.11Å; P230-Y289 HydrophobicContact CB-CE2 4.42Å; P230-Y289 HydrophobicContact CG-CE1 4.44Å; P230-Y289 HydrophobicContact CG-CE2 4.28Å; P230-F292 HydrophobicContact CG-CB 4.16Å; P230-Q293 HydrophobicContact CB-CB 3.73Å; P230-Q293 HydrophobicContact CG-CB 4.26Å; P230-E296 WeakPolarHBondContact CG-OE2 3.48Å
231F97.5Very high95.4Very high100 Ų10036.2 Ų36.244%0.43919%0.189SC..Hα-helixtrans-58.1-51.4178.6-179.7-103.9000112.5S227 L228 M229 G233 F234 L235 E296S227-F231 WeakPolarHBondContact O-CB 3.29Å; S227-F231 PolarHBondContact O-N 3.44Å; L228-F231 PolarHBondContact O-N 2.66Å; M229-F231 VanDerWaalsContact C-N 3.33Å; M229-F231 PolarHBondContact O-N 3.25Å; F231-G233 VanDerWaalsContact C-N 3.26Å; F231-G233 PolarHBondContact O-N 3.19Å; F231-F234 PolarHBondContact O-N 3.19Å; F231-L235 HydrophobicContact CE1-CD2 4.41Å; F231-L235 WeakPolarHBondContact O-CB 3.46Å; F231-L235 PolarHBondContact O-N 2.96Å; F231-E296 VanDerWaalsContact CA-OE2 3.23Å; F231-E296 WeakPolarHBondContact CA-OE2 2.93Å; F231-E296 WeakPolarHBondContact CB-OE2 3.5Å; F231-E296 PolarHBondContact N-OE2 2.92Å
232I97.8Very high95.5Very high40 Ų4034 Ų3421%0.20518%0.181CC..Hα-helixtrans-61.2-40176.7-69.3167.4000109.8T75 L79 L228 M229 P230 L235 L236T75-I232 HydrophobicContact CG2-CB 3.9Å; T75-I232 HydrophobicContact CG2-CD1 3.79Å; T75-I232 HydrophobicContact CG2-CG1 4.46Å; T75-I232 HydrophobicContact CG2-CG2 3.66Å; T75-I232 WeakPolarHBondContact OG1-CG2 3.15Å; L79-I232 HydrophobicContact CD1-CD1 4.3Å; L79-I232 HydrophobicContact CD2-CD1 4.43Å; L228-I232 HydrophobicContact CB-CD1 4.19Å; L228-I232 VanDerWaalsContact O-CB 3.27Å; L228-I232 WeakPolarHBondContact O-CB 3.42Å; L228-I232 WeakPolarHBondContact O-CD1 3.37Å; L228-I232 WeakPolarHBondContact O-CG1 3.41Å; L228-I232 PolarHBondContact O-N 3.05Å; M229-I232 PolarHBondContact O-N 3.09Å; P230-I232 PolarHBondContact O-N 3.16Å; I232-L235 PolarHBondContact O-N 3.22Å; I232-L236 HydrophobicContact CG2-CD1 3.47Å; I232-L236 VanDerWaalsContact CG2-CD1 3.47Å; I232-L236 HydrophobicContact CG2-CG 3.91Å; I232-L236 VanDerWaalsContact O-CB 3.28Å; I232-L236 WeakPolarHBondContact O-CB 3.3Å; I232-L236 WeakPolarHBondContact O-CG 3.29Å; I232-L236 PolarHBondContact O-N 3.16Å
233G97.3Very high95.8Very high0 Ų040 Ų400%021%0.213CC..Hα-helixtrans-55.1-54.4172.900000114.5M229 P230 F231 L235 G237 T258M229-G233 PolarHBondContact O-N 3.25Å; P230-G233 CarbonylContact O-C 3.56Å; P230-G233 WeakPolarHBondContact O-CA 3.09Å; P230-G233 PolarHBondContact O-N 3.14Å; P230-G233 VanDerWaalsContact O-N 3.13Å; F231-G233 VanDerWaalsContact C-N 3.26Å; F231-G233 PolarHBondContact O-N 3.19Å; G233-L235 VanDerWaalsContact C-N 3.32Å; G233-L235 PolarHBondContact O-N 3.44Å; G233-G237 WeakPolarHBondContact O-CA 3.24Å; G233-G237 PolarHBondContact O-N 3.5Å; G233-T258 WeakPolarHBondContact O-CB 3.48Å; G233-T258 WeakPolarHBondContact O-CG2 3.48Å
234F97.3Very high95.8Very high3 Ų343.1 Ų43.11%0.01322%0.224CC..Hα-helixtrans-59.1-46.2177.7-65-51.5000110.8P230 F231 Y238 S255 M256 E296 L300P230-F234 HydrophobicContact CB-CE2 4Å; P230-F234 WeakPolarHBondContact O-CD2 3.27Å; P230-F234 WeakPolarHBondContact O-CG 3.33Å; P230-F234 PolarHBondContact O-N 3.06Å; F231-F234 PolarHBondContact O-N 3.19Å; F234-Y238 WeakPolarHBondContact O-CB 3.37Å; F234-Y238 PolarHBondContact O-N 3.33Å; F234-Y238 VanDerWaalsContact O-N 3.14Å; F234-S255 WeakPolarHBondContact CD1-O 3.32Å; F234-S255 WeakPolarHBondContact O-CB 3.43Å; F234-S255 PolarHBondContact O-OG 2.89Å; F234-M256 HydrophobicContact CD1-SD 3.93Å; F234-M256 HydrophobicContact CE1-SD 3.81Å; F234-E296 HydrophobicContact CD2-CB 4.32Å; F234-E296 HydrophobicContact CE2-CB 3.99Å; F234-L300 HydrophobicContact CB-CD1 3.62Å; F234-L300 HydrophobicContact CD1-CD1 4.26Å; F234-L300 HydrophobicContact CD2-CD1 3.74Å; F234-L300 HydrophobicContact CE2-CD1 4.48Å; F234-L300 HydrophobicContact CG-CD1 3.62Å
235L97.3Very high95.6Very high88 Ų8846.2 Ų46.246%0.46124%0.243SC..Hα-helixtrans-65.9-57.1-177.6179.162.1000111.9F231 I232 G233 G237 Y238 V239F231-L235 HydrophobicContact CE1-CD2 4.41Å; F231-L235 WeakPolarHBondContact O-CB 3.46Å; F231-L235 PolarHBondContact O-N 2.96Å; I232-L235 PolarHBondContact O-N 3.22Å; G233-L235 VanDerWaalsContact C-N 3.32Å; G233-L235 PolarHBondContact O-N 3.44Å; L235-G237 VanDerWaalsContact C-N 3.34Å; L235-G237 PolarHBondContact O-N 3.33Å; L235-Y238 WeakPolarHBondContact O-CB 3.17Å; L235-Y238 PolarHBondContact O-N 3.45Å; L235-Y238 VanDerWaalsContact O-N 3.15Å; L235-V239 HydrophobicContact CD1-CG2 4.39Å; L235-V239 WeakPolarHBondContact O-CG2 3.35Å; L235-V239 PolarHBondContact O-N 3.4Å
236L97Very high95.4Very high70 Ų7047.2 Ų47.237%0.36625%0.248SC..Hα-helixtrans-70-31.9-176-64.9-174.7000111.9I71 I232 Y238 V239 L240I71-L236 HydrophobicContact CD1-CB 3.89Å; I71-L236 HydrophobicContact CG2-CB 3.77Å; I71-L236 HydrophobicContact CG2-CD1 3.79Å; I71-L236 HydrophobicContact CG2-CG 4.41Å; I232-L236 HydrophobicContact CG2-CD1 3.47Å; I232-L236 VanDerWaalsContact CG2-CD1 3.47Å; I232-L236 HydrophobicContact CG2-CG 3.91Å; I232-L236 VanDerWaalsContact O-CB 3.28Å; I232-L236 WeakPolarHBondContact O-CB 3.3Å; I232-L236 WeakPolarHBondContact O-CG 3.29Å; I232-L236 PolarHBondContact O-N 3.16Å; L236-Y238 VanDerWaalsContact C-N 3.31Å; L236-Y238 PolarHBondContact O-N 3.02Å; L236-V239 PolarHBondContact O-N 2.87Å; L236-L240 WeakPolarHBondContact O-CB 3.49Å; L236-L240 PolarHBondContact O-N 3.03Å
237G96.2Very high95.2Very high0 Ų050.7 Ų50.70%027%0.266CS..Hα-helixtrans-61.5-39.8170.200000112.2G233 L235 S241G233-G237 WeakPolarHBondContact O-CA 3.24Å; G233-G237 PolarHBondContact O-N 3.5Å; L235-G237 VanDerWaalsContact C-N 3.34Å; L235-G237 PolarHBondContact O-N 3.33Å; G237-S241 WeakPolarHBondContact O-CB 3.47Å; G237-S241 PolarHBondContact O-N 3.47Å; G237-S241 VanDerWaalsContact O-N 3.14Å; G237-S241 PolarHBondContact O-OG 2.87Å
238Y95.7Very high94.9Very high98 Ų9850.7 Ų50.738%0.38427%0.272SS..Hα-helixtrans-67.2-46.1173.7-170.1-90.6000112.1F234 L235 L236 S241 A242 R251 R252F234-Y238 WeakPolarHBondContact O-CB 3.37Å; F234-Y238 PolarHBondContact O-N 3.33Å; F234-Y238 VanDerWaalsContact O-N 3.14Å; L235-Y238 WeakPolarHBondContact O-CB 3.17Å; L235-Y238 PolarHBondContact O-N 3.45Å; L235-Y238 VanDerWaalsContact O-N 3.15Å; L236-Y238 VanDerWaalsContact C-N 3.31Å; L236-Y238 PolarHBondContact O-N 3.02Å; Y238-S241 WeakPolarHBondContact CA-OG 3.4Å; Y238-S241 PolarHBondContact O-N 2.73Å; Y238-S241 PolarHBondContact O-OG 3.27Å; Y238-A242 WeakPolarHBondContact O-CB 3.33Å; Y238-A242 PolarHBondContact O-N 3.42Å; Y238-R251 HydrophobicContact CD2-CB 4.07Å; Y238-R251 HydrophobicContact CE2-CB 3.85Å; Y238-R252 HydrophobicContact CE2-CG 4.28Å
239V96.3Very high94.7Very high61 Ų6153.8 Ų53.837%0.3728%0.279SS..Hα-helixtrans-63.5-48.5-179.7172.10000110.8L235 L236 S241 A242 L243L235-V239 HydrophobicContact CD1-CG2 4.39Å; L235-V239 WeakPolarHBondContact O-CG2 3.35Å; L235-V239 PolarHBondContact O-N 3.4Å; L236-V239 PolarHBondContact O-N 2.87Å; V239-S241 VanDerWaalsContact C-N 3.33Å; V239-S241 PolarHBondContact O-N 3.12Å; V239-A242 WeakPolarHBondContact O-CA 3.47Å; V239-A242 WeakPolarHBondContact O-CB 3.31Å; V239-A242 PolarHBondContact O-N 2.98Å; V239-A242 VanDerWaalsContact O-N 3.08Å; V239-L243 HydrophobicContact CG1-CD1 4.09Å; V239-L243 HydrophobicContact CG1-CG 4.33Å; V239-L243 WeakPolarHBondContact O-CG 3.25Å; V239-L243 PolarHBondContact O-N 2.89Å
240L95.3Very high94.5Very high36 Ų3654.3 Ų54.319%0.18828%0.283CS..Hα-helixtrans-58.7-47178.9-170.972.3000110.7I63 V66 A67 I71 L236 A242 L243 F244I63-L240 HydrophobicContact CG2-CD2 4.27Å; I63-L240 HydrophobicContact CG2-CG 4.36Å; V66-L240 HydrophobicContact CG1-CD2 4.38Å; A67-L240 HydrophobicContact CB-CD2 3.91Å; I71-L240 HydrophobicContact CD1-CB 4.21Å; I71-L240 HydrophobicContact CD1-CD2 3.92Å; L236-L240 WeakPolarHBondContact O-CB 3.49Å; L236-L240 PolarHBondContact O-N 3.03Å; L240-A242 VanDerWaalsContact C-N 3.27Å; L240-A242 PolarHBondContact O-N 3.21Å; L240-L243 PolarHBondContact O-N 2.95Å; L240-F244 HydrophobicContact CD1-CD2 4.18Å; L240-F244 HydrophobicContact CD1-CE2 3.72Å; L240-F244 HydrophobicContact CG-CD2 4.14Å; L240-F244 HydrophobicContact CG-CE2 4.1Å; L240-F244 VanDerWaalsContact O-CD2 3.29Å; L240-F244 WeakPolarHBondContact O-CD2 3.38Å; L240-F244 PolarHBondContact O-N 2.97Å; L240-F244 VanDerWaalsContact O-N 3.16Å
241S93.8Very high94.4Very high0 Ų057.6 Ų57.60%030%0.295CS..Hα-helixtrans-65.6-30.3177.657.60000113.3G237 Y238 V239 C245 L246 R251G237-S241 WeakPolarHBondContact O-CB 3.47Å; G237-S241 PolarHBondContact O-N 3.47Å; G237-S241 VanDerWaalsContact O-N 3.14Å; G237-S241 PolarHBondContact O-OG 2.87Å; Y238-S241 WeakPolarHBondContact CA-OG 3.4Å; Y238-S241 PolarHBondContact O-N 2.73Å; Y238-S241 PolarHBondContact O-OG 3.27Å; V239-S241 VanDerWaalsContact C-N 3.33Å; V239-S241 PolarHBondContact O-N 3.12Å; S241-C245 PolarHBondContact O-N 3.28Å; S241-L246 VanDerWaalsContact CB-CD1 3.47Å; S241-L246 WeakPolarHBondContact O-CB 3.08Å; S241-L246 PolarHBondContact O-N 2.92Å; S241-R251 VanDerWaalsContact OG-CA 3.31Å; S241-R251 WeakPolarHBondContact OG-CA 3.44Å; S241-R251 WeakPolarHBondContact OG-CB 3.4Å
242A93.3Very high94.3Very high28 Ų2854.9 Ų54.923%0.23128%0.282CS..Hα-helixtrans-69.2-41.9172.600000112.7Y238 V239 L240 F244 C245Y238-A242 WeakPolarHBondContact O-CB 3.33Å; Y238-A242 PolarHBondContact O-N 3.42Å; V239-A242 WeakPolarHBondContact O-CA 3.47Å; V239-A242 WeakPolarHBondContact O-CB 3.31Å; V239-A242 PolarHBondContact O-N 2.98Å; V239-A242 VanDerWaalsContact O-N 3.08Å; L240-A242 VanDerWaalsContact C-N 3.27Å; L240-A242 PolarHBondContact O-N 3.21Å; A242-F244 VanDerWaalsContact C-N 3.28Å; A242-F244 PolarHBondContact O-N 3.42Å; A242-C245 WeakPolarHBondContact O-CA 3.5Å; A242-C245 PolarHBondContact O-N 3.48Å
243L94.6Very high94.1Very high126 Ų12653 Ų5366%0.6627%0.272SS*.Hα-helixtrans-62-35.9177.7-70.3173.1000112.3V239 L240 C245V239-L243 HydrophobicContact CG1-CD1 4.09Å; V239-L243 HydrophobicContact CG1-CG 4.33Å; V239-L243 WeakPolarHBondContact O-CG 3.25Å; V239-L243 PolarHBondContact O-N 2.89Å; L240-L243 PolarHBondContact O-N 2.95Å; L243-C245 PolarHBondContact O-N 3.3Å
244F92.3Very high94Very high127 Ų12753 Ų5356%0.55727%0.272SS*.THydrogen-bonded Turntrans-86.615.7173.7-72.3-75.6000113.8I63 L240 A242 L246I63-F244 HydrophobicContact CD1-CB 3.4Å; I63-F244 HydrophobicContact CD1-CD1 4.46Å; I63-F244 HydrophobicContact CD1-CD2 4.34Å; I63-F244 HydrophobicContact CD1-CG 3.85Å; I63-F244 HydrophobicContact CG1-CB 4.13Å; I63-F244 HydrophobicContact CG1-CD2 4.13Å; I63-F244 HydrophobicContact CG1-CG 4.06Å; I63-F244 HydrophobicContact CG2-CD2 4.26Å; L240-F244 HydrophobicContact CD1-CD2 4.18Å; L240-F244 HydrophobicContact CD1-CE2 3.72Å; L240-F244 HydrophobicContact CG-CD2 4.14Å; L240-F244 HydrophobicContact CG-CE2 4.1Å; L240-F244 VanDerWaalsContact O-CD2 3.29Å; L240-F244 WeakPolarHBondContact O-CD2 3.38Å; L240-F244 PolarHBondContact O-N 2.97Å; L240-F244 VanDerWaalsContact O-N 3.16Å; A242-F244 VanDerWaalsContact C-N 3.28Å; A242-F244 PolarHBondContact O-N 3.42Å; F244-L246 VanDerWaalsContact C-N 3.27Å; F244-L246 PolarHBondContact O-N 2.95Å; F244-L246 VanDerWaalsContact O-N 3.16Å
245C89.9Confident94Very high99 Ų9953.2 Ų53.267%0.66927%0.274SS*.THydrogen-bonded Turntrans55.334.3172.9-61.90000114.8S241 A242 L243S241-C245 PolarHBondContact O-N 3.28Å; A242-C245 WeakPolarHBondContact O-CA 3.5Å; A242-C245 PolarHBondContact O-N 3.48Å; L243-C245 PolarHBondContact O-N 3.3Å
246L89.5Confident93.9Very high21 Ų2149.1 Ų49.111%0.1125%0.253CS..  trans-63.2157.4172.9-82.3144.4000111.2I63 S241 F244 C250 R251 V254I63-L246 HydrophobicContact CB-CD1 4.16Å; I63-L246 HydrophobicContact CD1-CD1 3.49Å; I63-L246 VanDerWaalsContact CD1-CD1 3.49Å; I63-L246 HydrophobicContact CD1-CG 4.08Å; I63-L246 HydrophobicContact CG1-CD1 4.42Å; I63-L246 HydrophobicContact CG2-CD1 3.86Å; S241-L246 VanDerWaalsContact CB-CD1 3.47Å; S241-L246 WeakPolarHBondContact O-CB 3.08Å; S241-L246 PolarHBondContact O-N 2.92Å; F244-L246 VanDerWaalsContact C-N 3.27Å; F244-L246 PolarHBondContact O-N 2.95Å; F244-L246 VanDerWaalsContact O-N 3.16Å; L246-C250 HydrophobicContact CB-CB 4.13Å; L246-C250 HydrophobicContact CD2-CB 3.71Å; L246-R251 HydrophobicContact CB-CG 3.91Å; L246-R251 PolarHBondContact O-NE 3.42Å; L246-R251 PolarHBondContact O-NH2 3.47Å; L246-V254 HydrophobicContact CD1-CG2 4.37Å
247N90.6Very high93.8Very high73 Ų7345.9 Ų45.939%0.3924%0.236SC..  trans-66.8153.3174.3-70.9-17.2000111R249 C250 R251N247-R249 PolarHBondContact O-N 3.37Å; N247-R249 VanDerWaalsContact O-N 3.1Å; N247-C250 WeakPolarHBondContact O-CA 3.45Å; N247-C250 PolarHBondContact O-N 3.03Å; N247-R251 PolarHBondContact O-N 2.88Å
248G90.7Very high93.8Very high33 Ų3345.9 Ų45.934%0.3424%0.236SC..Hα-helixtrans-55.1-34.5-176.600000114.2R252G248-R252 WeakPolarHBondContact O-CG 3.49Å; G248-R252 PolarHBondContact O-N 3.32Å; G248-R252 PolarHBondContact O-NH1 2.98Å; G248-R252 VanDerWaalsContact O-NH1 3.15Å
249R93.1Very high93.8Very high126 Ų12641.2 Ų41.248%0.47522%0.217SC..Hα-helixtrans-62-49.2172.4-73.3-173.9-93.6-158.9-10.7111.7G114 N247 R252 T253 E342G114-R249 WeakPolarHBondContact CA-O 3.41Å; N247-R249 PolarHBondContact O-N 3.37Å; N247-R249 VanDerWaalsContact O-N 3.1Å; R249-R252 PolarHBondContact O-N 2.91Å; R249-T253 PolarHBondContact O-N 2.89Å; R249-T253 VanDerWaalsContact O-N 3.15Å; R249-T253 PolarHBondContact O-OG1 3.48Å; R249-E342 IonicContact CZ-OE2 2.79Å; R249-E342 IonicContact NH1-OE2 2.73Å; R249-E342 IonicContact NH2-OE2 3.99Å; R249-E342 PolarHBondContact NH2-OE2 2.99Å
250C91.7Very high93.7Very high12 Ų1238.3 Ų38.38%0.08120%0.2CC..Hα-helixtrans-68.1-37.2-179.9-54.40000112.3L118 L246 N247 R252 T253 V254L118-C250 HydrophobicContact CD2-CB 3.69Å; L246-C250 HydrophobicContact CB-CB 4.13Å; L246-C250 HydrophobicContact CD2-CB 3.71Å; N247-C250 WeakPolarHBondContact O-CA 3.45Å; N247-C250 PolarHBondContact O-N 3.03Å; C250-R252 VanDerWaalsContact C-N 3.33Å; C250-R252 PolarHBondContact O-N 3.25Å; C250-T253 WeakPolarHBondContact O-CB 3.47Å; C250-T253 PolarHBondContact O-N 3.44Å; C250-V254 WeakPolarHBondContact O-CG2 3.23Å; C250-V254 PolarHBondContact O-N 3.37Å
251R94.9Very high93.7Very high68 Ų6836.7 Ų36.726%0.25719%0.191SC..Hα-helixtrans-59.3-44.2176.2-65.9-179.2-163.7176.75.9112.2Y238 S241 L246 N247 T253 V254 S255Y238-R251 HydrophobicContact CD2-CB 4.07Å; Y238-R251 HydrophobicContact CE2-CB 3.85Å; S241-R251 VanDerWaalsContact OG-CA 3.31Å; S241-R251 WeakPolarHBondContact OG-CA 3.44Å; S241-R251 WeakPolarHBondContact OG-CB 3.4Å; L246-R251 HydrophobicContact CB-CG 3.91Å; L246-R251 PolarHBondContact O-NE 3.42Å; L246-R251 PolarHBondContact O-NH2 3.47Å; N247-R251 PolarHBondContact O-N 2.88Å; R251-T253 VanDerWaalsContact C-N 3.34Å; R251-V254 PolarHBondContact O-N 3.39Å; R251-S255 VanDerWaalsContact O-CB 3.32Å; R251-S255 WeakPolarHBondContact O-CB 3.31Å; R251-S255 PolarHBondContact O-N 3.03Å
252R95.2Very high93.7Very high44 Ų4437 Ų3717%0.16619%0.193CC..Hα-helixtrans-64.4-39.7175.8-67.9-173-57.1-94.37.2111.5M112 K113 Y238 G248 R249 C250 S255 M256M112-R252 HydrophobicContact CB-CB 4.38Å; M112-R252 WeakPolarHBondContact O-CD 3.39Å; M112-R252 PolarHBondContact O-NE 3.24Å; K113-R252 PolarHBondContact O-NH2 2.87Å; Y238-R252 HydrophobicContact CE2-CG 4.28Å; G248-R252 WeakPolarHBondContact O-CG 3.49Å; G248-R252 PolarHBondContact O-N 3.32Å; G248-R252 PolarHBondContact O-NH1 2.98Å; G248-R252 VanDerWaalsContact O-NH1 3.15Å; R249-R252 PolarHBondContact O-N 2.91Å; C250-R252 VanDerWaalsContact C-N 3.33Å; C250-R252 PolarHBondContact O-N 3.25Å; R252-S255 WeakPolarHBondContact O-CB 3.33Å; R252-M256 WeakPolarHBondContact O-CG 3.37Å; R252-M256 PolarHBondContact O-N 2.9Å
253T95Very high93.6Very high0 Ų035.9 Ų35.90%018%0.183CC..Hα-helixtrans-61.9-50.1173.8-58.90000112D115 L118 M122 R249 C250 R251 S255 M256 E257D115-T253 WeakPolarHBondContact CA-OG1 3.48Å; D115-T253 PolarHBondContact N-OG1 3.47Å; D115-T253 VanDerWaalsContact O-CG2 3.28Å; D115-T253 WeakPolarHBondContact O-CG2 3.15Å; D115-T253 PolarHBondContact O-OG1 3.46Å; L118-T253 HydrophobicContact CB-CG2 4.13Å; L118-T253 HydrophobicContact CD2-CG2 4.27Å; L118-T253 HydrophobicContact CG-CG2 4.15Å; M122-T253 HydrophobicContact SD-CG2 4.04Å; R249-T253 PolarHBondContact O-N 2.89Å; R249-T253 VanDerWaalsContact O-N 3.15Å; R249-T253 PolarHBondContact O-OG1 3.48Å; C250-T253 WeakPolarHBondContact O-CB 3.47Å; C250-T253 PolarHBondContact O-N 3.44Å; R251-T253 VanDerWaalsContact C-N 3.34Å; T253-S255 VanDerWaalsContact C-N 3.29Å; T253-S255 PolarHBondContact O-N 3.14Å; T253-M256 PolarHBondContact O-N 3.31Å; T253-E257 VanDerWaalsContact O-CB 3.3Å; T253-E257 WeakPolarHBondContact O-CB 3.34Å; T253-E257 PolarHBondContact O-N 3.48Å
254V95.3Very high93.4Very high0 Ų030.6 Ų30.60%016%0.155CC..Hα-helixtrans-62-40-179.8176.70000111A64 A67 M122 L246 C250 R251 E257 T258A64-V254 HydrophobicContact CB-CG1 4.47Å; A64-V254 HydrophobicContact CB-CG2 4.34Å; A67-V254 HydrophobicContact CB-CG1 4.21Å; M122-V254 HydrophobicContact CE-CG2 3.54Å; M122-V254 HydrophobicContact SD-CG2 4.23Å; L246-V254 HydrophobicContact CD1-CG2 4.37Å; C250-V254 WeakPolarHBondContact O-CG2 3.23Å; C250-V254 PolarHBondContact O-N 3.37Å; R251-V254 PolarHBondContact O-N 3.39Å; V254-E257 PolarHBondContact O-N 3.15Å; V254-T258 WeakPolarHBondContact O-CB 3.33Å; V254-T258 PolarHBondContact O-N 3.42Å; V254-T258 PolarHBondContact O-OG1 3.4Å
255S96.3Very high93.3Very high8 Ų824.5 Ų24.56%0.05613%0.129CC..Hα-helixtrans-55.8-55.8172.9176.80000111.5F234 R251 R252 T253 E257 T258 G259F234-S255 WeakPolarHBondContact CD1-O 3.32Å; F234-S255 WeakPolarHBondContact O-CB 3.43Å; F234-S255 PolarHBondContact O-OG 2.89Å; R251-S255 VanDerWaalsContact O-CB 3.32Å; R251-S255 WeakPolarHBondContact O-CB 3.31Å; R251-S255 PolarHBondContact O-N 3.03Å; R252-S255 WeakPolarHBondContact O-CB 3.33Å; T253-S255 VanDerWaalsContact C-N 3.29Å; T253-S255 PolarHBondContact O-N 3.14Å; S255-E257 VanDerWaalsContact C-N 3.33Å; S255-E257 PolarHBondContact O-N 3.07Å; S255-T258 PolarHBondContact O-N 3.42Å; S255-G259 PolarHBondContact O-N 3.29Å; S255-G259 VanDerWaalsContact O-N 3.1Å
256M96Very high93.4Very high1 Ų119.8 Ų19.81%0.00510%0.097CC..Hα-helixtrans-64.1-37.9-179.2-67.2-57.4161.200112.6F108 M112 F234 R252 T253 C260 L300F108-M256 HydrophobicContact CB-CB 4.19Å; F108-M256 HydrophobicContact CB-CG 3.9Å; F108-M256 HydrophobicContact CB-SD 3.69Å; F108-M256 HydrophobicContact CD2-SD 4.25Å; F108-M256 HydrophobicContact CG-SD 4.38Å; M112-M256 HydrophobicContact CE-CE 3.81Å; M112-M256 HydrophobicContact CG-CE 3.51Å; M112-M256 HydrophobicContact CG-CG 4.32Å; M112-M256 HydrophobicContact CG-SD 4.48Å; M112-M256 HydrophobicContact SD-CE 3.96Å; F234-M256 HydrophobicContact CD1-SD 3.93Å; F234-M256 HydrophobicContact CE1-SD 3.81Å; R252-M256 WeakPolarHBondContact O-CG 3.37Å; R252-M256 PolarHBondContact O-N 2.9Å; T253-M256 PolarHBondContact O-N 3.31Å; M256-C260 VanDerWaalsContact O-CB 3.24Å; M256-C260 WeakPolarHBondContact O-CB 3.44Å; M256-C260 PolarHBondContact O-N 3.36Å; M256-C260 VanDerWaalsContact O-N 3.13Å; M256-C260 PolarHBondContact O-SG 2.87Å; M256-C260 VanDerWaalsContact O-SG 3.41Å; M256-L300 HydrophobicContact CE-CB 3.83Å; M256-L300 HydrophobicContact CE-CD1 3.92Å
257E95Very high93.4Very high2 Ų219 Ų191%0.0099%0.093CC..Hα-helixtrans-64.4-45.8176.4-169.667.6-166.200111.9Q68 S105 S119 M122 T123 T253 V254 S255Q68-E257 PolarHBondContact OE1-O 2.85Å; S105-E257 WeakPolarHBondContact CB-OE2 3.44Å; S105-E257 PolarHBondContact OG-OE2 2.96Å; S119-E257 PolarHBondContact OG-OE2 3.44Å; M122-E257 HydrophobicContact CB-CG 3.75Å; M122-E257 HydrophobicContact SD-CB 4.31Å; M122-E257 HydrophobicContact SD-CG 4.26Å; T123-E257 WeakPolarHBondContact CA-OE1 3.25Å; T123-E257 WeakPolarHBondContact CB-OE1 3.47Å; T123-E257 PolarHBondContact N-OE1 3.43Å; T123-E257 VanDerWaalsContact OG1-CD 3.25Å; T123-E257 PolarHBondContact OG1-OE1 3.27Å; T123-E257 PolarHBondContact OG1-OE2 3.24Å; T123-E257 VanDerWaalsContact OG1-OE2 3.05Å; T253-E257 VanDerWaalsContact O-CB 3.3Å; T253-E257 WeakPolarHBondContact O-CB 3.34Å; T253-E257 PolarHBondContact O-N 3.48Å; V254-E257 PolarHBondContact O-N 3.15Å; S255-E257 VanDerWaalsContact C-N 3.33Å; S255-E257 PolarHBondContact O-N 3.07Å
258T95.7Very high93.3Very high0 Ų015.8 Ų15.80%08%0.076CC..Hα-helixtrans-64.8-47.4-177.1-52.80000110.3A67 I71 M72 G233 V254 S255A67-T258 HydrophobicContact CB-CG2 4.09Å; A67-T258 VanDerWaalsContact CB-OG1 3.3Å; A67-T258 WeakPolarHBondContact CB-OG1 3.4Å; I71-T258 HydrophobicContact CB-CG2 4.39Å; I71-T258 HydrophobicContact CD1-CG2 4.45Å; I71-T258 HydrophobicContact CG2-CG2 4.47Å; M72-T258 WeakPolarHBondContact CE-O 3.49Å; M72-T258 HydrophobicContact CG-CG2 4.1Å; M72-T258 WeakPolarHBondContact CG-O 3.47Å; G233-T258 WeakPolarHBondContact O-CB 3.48Å; G233-T258 WeakPolarHBondContact O-CG2 3.48Å; V254-T258 WeakPolarHBondContact O-CB 3.33Å; V254-T258 PolarHBondContact O-N 3.42Å; V254-T258 PolarHBondContact O-OG1 3.4Å; S255-T258 PolarHBondContact O-N 3.42Å
259G94.9Very high93.2Very high0 Ų014.3 Ų14.30%06%0.06CC..Hα-helixtrans-69.5-31-177.900000114.8M72 S255 Q261 Y289M72-G259 VanDerWaalsContact CE-CA 3.44Å; S255-G259 PolarHBondContact O-N 3.29Å; S255-G259 VanDerWaalsContact O-N 3.1Å; G259-Q261 PolarHBondContact O-N 2.72Å; G259-Y289 PolarHBondContact O-OH 3.44Å
260C95.6Very high93Very high0 Ų08.3 Ų8.30%04%0.038CC..  trans-89.6110-178-73.40000112.1G101 G102 F108 M256G101-C260 WeakPolarHBondContact CA-O 3.33Å; G102-C260 PolarHBondContact N-O 2.88Å; F108-C260 VanDerWaalsContact CD2-SG 3.57Å; M256-C260 VanDerWaalsContact O-CB 3.24Å; M256-C260 WeakPolarHBondContact O-CB 3.44Å; M256-C260 PolarHBondContact O-N 3.36Å; M256-C260 VanDerWaalsContact O-N 3.13Å; M256-C260 PolarHBondContact O-SG 2.87Å; M256-C260 VanDerWaalsContact O-SG 3.41Å
261Q95.3Very high92.7Very high3 Ų39 Ų91%0.0144%0.04CC..BIsolated β-bridgetrans-92155.1176.9-68.9-65.5-11.600112.2Q68 S99 P100 G259 V263 Y289 Q293Q68-Q261 VanDerWaalsContact NE2-CD 3.33Å; S99-Q261 VanDerWaalsContact C-OE1 3.27Å; S99-Q261 PolarHBondContact O-OE1 3.02Å; P100-Q261 PolarHBondContact O-OE1 2.92Å; G259-Q261 PolarHBondContact O-N 2.72Å; Q261-V263 VanDerWaalsContact C-N 3.26Å; Q261-V263 PolarHBondContact O-N 3.24Å; Q261-Y289 HydrophobicContact CB-CD1 4.39Å; Q261-Y289 HydrophobicContact CB-CE1 3.75Å; Q261-Y289 HydrophobicContact CG-CE1 3.93Å; Q261-Y289 HydrophobicContact CG-CE2 4.29Å; Q261-Y289 WeakPolarHBondContact CG-OH 3.46Å; Q261-Q293 VanDerWaalsContact N-OE1 3.14Å
262N93.6Very high92.3Very high6 Ų68.7 Ų8.73%0.0325%0.046CC..  trans-75.780.3171.2-164.7-26.4000111.1M39 P100 Q264 L265 C266M39-N262 WeakPolarHBondContact CE-ND2 3.38Å; P100-N262 HydrophobicContact CG-CB 4.22Å; P100-N262 VanDerWaalsContact O-CB 3.23Å; P100-N262 WeakPolarHBondContact O-CB 3.48Å; P100-N262 PolarHBondContact O-N 2.83Å; N262-Q264 VanDerWaalsContact C-N 3.27Å; N262-Q264 PolarHBondContact O-N 3.2Å; N262-L265 HydrophobicContact CB-CB 4.01Å; N262-L265 VanDerWaalsContact CG-CB 3.45Å; N262-L265 PolarHBondContact O-N 2.89Å; N262-L265 WeakPolarHBondContact OD1-CB 3.42Å; N262-L265 PolarHBondContact OD1-N 3.32Å; N262-L265 VanDerWaalsContact OD1-N 3.16Å; N262-C266 PolarHBondContact O-N 2.64Å
263V91.1Very high91.8Very high4 Ų46.6 Ų6.62%0.0244%0.038CC..Hα-helixtrans-54.1-43.2-178.51660000112.3Q261 L265 C266 S267 P286 L287 Y289 M290Q261-V263 VanDerWaalsContact C-N 3.26Å; Q261-V263 PolarHBondContact O-N 3.24Å; V263-L265 PolarHBondContact O-N 3.24Å; V263-C266 PolarHBondContact O-N 3.39Å; V263-S267 PolarHBondContact O-N 3.23Å; V263-S267 PolarHBondContact O-OG 2.89Å; V263-P286 HydrophobicContact CB-CB 4.4Å; V263-P286 HydrophobicContact CG1-CB 3.68Å; V263-P286 WeakPolarHBondContact CG1-O 3.37Å; V263-P286 WeakPolarHBondContact CG2-O 3.24Å; V263-L287 HydrophobicContact CG1-CD2 4.43Å; V263-Y289 HydrophobicContact CG2-CD1 4.04Å; V263-M290 HydrophobicContact CB-CE 3.89Å; V263-M290 HydrophobicContact CG1-CB 4.19Å; V263-M290 HydrophobicContact CG1-CE 3.45Å; V263-M290 VanDerWaalsContact CG1-CE 3.45Å; V263-M290 HydrophobicContact CG2-CB 4.06Å
264Q89.1Confident91.3Very high15 Ų156.8 Ų6.87%0.074%0.039CC..Hα-helixtrans-64.2-43.9-177.5-169.165.22200111.4L31 M34 L35 V38 N262 C266 S267 T268L31-Q264 PolarHBondContact O-NE2 3.07Å; M34-Q264 PolarHBondContact SD-NE2 3.19Å; L35-Q264 HydrophobicContact CB-CG 4.05Å; L35-Q264 HydrophobicContact CD1-CB 4.22Å; L35-Q264 HydrophobicContact CD1-CG 3.91Å; V38-Q264 HydrophobicContact CG2-CG 4.35Å; N262-Q264 VanDerWaalsContact C-N 3.27Å; N262-Q264 PolarHBondContact O-N 3.2Å; Q264-C266 VanDerWaalsContact C-N 3.34Å; Q264-S267 PolarHBondContact O-N 2.82Å; Q264-T268 PolarHBondContact O-N 3.21Å; Q264-T268 PolarHBondContact O-OG1 3.23Å; Q264-T268 VanDerWaalsContact O-OG1 3.07Å
265L90.2Very high90.6Very high0 Ų09.1 Ų9.10%05%0.054CC..Hα-helixtrans-62.3-44.5175.9178.2150.7000110.8L35 P100 M134 L163 V166 N262 V263 T268 I269L35-L265 HydrophobicContact CD1-CB 4.05Å; P100-L265 HydrophobicContact CG-CD1 3.92Å; M134-L265 HydrophobicContact SD-CD2 4.32Å; L163-L265 HydrophobicContact CD2-CD1 4.12Å; L163-L265 HydrophobicContact CD2-CD2 4.4Å; V166-L265 HydrophobicContact CB-CD1 4.29Å; V166-L265 HydrophobicContact CG1-CD1 3.62Å; V166-L265 HydrophobicContact CG2-CD1 3.81Å; V166-L265 HydrophobicContact CG2-CG 4.33Å; N262-L265 HydrophobicContact CB-CB 4.01Å; N262-L265 VanDerWaalsContact CG-CB 3.45Å; N262-L265 PolarHBondContact O-N 2.89Å; N262-L265 WeakPolarHBondContact OD1-CB 3.42Å; N262-L265 PolarHBondContact OD1-N 3.32Å; N262-L265 VanDerWaalsContact OD1-N 3.16Å; V263-L265 PolarHBondContact O-N 3.24Å; L265-T268 PolarHBondContact O-N 3.36Å; L265-I269 HydrophobicContact CD2-CD1 3.43Å; L265-I269 VanDerWaalsContact CD2-CD1 3.43Å; L265-I269 HydrophobicContact CD2-CG1 4.35Å; L265-I269 HydrophobicContact CG-CD1 4.03Å; L265-I269 WeakPolarHBondContact O-CG1 3.26Å; L265-I269 PolarHBondContact O-N 2.99Å
266C92.4Very high89.5Confident0 Ų010.8 Ų10.80%07%0.065CC..Hα-helixtrans-60.1-49.5177.5-175.40000112.1C96 N262 V263 Q264 T268 I269 L270 P286C96-C266 WeakPolarHBondContact CA-SG 3.49Å; C96-C266 VanDerWaalsContact CB-SG 3.55Å; C96-C266 PolarHBondContact N-SG 2.83Å; N262-C266 PolarHBondContact O-N 2.64Å; V263-C266 PolarHBondContact O-N 3.39Å; Q264-C266 VanDerWaalsContact C-N 3.34Å; C266-T268 VanDerWaalsContact C-N 3.33Å; C266-T268 PolarHBondContact O-N 3.38Å; C266-I269 PolarHBondContact O-N 3.05Å; C266-L270 WeakPolarHBondContact O-CG 3.3Å; C266-L270 PolarHBondContact O-N 2.99Å; C266-P286 HydrophobicContact CB-CB 4.13Å; C266-P286 HydrophobicContact CB-CG 3.93Å; C266-P286 WeakPolarHBondContact SG-CG 3.46Å
267S89.1Confident88.4Confident4 Ų415.7 Ų15.73%0.0289%0.088CC..Hα-helixtrans-58.7-44.1177.8-73.30000111.9V263 Q264 L270 N271 F283 P286V263-S267 PolarHBondContact O-N 3.23Å; V263-S267 PolarHBondContact O-OG 2.89Å; Q264-S267 PolarHBondContact O-N 2.82Å; S267-L270 PolarHBondContact O-N 3.44Å; S267-N271 VanDerWaalsContact O-CB 3.25Å; S267-N271 WeakPolarHBondContact O-CB 3.45Å; S267-N271 PolarHBondContact O-N 3.22Å; S267-F283 PolarHBondContact OG-O 2.83Å; S267-P286 WeakPolarHBondContact OG-CB 3.37Å
268T88.8Confident87.5Confident5 Ų518.6 Ų18.63%0.03111%0.105CC..Hα-helixtrans-66.2-40.1178.7-600000111.9V32 L35 Q264 L265 C266 N271 V272V32-T268 HydrophobicContact CG2-CG2 3.94Å; L35-T268 HydrophobicContact CD2-CG2 3.67Å; Q264-T268 PolarHBondContact O-N 3.21Å; Q264-T268 PolarHBondContact O-OG1 3.23Å; Q264-T268 VanDerWaalsContact O-OG1 3.07Å; L265-T268 PolarHBondContact O-N 3.36Å; C266-T268 VanDerWaalsContact C-N 3.33Å; C266-T268 PolarHBondContact O-N 3.38Å; T268-N271 PolarHBondContact O-N 3.1Å; T268-V272 HydrophobicContact CG2-CG2 3.94Å; T268-V272 VanDerWaalsContact O-CB 3.29Å; T268-V272 WeakPolarHBondContact O-CB 3.47Å; T268-V272 WeakPolarHBondContact O-CG2 3.47Å; T268-V272 PolarHBondContact O-N 3.34Å
269I89.6Confident86.8Confident2 Ų218.8 Ų18.81%0.0111%0.106CC..Hα-helixtrans-64.4-45.4176.3-71.2176.2000110.7V95 M134 I159 L163 L265 C266 N271 V272 A273 F274V95-I269 HydrophobicContact CG1-CB 4.37Å; V95-I269 HydrophobicContact CG1-CG2 3.88Å; M134-I269 HydrophobicContact CE-CD1 3.51Å; M134-I269 HydrophobicContact CE-CG2 4.2Å; M134-I269 HydrophobicContact SD-CD1 3.53Å; M134-I269 VanDerWaalsContact SD-CD1 3.53Å; I159-I269 HydrophobicContact CG1-CG2 4.38Å; I159-I269 HydrophobicContact CG2-CG2 4.48Å; L163-I269 HydrophobicContact CD2-CD1 3.84Å; L163-I269 HydrophobicContact CG-CD1 4.16Å; L265-I269 HydrophobicContact CD2-CD1 3.43Å; L265-I269 VanDerWaalsContact CD2-CD1 3.43Å; L265-I269 HydrophobicContact CD2-CG1 4.35Å; L265-I269 HydrophobicContact CG-CD1 4.03Å; L265-I269 WeakPolarHBondContact O-CG1 3.26Å; L265-I269 PolarHBondContact O-N 2.99Å; C266-I269 PolarHBondContact O-N 3.05Å; I269-N271 PolarHBondContact O-N 3.3Å; I269-V272 PolarHBondContact O-N 2.99Å; I269-A273 HydrophobicContact CG2-CB 4.08Å; I269-A273 WeakPolarHBondContact O-CA 3.22Å; I269-A273 WeakPolarHBondContact O-CB 3.38Å; I269-A273 PolarHBondContact O-N 2.77Å; I269-F274 HydrophobicContact CG2-CE2 4.21Å
270L89.4Confident86Confident1 Ų119 Ų191%0.00511%0.108CC..Hα-helixtrans-60.3-36.4176.6-71.1175.4000112.2A92 V95 C266 S267 F274 I279 F283 P286A92-L270 HydrophobicContact CB-CD1 4.38Å; A92-L270 HydrophobicContact CB-CD2 4.23Å; V95-L270 HydrophobicContact CB-CD2 3.97Å; V95-L270 HydrophobicContact CG1-CD2 3.89Å; V95-L270 HydrophobicContact CG1-CG 4.01Å; V95-L270 HydrophobicContact CG2-CD2 4.1Å; C266-L270 WeakPolarHBondContact O-CG 3.3Å; C266-L270 PolarHBondContact O-N 2.99Å; S267-L270 PolarHBondContact O-N 3.44Å; L270-F274 HydrophobicContact CD2-CD2 4.32Å; L270-F274 HydrophobicContact CD2-CE2 4.26Å; L270-I279 HydrophobicContact CB-CG2 4.23Å; L270-I279 HydrophobicContact CD2-CD1 3.94Å; L270-F283 HydrophobicContact CB-CB 4.18Å; L270-P286 HydrophobicContact CD1-CG 3.87Å
271N85.4Confident85.2Confident26 Ų2619.1 Ų19.114%0.13911%0.109CC..Hα-helixtrans-81.3-36.6-178.4179.3-105.1000114S28 L31 S267 T268 I269S28-N271 WeakPolarHBondContact CA-OD1 3.3Å; S28-N271 WeakPolarHBondContact CB-OD1 3.26Å; S28-N271 PolarHBondContact OG-OD1 3.45Å; S28-N271 VanDerWaalsContact OG-OD1 3.08Å; L31-N271 HydrophobicContact CD1-CB 3.89Å; S267-N271 VanDerWaalsContact O-CB 3.25Å; S267-N271 WeakPolarHBondContact O-CB 3.45Å; S267-N271 PolarHBondContact O-N 3.22Å; T268-N271 PolarHBondContact O-N 3.1Å; I269-N271 PolarHBondContact O-N 3.3Å
272V84.9Confident84.6Confident61 Ų6119.1 Ų19.137%0.3711%0.109SC..Hα-helixtrans-98.6-39.5-172.7176.40000112.5V32 T268 I269V32-V272 HydrophobicContact CG2-CG2 3.95Å; T268-V272 HydrophobicContact CG2-CG2 3.94Å; T268-V272 VanDerWaalsContact O-CB 3.29Å; T268-V272 WeakPolarHBondContact O-CB 3.47Å; T268-V272 WeakPolarHBondContact O-CG2 3.47Å; T268-V272 PolarHBondContact O-N 3.34Å; I269-V272 PolarHBondContact O-N 2.99Å
273A85.8Confident84Confident0 Ų019.4 Ų19.40%011%0.11CC..THydrogen-bonded Turntrans-78.2-32.9-174.600000111.9P155 R158 I159 I269P155-A273 WeakPolarHBondContact CG-O 3.48Å; R158-A273 HydrophobicContact CB-CB 4.13Å; R158-A273 VanDerWaalsContact CD-O 3.23Å; R158-A273 WeakPolarHBondContact CD-O 3.02Å; I159-A273 HydrophobicContact CG1-CB 3.8Å; I269-A273 HydrophobicContact CG2-CB 4.08Å; I269-A273 WeakPolarHBondContact O-CA 3.22Å; I269-A273 WeakPolarHBondContact O-CB 3.38Å; I269-A273 PolarHBondContact O-N 2.77Å
274F84.6Confident83.5Confident4 Ų419.5 Ų19.52%0.01811%0.11CC..SBendtrans-105.2148.9-175.5-62.3-91000112.2L91 V95 V154 P155 I159 I269 L270 I279L91-F274 HydrophobicContact CD1-CZ 4.42Å; L91-F274 HydrophobicContact CD2-CD1 4.31Å; L91-F274 HydrophobicContact CD2-CE1 3.65Å; L91-F274 HydrophobicContact CD2-CZ 4.22Å; L91-F274 HydrophobicContact CG-CE1 4.28Å; L91-F274 HydrophobicContact CG-CZ 4.37Å; V95-F274 HydrophobicContact CG2-CE2 4.04Å; V95-F274 HydrophobicContact CG2-CZ 4.05Å; V154-F274 HydrophobicContact CG1-CE1 4.48Å; P155-F274 HydrophobicContact CG-CD1 3.84Å; P155-F274 HydrophobicContact CG-CE1 3.96Å; P155-F274 HydrophobicContact CG-CG 4.28Å; I159-F274 HydrophobicContact CD1-CE2 4.23Å; I159-F274 HydrophobicContact CD1-CZ 3.85Å; I159-F274 HydrophobicContact CG1-CE2 4.45Å; I159-F274 HydrophobicContact CG1-CZ 4.49Å; I269-F274 HydrophobicContact CG2-CE2 4.21Å; L270-F274 HydrophobicContact CD2-CD2 4.32Å; L270-F274 HydrophobicContact CD2-CE2 4.26Å; F274-I279 HydrophobicContact CB-CD1 4.06Å; F274-I279 HydrophobicContact CB-CG1 3.31Å; F274-I279 HydrophobicContact CD1-CD1 4.32Å; F274-I279 HydrophobicContact CD1-CG1 4.47Å; F274-I279 HydrophobicContact CD2-CD1 4.38Å; F274-I279 HydrophobicContact CD2-CG1 4.28Å; F274-I279 HydrophobicContact CG-CD1 4Å; F274-I279 HydrophobicContact CG-CG1 3.8Å
275P79.8Confident83.5Confident49 Ų4918.9 Ų18.932%0.31811%0.107SC..  trans-60.7135.5173.2-19.631.6000111.4E277 V278 I279P275-E277 VanDerWaalsContact CB-OE2 3.28Å; P275-E277 WeakPolarHBondContact CB-OE2 3.25Å; P275-E277 PolarHBondContact O-N 2.66Å; P275-E277 VanDerWaalsContact O-N 3.14Å; P275-V278 HydrophobicContact CB-CB 4.49Å; P275-V278 HydrophobicContact CB-CG2 4.07Å; P275-V278 HydrophobicContact CG-CG2 4.13Å; P275-V278 PolarHBondContact O-N 3.45Å; P275-I279 PolarHBondContact O-N 3.2Å
276P74.3Confident83.6Confident44 Ų4418.9 Ų18.929%0.28611%0.107SC..Hα-helixtrans-56.3-28.8178-26.835.6000113.8F18 V278 G280F18-P276 HydrophobicContact CD1-CB 4.03Å; F18-P276 HydrophobicContact CE1-CB 4.09Å; P276-V278 VanDerWaalsContact C-N 3.27Å; P276-V278 PolarHBondContact O-N 2.86Å; P276-G280 WeakPolarHBondContact O-CA 3.45Å; P276-G280 PolarHBondContact O-N 3.46Å
277E71.4Confident83.3Confident104 Ų10421.6 Ų21.649%0.48612%0.121SC..Hα-helixtrans-68.7-27177.9-55.179.6-173.800112.4P275P275-E277 VanDerWaalsContact CB-OE2 3.28Å; P275-E277 WeakPolarHBondContact CB-OE2 3.25Å; P275-E277 PolarHBondContact O-N 2.66Å; P275-E277 VanDerWaalsContact O-N 3.14Å
278V76.4Confident83.3Confident62 Ų6221.9 Ų21.938%0.37612%0.122SC..Hα-helixtrans-87.4-51.2-179.3177.30000110.5I88 P275 P276I88-V278 HydrophobicContact CD1-CG1 3.67Å; I88-V278 HydrophobicContact CG1-CG1 4.44Å; I88-V278 HydrophobicContact CG2-CG1 4.37Å; I88-V278 WeakPolarHBondContact CG2-O 3.19Å; P275-V278 HydrophobicContact CB-CB 4.49Å; P275-V278 HydrophobicContact CB-CG2 4.07Å; P275-V278 HydrophobicContact CG-CG2 4.13Å; P275-V278 PolarHBondContact O-N 3.45Å; P276-V278 VanDerWaalsContact C-N 3.27Å; P276-V278 PolarHBondContact O-N 2.86Å
279I81Confident83.6Confident5 Ų521.6 Ų21.63%0.02612%0.121CC..Hα-helixtrans-77.1-32.8-177.2-69.1-56.8000112I88 L270 F274 P275 L282 F283I88-I279 HydrophobicContact CG2-CD1 4.27Å; L270-I279 HydrophobicContact CB-CG2 4.23Å; L270-I279 HydrophobicContact CD2-CD1 3.94Å; F274-I279 HydrophobicContact CB-CD1 4.06Å; F274-I279 HydrophobicContact CB-CG1 3.31Å; F274-I279 HydrophobicContact CD1-CD1 4.32Å; F274-I279 HydrophobicContact CD1-CG1 4.47Å; F274-I279 HydrophobicContact CD2-CD1 4.38Å; F274-I279 HydrophobicContact CD2-CG1 4.28Å; F274-I279 HydrophobicContact CG-CD1 4Å; F274-I279 HydrophobicContact CG-CG1 3.8Å; P275-I279 PolarHBondContact O-N 3.2Å; I279-L282 HydrophobicContact CG2-CB 4.15Å; I279-L282 VanDerWaalsContact O-CB 3.27Å; I279-L282 WeakPolarHBondContact O-CB 3.22Å; I279-L282 PolarHBondContact O-N 3.46Å; I279-F283 HydrophobicContact CG2-CB 4.07Å
280G78.6Confident83.8Confident3 Ų324.9 Ų24.93%0.03114%0.137CC..G310 helixtrans50-128.1-178.800000111.4P276 L282 F283P276-G280 WeakPolarHBondContact O-CA 3.45Å; P276-G280 PolarHBondContact O-N 3.46Å; G280-L282 VanDerWaalsContact C-N 3.29Å; G280-L282 PolarHBondContact O-N 2.97Å; G280-F283 VanDerWaalsContact O-CD1 3.26Å; G280-F283 WeakPolarHBondContact O-CD1 3.27Å
281P77.7Confident83.9Confident3 Ų330.1 Ų30.12%0.01916%0.164CC..G310 helixtrans-79.2-3.6-179.933.8-37.9000113.9F12 V210 F216 F283 F284F12-P281 VanDerWaalsContact CE2-CD 3.41Å; F12-P281 HydrophobicContact CE2-CG 3.79Å; F12-P281 HydrophobicContact CZ-CG 4.19Å; V210-P281 HydrophobicContact CG1-CB 4.06Å; F216-P281 HydrophobicContact CB-CG 3.85Å; F216-P281 HydrophobicContact CD1-CG 3.64Å; F216-P281 HydrophobicContact CG-CG 4.04Å; P281-F283 PolarHBondContact O-N 3.47Å; P281-F283 VanDerWaalsContact O-N 3.14Å; P281-F284 HydrophobicContact CB-CD2 4.3Å; P281-F284 WeakPolarHBondContact O-CB 3.46Å; P281-F284 VanDerWaalsContact O-CD2 3.22Å; P281-F284 WeakPolarHBondContact O-CD2 3.46Å; P281-F284 PolarHBondContact O-N 3.38Å
282L83.6Confident84.4Confident4 Ų431.5 Ų31.52%0.02117%0.169CC..G310 helixtrans-68.3-12.7-176.5-66.6167000113.3I88 E89 A92 F216 L222 I279 G280 F284 F285I88-L282 HydrophobicContact CB-CD1 4.18Å; I88-L282 HydrophobicContact CG2-CD1 3.48Å; I88-L282 VanDerWaalsContact CG2-CD1 3.48Å; E89-L282 HydrophobicContact CG-CD1 4.01Å; E89-L282 HydrophobicContact CG-CD2 4.05Å; A92-L282 HydrophobicContact CB-CB 3.94Å; A92-L282 HydrophobicContact CB-CD1 4.33Å; F216-L282 HydrophobicContact CE1-CD2 4.29Å; F216-L282 HydrophobicContact CE1-CG 4.44Å; L222-L282 HydrophobicContact CD1-CD2 3.68Å; L222-L282 HydrophobicContact CD2-CD2 4.46Å; I279-L282 HydrophobicContact CG2-CB 4.15Å; I279-L282 VanDerWaalsContact O-CB 3.27Å; I279-L282 WeakPolarHBondContact O-CB 3.22Å; I279-L282 PolarHBondContact O-N 3.46Å; G280-L282 VanDerWaalsContact C-N 3.29Å; G280-L282 PolarHBondContact O-N 2.97Å; L282-F284 PolarHBondContact O-N 3.29Å; L282-F284 VanDerWaalsContact O-N 3.1Å; L282-F285 VanDerWaalsContact O-CB 3.24Å; L282-F285 WeakPolarHBondContact O-CB 3.38Å; L282-F285 PolarHBondContact O-N 3.39Å
283F81.1Confident84.9Confident12 Ų1228.7 Ų28.75%0.05315%0.152CC..G310 helixtrans-63-12.216983.4-87.1000113.5F18 L27 V210 S267 L270 I279 G280 P281 P286F18-F283 HydrophobicContact CZ-CE1 4.44Å; L27-F283 HydrophobicContact CD1-CE2 4.27Å; L27-F283 HydrophobicContact CD1-CZ 4.12Å; L27-F283 HydrophobicContact CD2-CE2 4.13Å; L27-F283 HydrophobicContact CD2-CZ 4.49Å; V210-F283 HydrophobicContact CG2-CE1 4.11Å; V210-F283 HydrophobicContact CG2-CZ 4.31Å; S267-F283 PolarHBondContact OG-O 2.83Å; L270-F283 HydrophobicContact CB-CB 4.18Å; I279-F283 HydrophobicContact CG2-CB 4.07Å; G280-F283 VanDerWaalsContact O-CD1 3.26Å; G280-F283 WeakPolarHBondContact O-CD1 3.27Å; P281-F283 PolarHBondContact O-N 3.47Å; P281-F283 VanDerWaalsContact O-N 3.14Å; F283-P286 VanDerWaalsContact O-CD 3.29Å; F283-P286 WeakPolarHBondContact O-CD 3.46Å
284F80.9Confident85.3Confident6 Ų632.2 Ų32.23%0.02617%0.17CC..G310 helixtrans-84.5-15.7170.8-67.7-58.7000114.6S206 V210 I214 A217 P281 L282 P286 L287 L288S206-F284 WeakPolarHBondContact OG-CE1 3.38Å; S206-F284 WeakPolarHBondContact OG-CZ 3.14Å; V210-F284 HydrophobicContact CB-CE2 3.76Å; V210-F284 HydrophobicContact CB-CZ 4.26Å; V210-F284 HydrophobicContact CG1-CE2 3.82Å; V210-F284 HydrophobicContact CG2-CE2 3.61Å; V210-F284 HydrophobicContact CG2-CZ 4.01Å; I214-F284 HydrophobicContact CD1-CD1 4.3Å; I214-F284 HydrophobicContact CD1-CD2 4.01Å; I214-F284 HydrophobicContact CD1-CE1 4.35Å; I214-F284 HydrophobicContact CD1-CE2 4.05Å; I214-F284 HydrophobicContact CD1-CG 4.13Å; I214-F284 HydrophobicContact CD1-CZ 4.23Å; I214-F284 HydrophobicContact CG1-CD2 4.08Å; I214-F284 HydrophobicContact CG1-CE2 4.4Å; I214-F284 HydrophobicContact CG1-CG 4.43Å; A217-F284 HydrophobicContact CB-CB 4.12Å; P281-F284 HydrophobicContact CB-CD2 4.3Å; P281-F284 WeakPolarHBondContact O-CB 3.46Å; P281-F284 VanDerWaalsContact O-CD2 3.22Å; P281-F284 WeakPolarHBondContact O-CD2 3.46Å; P281-F284 PolarHBondContact O-N 3.38Å; L282-F284 PolarHBondContact O-N 3.29Å; L282-F284 VanDerWaalsContact O-N 3.1Å; F284-P286 VanDerWaalsContact C-N 3.26Å; F284-L287 HydrophobicContact CD1-CD1 3.7Å; F284-L287 HydrophobicContact CD1-CG 4.49Å; F284-L287 HydrophobicContact CE1-CD1 4.27Å; F284-L287 WeakPolarHBondContact O-CA 2.97Å; F284-L287 WeakPolarHBondContact O-CB 3.46Å; F284-L287 PolarHBondContact O-N 3.21Å; F284-L288 PolarHBondContact O-N 3.19Å
285F89.3Confident85.9Confident1 Ų134 Ų340%0.00419%0.189CC..Hα-helixtrans-51.3-42.3176.8174.4-92.5000112.7I93 C96 L222 T225 M229 L282 L287 L288 Y289I93-F285 HydrophobicContact CB-CE1 4.03Å; I93-F285 HydrophobicContact CB-CZ 3.95Å; I93-F285 HydrophobicContact CG2-CD1 4.13Å; I93-F285 HydrophobicContact CG2-CD2 3.95Å; I93-F285 HydrophobicContact CG2-CE1 3.71Å; I93-F285 HydrophobicContact CG2-CE2 3.48Å; I93-F285 VanDerWaalsContact CG2-CE2 3.48Å; I93-F285 HydrophobicContact CG2-CG 4.25Å; I93-F285 HydrophobicContact CG2-CZ 3.35Å; C96-F285 HydrophobicContact CB-CD1 4.17Å; C96-F285 HydrophobicContact CB-CE1 3.83Å; L222-F285 HydrophobicContact CD2-CD2 4.06Å; L222-F285 HydrophobicContact CD2-CE2 4.32Å; T225-F285 HydrophobicContact CG2-CE2 4.42Å; T225-F285 HydrophobicContact CG2-CZ 4.3Å; M229-F285 HydrophobicContact SD-CE1 4.39Å; M229-F285 HydrophobicContact SD-CZ 4.04Å; L282-F285 VanDerWaalsContact O-CB 3.24Å; L282-F285 WeakPolarHBondContact O-CB 3.38Å; L282-F285 PolarHBondContact O-N 3.39Å; F285-L287 VanDerWaalsContact C-N 3.25Å; F285-L287 PolarHBondContact O-N 2.9Å; F285-L288 WeakPolarHBondContact O-CB 3.25Å; F285-L288 PolarHBondContact O-N 3.42Å; F285-L288 VanDerWaalsContact O-N 3.11Å; F285-Y289 HydrophobicContact CE1-CD2 4.4Å; F285-Y289 PolarHBondContact O-N 3.16Å
286P91.4Very high86.7Confident0 Ų032.7 Ų32.70%018%0.179CC..Hα-helixtrans-64.2-26.8176.6-22.836.8000113.6V263 C266 S267 L270 F283 F284 Y289 M290V263-P286 HydrophobicContact CB-CB 4.4Å; V263-P286 HydrophobicContact CG1-CB 3.68Å; V263-P286 WeakPolarHBondContact CG1-O 3.37Å; V263-P286 WeakPolarHBondContact CG2-O 3.24Å; C266-P286 HydrophobicContact CB-CB 4.13Å; C266-P286 HydrophobicContact CB-CG 3.93Å; C266-P286 WeakPolarHBondContact SG-CG 3.46Å; S267-P286 WeakPolarHBondContact OG-CB 3.37Å; L270-P286 HydrophobicContact CD1-CG 3.87Å; F283-P286 VanDerWaalsContact O-CD 3.29Å; F283-P286 WeakPolarHBondContact O-CD 3.46Å; F284-P286 VanDerWaalsContact C-N 3.26Å; P286-Y289 WeakPolarHBondContact O-CB 3.35Å; P286-Y289 PolarHBondContact O-N 2.98Å; P286-M290 PolarHBondContact O-N 2.84Å
287L86.8Confident87.7Confident57 Ų5730.6 Ų30.630%0.29817%0.166SC..Hα-helixtrans-70.3-39.1172.9-59.8-173.4000111.5V263 F284 F285 M290 I291V263-L287 HydrophobicContact CG1-CD2 4.43Å; F284-L287 HydrophobicContact CD1-CD1 3.7Å; F284-L287 HydrophobicContact CD1-CG 4.49Å; F284-L287 HydrophobicContact CE1-CD1 4.27Å; F284-L287 WeakPolarHBondContact O-CA 2.97Å; F284-L287 WeakPolarHBondContact O-CB 3.46Å; F284-L287 PolarHBondContact O-N 3.21Å; F285-L287 VanDerWaalsContact C-N 3.25Å; F285-L287 PolarHBondContact O-N 2.9Å; L287-M290 VanDerWaalsContact O-CB 3.26Å; L287-M290 WeakPolarHBondContact O-CB 3.22Å; L287-M290 PolarHBondContact O-N 2.94Å; L287-M290 VanDerWaalsContact O-N 3.14Å; L287-I291 WeakPolarHBondContact O-CG1 3.45Å; L287-I291 PolarHBondContact O-N 3.32Å; L287-I291 VanDerWaalsContact O-N 3.12Å
288L89.4Confident88.9Confident10 Ų1029.9 Ų29.95%0.05216%0.164CC..Hα-helixtrans-60.5-47.6171-81.7177.2000111.3A217 M218 F284 F285 M290 I291 F292A217-L288 WeakPolarHBondContact O-CD1 3.38Å; M218-L288 HydrophobicContact CE-CD1 3.7Å; M218-L288 HydrophobicContact CE-CD2 3.37Å; M218-L288 HydrophobicContact CE-CG 3.54Å; M218-L288 HydrophobicContact SD-CD1 4.08Å; M218-L288 HydrophobicContact SD-CD2 3.62Å; M218-L288 HydrophobicContact SD-CG 4.24Å; F284-L288 PolarHBondContact O-N 3.19Å; F285-L288 WeakPolarHBondContact O-CB 3.25Å; F285-L288 PolarHBondContact O-N 3.42Å; F285-L288 VanDerWaalsContact O-N 3.11Å; L288-M290 PolarHBondContact O-N 3.16Å; L288-I291 PolarHBondContact O-N 3.37Å; L288-I291 VanDerWaalsContact O-N 3.1Å; L288-F292 WeakPolarHBondContact O-CD2 3.3Å; L288-F292 PolarHBondContact O-N 3.26Å; L288-F292 VanDerWaalsContact O-N 3.15Å
289Y94.1Very high89.9Confident0 Ų031.5 Ų31.50%017%0.17CC..Hα-helixtrans-53.8-41.3172.2-169.6-73.8000111.2M72 M229 P230 G259 Q261 V263 F285 P286 I291 F292 Q293M72-Y289 WeakPolarHBondContact CE-OH 3.39Å; M229-Y289 HydrophobicContact CB-CD2 4.26Å; M229-Y289 HydrophobicContact CB-CE2 3.6Å; M229-Y289 HydrophobicContact CE-CE2 4.18Å; M229-Y289 HydrophobicContact SD-CE2 4.44Å; P230-Y289 WeakPolarHBondContact CA-OH 3.49Å; P230-Y289 HydrophobicContact CB-CE1 4.11Å; P230-Y289 HydrophobicContact CB-CE2 4.42Å; P230-Y289 HydrophobicContact CG-CE1 4.44Å; P230-Y289 HydrophobicContact CG-CE2 4.28Å; G259-Y289 PolarHBondContact O-OH 3.44Å; Q261-Y289 HydrophobicContact CB-CD1 4.39Å; Q261-Y289 HydrophobicContact CB-CE1 3.75Å; Q261-Y289 HydrophobicContact CG-CE1 3.93Å; Q261-Y289 HydrophobicContact CG-CE2 4.29Å; Q261-Y289 WeakPolarHBondContact CG-OH 3.46Å; V263-Y289 HydrophobicContact CG2-CD1 4.04Å; F285-Y289 HydrophobicContact CE1-CD2 4.4Å; F285-Y289 PolarHBondContact O-N 3.16Å; P286-Y289 WeakPolarHBondContact O-CB 3.35Å; P286-Y289 PolarHBondContact O-N 2.98Å; Y289-I291 VanDerWaalsContact C-N 3.34Å; Y289-I291 PolarHBondContact O-N 2.9Å; Y289-F292 PolarHBondContact O-N 2.67Å; Y289-Q293 HydrophobicContact CD1-CB 4.1Å; Y289-Q293 HydrophobicContact CD1-CG 4.18Å; Y289-Q293 HydrophobicContact CE1-CB 3.84Å; Y289-Q293 HydrophobicContact CE1-CG 4.23Å; Y289-Q293 VanDerWaalsContact CE1-OE1 3.22Å; Y289-Q293 WeakPolarHBondContact O-CB 3.23Å; Y289-Q293 WeakPolarHBondContact O-CG 3.47Å; Y289-Q293 PolarHBondContact O-N 2.82Å
290M92.8Very high90.6Very high70 Ų7033.5 Ų33.535%0.34518%0.181SC..Hα-helixtrans-58.9-43.7177.7-167.4-175.5-7100112.5V263 P286 L287 L288 Q293 L294V263-M290 HydrophobicContact CB-CE 3.89Å; V263-M290 HydrophobicContact CG1-CB 4.19Å; V263-M290 HydrophobicContact CG1-CE 3.45Å; V263-M290 VanDerWaalsContact CG1-CE 3.45Å; V263-M290 HydrophobicContact CG2-CB 4.06Å; P286-M290 PolarHBondContact O-N 2.84Å; L287-M290 VanDerWaalsContact O-CB 3.26Å; L287-M290 WeakPolarHBondContact O-CB 3.22Å; L287-M290 PolarHBondContact O-N 2.94Å; L287-M290 VanDerWaalsContact O-N 3.14Å; L288-M290 PolarHBondContact O-N 3.16Å; M290-Q293 WeakPolarHBondContact O-CG 3.49Å; M290-L294 VanDerWaalsContact O-CB 3.23Å; M290-L294 WeakPolarHBondContact O-CB 3.46Å; M290-L294 PolarHBondContact O-N 3.2Å; M290-L294 VanDerWaalsContact O-N 3.07Å
291I92.3Very high91.4Very high112 Ų11234.4 Ų34.457%0.57419%0.185SC*.Hα-helixtrans-63.6-48.2-179.8-65.1165.9000109.8L287 L288 Y289 L294 G295L287-I291 WeakPolarHBondContact O-CG1 3.45Å; L287-I291 PolarHBondContact O-N 3.32Å; L287-I291 VanDerWaalsContact O-N 3.12Å; L288-I291 PolarHBondContact O-N 3.37Å; L288-I291 VanDerWaalsContact O-N 3.1Å; Y289-I291 VanDerWaalsContact C-N 3.34Å; Y289-I291 PolarHBondContact O-N 2.9Å; I291-L294 PolarHBondContact O-N 3.1Å; I291-G295 PolarHBondContact O-N 2.96Å
292F95.3Very high92.3Very high55 Ų5538.4 Ų38.424%0.24121%0.209CC..Hα-helixtrans-69.3-46.6-178.8-75-67.2000113.1I223 S226 S227 P230 L288 Y289 L294 G295 E296I223-F292 HydrophobicContact CG2-CE2 3.95Å; I223-F292 HydrophobicContact CG2-CZ 3.68Å; S226-F292 WeakPolarHBondContact O-CB 3.45Å; S226-F292 WeakPolarHBondContact OG-CD2 3.12Å; S226-F292 WeakPolarHBondContact OG-CE2 3.5Å; S227-F292 VanDerWaalsContact CB-CD1 3.43Å; P230-F292 HydrophobicContact CG-CB 4.16Å; L288-F292 WeakPolarHBondContact O-CD2 3.3Å; L288-F292 PolarHBondContact O-N 3.26Å; L288-F292 VanDerWaalsContact O-N 3.15Å; Y289-F292 PolarHBondContact O-N 2.67Å; F292-L294 PolarHBondContact O-N 3.14Å; F292-G295 PolarHBondContact O-N 3.09Å; F292-E296 VanDerWaalsContact O-CB 3.32Å; F292-E296 WeakPolarHBondContact O-CB 3.26Å; F292-E296 WeakPolarHBondContact O-CG 3.28Å; F292-E296 PolarHBondContact O-N 3.28Å
293Q96.1Very high92.8Very high2 Ų243.4 Ų43.41%0.00923%0.233CC..Hα-helixtrans-60.4-33.3176.777.8178.5-1800111.7L104 F108 P230 Q261 Y289 M290 G297L104-Q293 HydrophobicContact CD1-CG 4.45Å; F108-Q293 WeakPolarHBondContact CE2-O 3.06Å; P230-Q293 HydrophobicContact CB-CB 3.73Å; P230-Q293 HydrophobicContact CG-CB 4.26Å; Q261-Q293 VanDerWaalsContact N-OE1 3.14Å; Y289-Q293 HydrophobicContact CD1-CB 4.1Å; Y289-Q293 HydrophobicContact CD1-CG 4.18Å; Y289-Q293 HydrophobicContact CE1-CB 3.84Å; Y289-Q293 HydrophobicContact CE1-CG 4.23Å; Y289-Q293 VanDerWaalsContact CE1-OE1 3.22Å; Y289-Q293 WeakPolarHBondContact O-CB 3.23Å; Y289-Q293 WeakPolarHBondContact O-CG 3.47Å; Y289-Q293 PolarHBondContact O-N 2.82Å; M290-Q293 WeakPolarHBondContact O-CG 3.49Å; Q293-G297 PolarHBondContact O-N 3.44Å
294L95.2Very high93.4Very high74 Ų7444.2 Ų44.239%0.38724%0.237SC..Hα-helixtrans-69.4-50.1176.2-171.684.7000110.5F108 M290 I291 F292 G297 L298F108-L294 HydrophobicContact CZ-CD1 4.02Å; M290-L294 VanDerWaalsContact O-CB 3.23Å; M290-L294 WeakPolarHBondContact O-CB 3.46Å; M290-L294 PolarHBondContact O-N 3.2Å; M290-L294 VanDerWaalsContact O-N 3.07Å; I291-L294 PolarHBondContact O-N 3.1Å; F292-L294 PolarHBondContact O-N 3.14Å; L294-G297 PolarHBondContact O-N 2.83Å; L294-L298 HydrophobicContact CG-CD1 4.18Å; L294-L298 WeakPolarHBondContact O-CB 3.29Å; L294-L298 VanDerWaalsContact O-CG 3.22Å; L294-L298 WeakPolarHBondContact O-CG 2.9Å; L294-L298 PolarHBondContact O-N 2.84Å
295G95.9Very high93.9Very high41 Ų4149.4 Ų49.442%0.42326%0.256SS..Hα-helixtrans-60.8-48.5179.900000112.5I291 F292 L298 L299I291-G295 PolarHBondContact O-N 2.96Å; F292-G295 PolarHBondContact O-N 3.09Å; G295-L298 PolarHBondContact O-N 3.08Å; G295-L299 WeakPolarHBondContact O-CB 3.13Å; G295-L299 PolarHBondContact O-N 3.36Å
296E97.1Very high94.1Very high22 Ų2252.1 Ų52.110%0.10328%0.275CS..Hα-helixtrans-68-41.1179.1-68.5170.1-168.400111.9S227 P230 F231 F234 F292 L298 L299 L300S227-E296 PolarHBondContact OG-OE1 3.37Å; P230-E296 WeakPolarHBondContact CG-OE2 3.48Å; F231-E296 VanDerWaalsContact CA-OE2 3.23Å; F231-E296 WeakPolarHBondContact CA-OE2 2.93Å; F231-E296 WeakPolarHBondContact CB-OE2 3.5Å; F231-E296 PolarHBondContact N-OE2 2.92Å; F234-E296 HydrophobicContact CD2-CB 4.32Å; F234-E296 HydrophobicContact CE2-CB 3.99Å; F292-E296 VanDerWaalsContact O-CB 3.32Å; F292-E296 WeakPolarHBondContact O-CB 3.26Å; F292-E296 WeakPolarHBondContact O-CG 3.28Å; F292-E296 PolarHBondContact O-N 3.28Å; E296-L298 PolarHBondContact O-N 2.9Å; E296-L299 WeakPolarHBondContact O-CB 3.3Å; E296-L299 PolarHBondContact O-N 3.38Å; E296-L300 WeakPolarHBondContact O-CG 3.47Å; E296-L300 PolarHBondContact O-N 3.49Å
297G96Very high94.1Very high0 Ų058.6 Ų58.60%030%0.3CS..Hα-helixtrans-60.7-44.7174.200000112.3Q293 L294 L300 I301Q293-G297 PolarHBondContact O-N 3.44Å; L294-G297 PolarHBondContact O-N 2.83Å; G297-L300 PolarHBondContact O-N 3.35Å; G297-I301 WeakPolarHBondContact O-CD1 3.37Å; G297-I301 VanDerWaalsContact O-CG1 3.24Å; G297-I301 WeakPolarHBondContact O-CG1 3.3Å; G297-I301 PolarHBondContact O-N 3.45Å
298L96.5Very high94.2Very high88 Ų8858.2 Ų58.246%0.46130%0.297SS..Hα-helixtrans-62.8-41.3173.9-72.4174.1000112F108 L294 G295 E296 I301 V302F108-L298 HydrophobicContact CE1-CD2 4.42Å; L294-L298 HydrophobicContact CG-CD1 4.18Å; L294-L298 WeakPolarHBondContact O-CB 3.29Å; L294-L298 VanDerWaalsContact O-CG 3.22Å; L294-L298 WeakPolarHBondContact O-CG 2.9Å; L294-L298 PolarHBondContact O-N 2.84Å; G295-L298 PolarHBondContact O-N 3.08Å; E296-L298 PolarHBondContact O-N 2.9Å; L298-I301 HydrophobicContact CD2-CD1 4.45Å; L298-I301 WeakPolarHBondContact O-CB 3.38Å; L298-I301 PolarHBondContact O-N 3.49Å; L298-V302 WeakPolarHBondContact O-CG2 3.34Å; L298-V302 PolarHBondContact O-N 2.91Å
299L96.4Very high94.1Very high96 Ų9665.9 Ų65.950%0.50333%0.33SS..Hα-helixtrans-60.5-46.5175.9-178.664.5000111.4G295 E296 I301 V302 M303G295-L299 WeakPolarHBondContact O-CB 3.13Å; G295-L299 PolarHBondContact O-N 3.36Å; E296-L299 WeakPolarHBondContact O-CB 3.3Å; E296-L299 PolarHBondContact O-N 3.38Å; L299-I301 VanDerWaalsContact C-N 3.29Å; L299-I301 PolarHBondContact O-N 2.8Å; L299-V302 PolarHBondContact O-N 3.47Å; L299-M303 HydrophobicContact CD1-CE 3.99Å; L299-M303 HydrophobicContact CD2-CE 4.04Å; L299-M303 HydrophobicContact CG-CE 3.87Å; L299-M303 HydrophobicContact CG-SD 4.4Å; L299-M303 WeakPolarHBondContact O-CG 3.41Å; L299-M303 PolarHBondContact O-N 3.31Å
300L95.9Very high93.6Very high48 Ų4874 Ų7425%0.25137%0.365SS..Hα-helixtrans-61.3-38.2176.1-71.7173.6000111.9F234 M256 E296 G297 M303 F304F234-L300 HydrophobicContact CB-CD1 3.62Å; F234-L300 HydrophobicContact CD1-CD1 4.26Å; F234-L300 HydrophobicContact CD2-CD1 3.74Å; F234-L300 HydrophobicContact CE2-CD1 4.48Å; F234-L300 HydrophobicContact CG-CD1 3.62Å; M256-L300 HydrophobicContact CE-CB 3.83Å; M256-L300 HydrophobicContact CE-CD1 3.92Å; E296-L300 WeakPolarHBondContact O-CG 3.47Å; E296-L300 PolarHBondContact O-N 3.49Å; G297-L300 PolarHBondContact O-N 3.35Å; L300-M303 PolarHBondContact O-N 2.89Å; L300-F304 VanDerWaalsContact O-CB 3.31Å; L300-F304 WeakPolarHBondContact O-CB 3.33Å; L300-F304 PolarHBondContact O-N 2.93Å
301I95.8Very high92.8Very high22 Ų2276.5 Ų76.511%0.11337%0.374CS..Hα-helixtrans-61.3-49.2173.2-68.3159.8000111.1F108 A111 M112 G297 L298 L299 F304 R305F108-I301 HydrophobicContact CB-CD1 4.4Å; F108-I301 HydrophobicContact CD1-CD1 3.55Å; F108-I301 HydrophobicContact CE1-CD1 4.03Å; F108-I301 HydrophobicContact CG-CD1 4.16Å; A111-I301 HydrophobicContact CB-CD1 3.57Å; A111-I301 HydrophobicContact CB-CG1 3.93Å; A111-I301 HydrophobicContact CB-CG2 4.2Å; M112-I301 HydrophobicContact CG-CG1 3.85Å; M112-I301 WeakPolarHBondContact SD-CA 3.34Å; M112-I301 HydrophobicContact SD-CB 4.16Å; M112-I301 HydrophobicContact SD-CG1 3.7Å; G297-I301 WeakPolarHBondContact O-CD1 3.37Å; G297-I301 VanDerWaalsContact O-CG1 3.24Å; G297-I301 WeakPolarHBondContact O-CG1 3.3Å; G297-I301 PolarHBondContact O-N 3.45Å; L298-I301 HydrophobicContact CD2-CD1 4.45Å; L298-I301 WeakPolarHBondContact O-CB 3.38Å; L298-I301 PolarHBondContact O-N 3.49Å; L299-I301 VanDerWaalsContact C-N 3.29Å; L299-I301 PolarHBondContact O-N 2.8Å; I301-F304 PolarHBondContact O-N 3.36Å; I301-R305 HydrophobicContact CG2-CG 4.31Å; I301-R305 WeakPolarHBondContact O-CB 3.24Å; I301-R305 WeakPolarHBondContact O-CG 3.32Å; I301-R305 PolarHBondContact O-N 3.16Å
302V95.5Very high91Very high86 Ų8674.4 Ų74.452%0.52137%0.367SS..Hα-helixtrans-60.4-48.2178.41720000110.5L298 L299 F304 R305 C306L298-V302 WeakPolarHBondContact O-CG2 3.34Å; L298-V302 PolarHBondContact O-N 2.91Å; L299-V302 PolarHBondContact O-N 3.47Å; V302-F304 VanDerWaalsContact C-N 3.33Å; V302-F304 PolarHBondContact O-N 3.07Å; V302-R305 PolarHBondContact O-N 3.19Å; V302-C306 WeakPolarHBondContact O-CB 3.37Å; V302-C306 PolarHBondContact O-N 2.93Å; V302-C306 PolarHBondContact O-SG 3.36Å; V302-C306 VanDerWaalsContact O-SG 3.34Å
303M94.6Very high89Confident109 Ų10975.4 Ų75.454%0.53738%0.379SS..Hα-helixtrans-56.8-45.5177.3-73.4-177.2175.600112L299 L300 C306 Y307L299-M303 HydrophobicContact CD1-CE 3.99Å; L299-M303 HydrophobicContact CD2-CE 4.04Å; L299-M303 HydrophobicContact CG-CE 3.87Å; L299-M303 HydrophobicContact CG-SD 4.4Å; L299-M303 WeakPolarHBondContact O-CG 3.41Å; L299-M303 PolarHBondContact O-N 3.31Å; L300-M303 PolarHBondContact O-N 2.89Å; M303-C306 PolarHBondContact O-N 3.32Å; M303-Y307 WeakPolarHBondContact O-CB 3.47Å; M303-Y307 PolarHBondContact O-N 2.82Å
304F93.4Very high86.7Confident29 Ų2984 Ų8413%0.12742%0.416CS..Hα-helixtrans-63.4-44177.8174.1-103.9000112.5M112 K113 L300 I301 V302 Y307 E308M112-F304 HydrophobicContact CE-CB 3.47Å; M112-F304 VanDerWaalsContact CE-CB 3.47Å; M112-F304 HydrophobicContact CE-CD1 4.36Å; M112-F304 HydrophobicContact CE-CD2 4.14Å; M112-F304 HydrophobicContact CE-CG 3.74Å; M112-F304 WeakPolarHBondContact O-CE1 3.29Å; M112-F304 WeakPolarHBondContact O-CZ 3.47Å; M112-F304 HydrophobicContact SD-CB 3.54Å; M112-F304 VanDerWaalsContact SD-CB 3.54Å; M112-F304 HydrophobicContact SD-CD1 3.95Å; M112-F304 HydrophobicContact SD-CG 3.84Å; K113-F304 HydrophobicContact CB-CE1 4.34Å; K113-F304 HydrophobicContact CB-CZ 4.48Å; K113-F304 HydrophobicContact CD-CE1 4.22Å; K113-F304 HydrophobicContact CD-CZ 4.46Å; K113-F304 HydrophobicContact CG-CE1 4.21Å; L300-F304 VanDerWaalsContact O-CB 3.31Å; L300-F304 WeakPolarHBondContact O-CB 3.33Å; L300-F304 PolarHBondContact O-N 2.93Å; I301-F304 PolarHBondContact O-N 3.36Å; V302-F304 VanDerWaalsContact C-N 3.33Å; V302-F304 PolarHBondContact O-N 3.07Å; F304-Y307 PolarHBondContact O-N 3.44Å; F304-E308 HydrophobicContact CE1-CG 4.09Å; F304-E308 WeakPolarHBondContact CE1-OE2 3.25Å; F304-E308 HydrophobicContact CE2-CG 4.12Å; F304-E308 VanDerWaalsContact CZ-CD 3.5Å; F304-E308 HydrophobicContact CZ-CG 3.82Å; F304-E308 PolarHBondContact O-N 3.03Å
305R92.4Very high84.6Confident115 Ų11585.4 Ų85.443%0.43442%0.424SS..Hα-helixtrans-66-39.3178.3-66.8-68.3-178.8155.51.7111.9A111 I301 V302 K309A111-R305 PolarHBondContact O-NE 3.32Å; A111-R305 PolarHBondContact O-NH2 2.77Å; I301-R305 HydrophobicContact CG2-CG 4.31Å; I301-R305 WeakPolarHBondContact O-CB 3.24Å; I301-R305 WeakPolarHBondContact O-CG 3.32Å; I301-R305 PolarHBondContact O-N 3.16Å; V302-R305 PolarHBondContact O-N 3.19Å; R305-K309 WeakPolarHBondContact O-CB 3.27Å; R305-K309 PolarHBondContact O-N 3.47Å
306C92.8Very high82.2Confident58 Ų5890 Ų9039%0.39243%0.433SS..Hα-helixtrans-60.8-49.9171.7-73.20000110.8V302 M303 E308 K309 F310V302-C306 WeakPolarHBondContact O-CB 3.37Å; V302-C306 PolarHBondContact O-N 2.93Å; V302-C306 PolarHBondContact O-SG 3.36Å; V302-C306 VanDerWaalsContact O-SG 3.34Å; M303-C306 PolarHBondContact O-N 3.32Å; C306-E308 PolarHBondContact O-N 3.4Å; C306-K309 WeakPolarHBondContact O-CB 3.26Å; C306-K309 PolarHBondContact O-N 2.99Å; C306-K309 VanDerWaalsContact O-N 3.09Å; C306-F310 HydrophobicContact CB-CE2 4.49Å; C306-F310 WeakPolarHBondContact O-CD2 3.32Å; C306-F310 PolarHBondContact O-N 3.41Å
307Y91Very high79.7Confident136 Ų13692.2 Ų92.253%0.53345%0.448SS..Hα-helixtrans-57.6-44.7177.9173-102.9000112.6M303 F304 K309 F310 K311M303-Y307 WeakPolarHBondContact O-CB 3.47Å; M303-Y307 PolarHBondContact O-N 2.82Å; F304-Y307 PolarHBondContact O-N 3.44Å; Y307-K309 VanDerWaalsContact C-N 3.33Å; Y307-K309 PolarHBondContact O-N 3.33Å; Y307-F310 PolarHBondContact O-N 3.32Å; Y307-K311 HydrophobicContact CE1-CD 4.08Å; Y307-K311 WeakPolarHBondContact O-CB 3.44Å; Y307-K311 PolarHBondContact O-N 3.48Å
308E89.6Confident77.1Confident49 Ų4999.4 Ų99.423%0.22948%0.479CS..Hα-helixtrans-59.3-44.7174.4-76.9-163.8113.600111.6K113 F304 C306 F310 K311 T312K113-E308 WeakPolarHBondContact CE-OE2 3.21Å; K113-E308 IonicContact NZ-OE1 2.78Å; K113-E308 PolarHBondContact NZ-OE1 2.85Å; K113-E308 IonicContact NZ-OE2 3.34Å; K113-E308 PolarHBondContact NZ-OE2 2.9Å; F304-E308 HydrophobicContact CE1-CG 4.09Å; F304-E308 WeakPolarHBondContact CE1-OE2 3.25Å; F304-E308 HydrophobicContact CE2-CG 4.12Å; F304-E308 VanDerWaalsContact CZ-CD 3.5Å; F304-E308 HydrophobicContact CZ-CG 3.82Å; F304-E308 PolarHBondContact O-N 3.03Å; C306-E308 PolarHBondContact O-N 3.4Å; E308-F310 VanDerWaalsContact C-N 3.31Å; E308-F310 PolarHBondContact O-N 2.98Å; E308-K311 PolarHBondContact O-N 2.82Å; E308-T312 WeakPolarHBondContact O-CB 3.41Å; E308-T312 PolarHBondContact O-N 3.21Å; E308-T312 PolarHBondContact O-OG1 3.36Å
309K88Confident74.8Confident172 Ų172102 Ų10275%0.74849%0.491SS*.Hα-helixtrans-61.6-39.2178.9-166-178.8-179.8-175.20112R305 C306 Y307R305-K309 WeakPolarHBondContact O-CB 3.27Å; R305-K309 PolarHBondContact O-N 3.47Å; C306-K309 WeakPolarHBondContact O-CB 3.26Å; C306-K309 PolarHBondContact O-N 2.99Å; C306-K309 VanDerWaalsContact O-N 3.09Å; Y307-K309 VanDerWaalsContact C-N 3.33Å; Y307-K309 PolarHBondContact O-N 3.33Å
310F83.1Confident72.5Confident169 Ų169102.7 Ų102.774%0.74149%0.494SS*.Hα-helixtrans-77.8-25178.3-76-68.5000114.4C306 Y307 E308 P313C306-F310 HydrophobicContact CB-CE2 4.49Å; C306-F310 WeakPolarHBondContact O-CD2 3.32Å; C306-F310 PolarHBondContact O-N 3.41Å; Y307-F310 PolarHBondContact O-N 3.32Å; E308-F310 VanDerWaalsContact C-N 3.31Å; E308-F310 PolarHBondContact O-N 2.98Å; F310-P313 WeakPolarHBondContact O-CD 3.29Å
311K75Confident70.3Confident123 Ų123108.1 Ų108.154%0.53551%0.512SS..Hα-helixtrans-82.7-29.7176.3-167.8175.3-179.6177.50112.9Y307 E308 P313Y307-K311 HydrophobicContact CE1-CD 4.08Å; Y307-K311 WeakPolarHBondContact O-CB 3.44Å; Y307-K311 PolarHBondContact O-N 3.48Å; E308-K311 PolarHBondContact O-N 2.82Å; K311-P313 WeakPolarHBondContact O-CD 3.39Å
312T56Low68.1Low68 Ų68111 Ų11142%0.41753%0.531SS..Hα-helixtrans-65-11.2-179-51.90000117E308 K316E308-T312 WeakPolarHBondContact O-CB 3.41Å; E308-T312 PolarHBondContact O-N 3.21Å; E308-T312 PolarHBondContact O-OG1 3.36Å; T312-K316 HydrophobicContact CG2-CD 4.42Å; T312-K316 HydrophobicContact CG2-CG 4.45Å
313P53.3Low66Low76 Ų76109.2 Ų109.249%0.49453%0.525SS..Hα-helixtrans-68.8-36.8173.8-1932.3000114F310 K311 T317F310-P313 WeakPolarHBondContact O-CD 3.29Å; K311-P313 WeakPolarHBondContact O-CD 3.39Å; P313-T317 PolarHBondContact O-OG1 2.97Å
314K47.4Very low63.9Low182 Ų182106.4 Ų106.479%0.79152%0.519SS*.Hα-helixtrans-80.9-30.6-172.5-82.5-174.2179.8-177.90114.7K318K314-K318 PolarHBondContact O-N 3.26Å; K314-K318 VanDerWaalsContact O-N 3.12Å
315D50.4Low61.9Low104 Ų104109.2 Ų109.256%0.55654%0.539SS*.Hα-helixtrans-79-31.5179.8-100.2-21.8000113T317 K318 M319D315-T317 VanDerWaalsContact C-N 3.34Å; D315-K318 PolarHBondContact O-N 3.03Å; D315-M319 WeakPolarHBondContact O-CB 3.36Å; D315-M319 VanDerWaalsContact O-CG 3.29Å; D315-M319 WeakPolarHBondContact O-CG 3.33Å; D315-M319 PolarHBondContact O-N 3.48Å
316K45.4Very low59.7Low138 Ų138107.3 Ų107.360%0.654%0.54SS*.Hα-helixtrans-65-40.7171.8-76.5-171.2176.2-172.70111.2T312 M319 I320T312-K316 HydrophobicContact CG2-CD 4.42Å; T312-K316 HydrophobicContact CG2-CG 4.45Å; K316-M319 PolarHBondContact O-N 3.3Å; K316-I320 WeakPolarHBondContact O-CB 3.48Å; K316-I320 VanDerWaalsContact O-CD1 3.32Å; K316-I320 WeakPolarHBondContact O-CD1 3.36Å; K316-I320 WeakPolarHBondContact O-CG1 3.48Å; K316-I320 PolarHBondContact O-N 2.99Å
317T45.1Very low57.5Low69 Ų69112.6 Ų112.642%0.42356%0.559SS.*Hα-helixtrans-62.6-48.1173.5-490000110.6P313 D315 M319 I320 Y321P313-T317 PolarHBondContact O-OG1 2.97Å; D315-T317 VanDerWaalsContact C-N 3.34Å; T317-M319 PolarHBondContact O-N 2.84Å; T317-I320 PolarHBondContact O-N 3.23Å; T317-Y321 HydrophobicContact CG2-CD2 3.66Å; T317-Y321 HydrophobicContact CG2-CE2 3.3Å; T317-Y321 WeakPolarHBondContact O-CB 3.34Å; T317-Y321 WeakPolarHBondContact O-CD2 3.36Å; T317-Y321 PolarHBondContact O-N 2.96Å
318K40.6Very low55.5Low150 Ų150114.6 Ų114.665%0.65257%0.573SS**Hα-helixtrans-60.4-40.7176.3-109.3-178176-173.80113.7K314 D315 T322K314-K318 PolarHBondContact O-N 3.26Å; K314-K318 VanDerWaalsContact O-N 3.12Å; D315-K318 PolarHBondContact O-N 3.03Å; K318-T322 VanDerWaalsContact O-CB 3.32Å; K318-T322 WeakPolarHBondContact O-CB 3.43Å; K318-T322 PolarHBondContact O-N 2.89Å; K318-T322 PolarHBondContact O-OG1 3.31Å
319M48.2Very low53.3Low143 Ų143117.3 Ų117.370%0.70459%0.593SS**Hα-helixtrans-67.4-41.3176.8-76.3-95.9-79.800112.5D315 K316 T317 T322 A323D315-M319 WeakPolarHBondContact O-CB 3.36Å; D315-M319 VanDerWaalsContact O-CG 3.29Å; D315-M319 WeakPolarHBondContact O-CG 3.33Å; D315-M319 PolarHBondContact O-N 3.48Å; K316-M319 PolarHBondContact O-N 3.3Å; T317-M319 PolarHBondContact O-N 2.84Å; M319-T322 PolarHBondContact O-N 3.31Å; M319-A323 WeakPolarHBondContact O-CB 3.05Å; M319-A323 PolarHBondContact O-N 2.77Å
320I49.8Very low50.8Low110 Ų110115.3 Ų115.356%0.56459%0.589SS**Hα-helixtrans-66.4-43.2177.3-68.6163.2000110.7K316 T317 A323 A324K316-I320 WeakPolarHBondContact O-CB 3.48Å; K316-I320 VanDerWaalsContact O-CD1 3.32Å; K316-I320 WeakPolarHBondContact O-CD1 3.36Å; K316-I320 WeakPolarHBondContact O-CG1 3.48Å; K316-I320 PolarHBondContact O-N 2.99Å; T317-I320 PolarHBondContact O-N 3.23Å; I320-A323 PolarHBondContact O-N 3.26Å; I320-A324 VanDerWaalsContact O-CB 3.26Å; I320-A324 WeakPolarHBondContact O-CB 3.41Å; I320-A324 PolarHBondContact O-N 3.2Å
321Y48Very low48.5Very low163 Ų163113.1 Ų113.164%0.63959%0.592SS**Hα-helixtrans-68.8-38.8178.9-78.6-112.2000111.2T317 T325T317-Y321 HydrophobicContact CG2-CD2 3.66Å; T317-Y321 HydrophobicContact CG2-CE2 3.3Å; T317-Y321 WeakPolarHBondContact O-CB 3.34Å; T317-Y321 WeakPolarHBondContact O-CD2 3.36Å; T317-Y321 PolarHBondContact O-N 2.96Å; Y321-T325 WeakPolarHBondContact O-CG2 3.19Å; Y321-T325 PolarHBondContact O-N 3.39Å; Y321-T325 PolarHBondContact O-OG1 3.35Å
322T50.4Low46.7Very low82 Ų82110.8 Ų110.850%0.50360%0.603SS.*Hα-helixtrans-67.2-44.4175.9-51.50000111K318 M319 T325 T326K318-T322 VanDerWaalsContact O-CB 3.32Å; K318-T322 WeakPolarHBondContact O-CB 3.43Å; K318-T322 PolarHBondContact O-N 2.89Å; K318-T322 PolarHBondContact O-OG1 3.31Å; M319-T322 PolarHBondContact O-N 3.31Å; T322-T325 WeakPolarHBondContact CA-OG1 3.48Å; T322-T325 PolarHBondContact O-N 2.99Å; T322-T325 PolarHBondContact O-OG1 3.23Å; T322-T326 WeakPolarHBondContact O-CB 3.3Å; T322-T326 PolarHBondContact O-N 3.45Å; T322-T326 PolarHBondContact O-OG1 2.95Å
323A51.9Low45.4Very low49 Ų49112.6 Ų112.641%0.40563%0.625SS.*Hα-helixtrans-62.6-44.4176.800000112M319 I320 T325 T326 E327M319-A323 WeakPolarHBondContact O-CB 3.05Å; M319-A323 PolarHBondContact O-N 2.77Å; I320-A323 PolarHBondContact O-N 3.26Å; A323-T325 PolarHBondContact O-N 2.93Å; A323-T326 PolarHBondContact O-N 3.46Å; A323-T326 VanDerWaalsContact O-N 3.13Å; A323-E327 PolarHBondContact O-N 2.75Å
324A50.7Low44.5Very low50 Ų50117.6 Ų117.641%0.41365%0.646SS.*Hα-helixtrans-62.3-41.3175.700000112.3I320 T326 E328I320-A324 VanDerWaalsContact O-CB 3.26Å; I320-A324 WeakPolarHBondContact O-CB 3.41Å; I320-A324 PolarHBondContact O-N 3.2Å; A324-T326 VanDerWaalsContact C-N 3.29Å; A324-T326 PolarHBondContact O-N 2.72Å; A324-E328 PolarHBondContact O-N 2.61Å
325T50.4Low43.5Very low88 Ų88112.5 Ų112.554%0.5465%0.646SS.*Hα-helixtrans-69.1-25.7174.647.50000113.5Y321 T322 A323 T329Y321-T325 WeakPolarHBondContact O-CG2 3.19Å; Y321-T325 PolarHBondContact O-N 3.39Å; Y321-T325 PolarHBondContact O-OG1 3.35Å; T322-T325 WeakPolarHBondContact CA-OG1 3.48Å; T322-T325 PolarHBondContact O-N 2.99Å; T322-T325 PolarHBondContact O-OG1 3.23Å; A323-T325 PolarHBondContact O-N 2.93Å; T325-T329 PolarHBondContact O-OG1 2.95Å
326T46.8Very low42.5Very low75 Ų75115.8 Ų115.846%0.4666%0.663SS.*Hα-helixtrans-86.4-31.9-179.3-40.80000111.7T322 A323 A324 E328 T329T322-T326 WeakPolarHBondContact O-CB 3.3Å; T322-T326 PolarHBondContact O-N 3.45Å; T322-T326 PolarHBondContact O-OG1 2.95Å; A323-T326 PolarHBondContact O-N 3.46Å; A323-T326 VanDerWaalsContact O-N 3.13Å; A324-T326 VanDerWaalsContact C-N 3.29Å; A324-T326 PolarHBondContact O-N 2.72Å; T326-E328 VanDerWaalsContact C-N 3.34Å; T326-T329 PolarHBondContact O-N 3.2Å
327E47.3Very low41.9Very low169 Ų169112.6 Ų112.679%0.7967%0.669SS**Hα-helixtrans-70-28.5173.7-80.8-176.4156.600112.5A323 T329A323-E327 PolarHBondContact O-N 2.75Å; E327-T329 VanDerWaalsContact C-N 3.26Å; E327-T329 PolarHBondContact O-N 3.31Å
328E48.5Very low41Very low178 Ų178116 Ų11683%0.83269%0.69SS**THydrogen-bonded Turntrans-76-5.2174-77.2-171.6165.700114.3A324 T326A324-E328 PolarHBondContact O-N 2.61Å; T326-E328 VanDerWaalsContact C-N 3.34Å
329T43.5Very low40.4Very low105 Ų105120.4 Ų120.464%0.64471%0.705SS**SBendtrans-119.81.2-173.420.60000119.1T325 T326 E327T325-T329 PolarHBondContact O-OG1 2.95Å; T326-T329 PolarHBondContact O-N 3.2Å; E327-T329 VanDerWaalsContact C-N 3.26Å; E327-T329 PolarHBondContact O-N 3.31Å
330I35.1Very low39.6Very low130 Ų130123 Ų12367%0.66771%0.712SS**  trans-142.1117.7179.2-50.7180000113.8
331P35Very low38.6Very low124 Ų124121.2 Ų121.281%0.80572%0.72SS**  trans-82.7124161.516.5-1.8000111.3
332G36Very low37.9Very low74 Ų74121 Ų12176%0.76373%0.725SS**  trans75.6111.415100000119.2
333A30.1Very low37.2Very low106 Ų106123.4 Ų123.488%0.87674%0.735SS**  171.1135.7126.900000112.1
334L34.3Very low36.6Very low181 Ų181124.5 Ų124.595%0.94874%0.739SS**  trans-59.5154.4174.7-89.877.2000114.2
335G26.5Very low35.8Very low75 Ų75126.1 Ų126.177%0.77375%0.747SS**  trans163.2100.9149.500000118.1
336N27.9Very low35.1Very low173 Ų173127.5 Ų127.593%0.92576%0.758SS**  trans27.6130.6149.2-75.9-13.3000122.8
337G33.1Very low34.8Very low71 Ų71129.7 Ų129.773%0.73278%0.775SS**  trans-83.7168.1177.200000116.8
338T26.2Very low34.3Very low140 Ų140128 Ų12886%0.85978%0.776SS**  trans-164.1119.5151.7-5.30000109K340T338-K340 PolarHBondContact O-N 2.91Å
339Y29.1Very low33.9Very low243 Ų243128.1 Ų128.195%0.95381%0.807SS**  trans-72.4114172.5-94.1-97.6000109.7
340K30.6Very low33.4Very low198 Ų198129.3 Ų129.386%0.86182%0.815SS**  trans-96.5131.1166.5-94.3-178.6173.61770109.7T338T338-K340 PolarHBondContact O-N 2.91Å
341G29.9Very low33.3Very low72 Ų72129.2 Ų129.274%0.74282%0.823SS**  trans-62.6137.8173.200000111.5D343G341-D343 PolarHBondContact O-N 3.15Å; G341-D343 VanDerWaalsContact O-N 3.12Å
342E33.6Very low33.2Very low159 Ų159129.5 Ų129.574%0.74382%0.824SS**  trans-68.8106.6176.6-76.7178.7127.600110.7R249R249-E342 IonicContact CZ-OE2 2.79Å; R249-E342 IonicContact NH1-OE2 2.73Å; R249-E342 IonicContact NH2-OE2 3.99Å; R249-E342 PolarHBondContact NH2-OE2 2.99Å
343D34.2Very low33.1Very low131 Ų131132.8 Ų132.870%0.70183%0.828SS**  trans-63.1137.4165.6-91.4-47.9000111.4G341 S345G341-D343 PolarHBondContact O-N 3.15Å; G341-D343 VanDerWaalsContact O-N 3.12Å; D343-S345 VanDerWaalsContact C-N 3.29Å; D343-S345 PolarHBondContact O-N 3.03Å
344C39Very low33.3Very low73 Ų73134.4 Ų134.449%0.49383%0.825SS.*  trans-6789.3163.1-76.90000109.3
345S34Very low33.2Very low83 Ų83131.3 Ų131.358%0.5882%0.817SS**  trans-83.4140167.1-73.10000110.9D343D343-S345 VanDerWaalsContact C-N 3.29Å; D343-S345 PolarHBondContact O-N 3.03Å
346P35.9Very low33.7Very low118 Ų118135.4 Ų135.477%0.76682%0.82SS**  trans-83.6137.9164.333.1-26.5000109.2
347C41.3Very low34.1Very low121 Ų121132.5 Ų132.582%0.81881%0.811SS**  trans-123.1118.4164.6-78.80000111
348T37.1Very low34.2Very low134 Ų134137.6 Ų137.682%0.82282%0.818SS**  trans-10.2135.7150.240.20000119.2
349A39.3Very low34.9Very low179 Ų179137.4 Ų137.4100%1.47981%0.814SS**  trans51.5015400000118.2

Retrieved 349 of 349 residues in 987.2 ms (Link to these results)