G4VHT3_SCHMA Loading...

Magnesium transporter NIPA2

AlphaFold DB , UniProt , Accession G4VHT3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 441 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
1M35.5Very low36.7Very low223 Ų223147 Ų147100%1.09971%0.709SS**  088.30-170.7178.7-101.400106.5I3M1-I3 HydrophobicContact CG-CG1 4.43Å; M1-I3 PolarHBondContact O-N 3.21Å
2Y31Very low36.9Very low240 Ų240142 Ų14294%0.94170%0.697SS**  trans-75.2103.7172.9-84.6-89.1000106.2E4Y2-E4 PolarHBondContact O-N 3.16Å; Y2-E4 VanDerWaalsContact O-N 3.13Å
3I36Very low36.7Very low132 Ų132136.2 Ų136.268%0.67768%0.679SS**  trans-74.1100.8172.1-61.8177.3000105.5M1 V5M1-I3 HydrophobicContact CG-CG1 4.43Å; M1-I3 PolarHBondContact O-N 3.21Å; I3-V5 VanDerWaalsContact C-N 3.29Å; I3-V5 HydrophobicContact CG2-CG2 4.06Å; I3-V5 PolarHBondContact O-N 2.93Å
4E33.1Very low36.9Very low189 Ų189136.9 Ų136.988%0.88369%0.686SS**  trans-6296.3162.1-98.3-177.9153.500107.4Y2 N6Y2-E4 PolarHBondContact O-N 3.16Å; Y2-E4 VanDerWaalsContact O-N 3.13Å; E4-N6 PolarHBondContact O-N 2.98Å; E4-N6 VanDerWaalsContact O-N 3.12Å
5V36.1Very low37.1Very low89 Ų89136.8 Ų136.854%0.53968%0.684SS.*  trans-71.4105.9169.1-178.60000106.5I3 K7 Y10I3-V5 VanDerWaalsContact C-N 3.29Å; I3-V5 HydrophobicContact CG2-CG2 4.06Å; I3-V5 PolarHBondContact O-N 2.93Å; V5-K7 PolarHBondContact O-N 3.32Å; V5-Y10 HydrophobicContact CG1-CE2 3.7Å
6N33Very low37.8Very low109 Ų109135.6 Ų135.658%0.58369%0.686SS**  trans-62.2123.9-175.8-147.1-5.8000109.6E4 S8 D9E4-N6 PolarHBondContact O-N 2.98Å; E4-N6 VanDerWaalsContact O-N 3.12Å; N6-S8 PolarHBondContact O-N 3.05Å; N6-D9 PolarHBondContact O-N 3.27Å; N6-D9 VanDerWaalsContact O-N 3.15Å
7K42.3Very low38.1Very low191 Ų191138.5 Ų138.583%0.8370%0.696SS**THydrogen-bonded Turntrans-61.1-10.6-177-132.5174.9-176.1178.90112.8V5V5-K7 PolarHBondContact O-N 3.32Å
8S42.4Very low38.9Very low61 Ų61135.7 Ų135.743%0.42768%0.679SS.*THydrogen-bonded Turntrans-72.9-23.2176.253.40000114.5N6 Y10 P12N6-S8 PolarHBondContact O-N 3.05Å; S8-Y10 VanDerWaalsContact C-N 3.33Å; S8-Y10 PolarHBondContact O-N 3.26Å; S8-P12 VanDerWaalsContact O-CD 3.27Å; S8-P12 WeakPolarHBondContact O-CD 3.47Å
9D37Very low40.6Very low113 Ų113130.8 Ų130.860%0.60466%0.659SS**THydrogen-bonded Turntrans-83.8-8.7-172.7-66.5-13.6000113.5N6N6-D9 PolarHBondContact O-N 3.27Å; N6-D9 VanDerWaalsContact O-N 3.15Å
10Y40.9Very low42.8Very low150 Ų150128.8 Ų128.859%0.58866%0.655SS**THydrogen-bonded Turntrans-95.4-15.5175.8-67.6-78.3000114.2V5 S8 S13 L14V5-Y10 HydrophobicContact CG1-CE2 3.7Å; S8-Y10 VanDerWaalsContact C-N 3.33Å; S8-Y10 PolarHBondContact O-N 3.26Å; Y10-S13 WeakPolarHBondContact CA-OG 3.44Å; Y10-S13 PolarHBondContact O-OG 3.03Å; Y10-S13 VanDerWaalsContact O-OG 3.11Å; Y10-L14 PolarHBondContact O-N 3.26Å
11L36.3Very low45Very low120 Ų120127 Ų12763%0.62865%0.65SS**Hα-helixtrans-68.9-36.9176.6-126.486.7000113.5S13 M15L11-S13 VanDerWaalsContact C-N 3.34Å; L11-M15 PolarHBondContact O-N 2.85Å
12P38.8Very low47.5Very low87 Ų87119 Ų11957%0.56561%0.612SS**Hα-helixtrans-71.7-27.3177-15.829.2000113S8 M15S8-P12 VanDerWaalsContact O-CD 3.27Å; S8-P12 WeakPolarHBondContact O-CD 3.47Å; P12-M15 CarbonylContact O-C 3.48Å
13S34.2Very low50.2Low67 Ų67111.1 Ų111.147%0.46958%0.583SS.*Hα-helixtrans-84.7-22.5-177.851.80000113.4Y10 L11 V16Y10-S13 WeakPolarHBondContact CA-OG 3.44Å; Y10-S13 PolarHBondContact O-OG 3.03Å; Y10-S13 VanDerWaalsContact O-OG 3.11Å; L11-S13 VanDerWaalsContact C-N 3.34Å; S13-V16 WeakPolarHBondContact O-CG2 3.09Å
14L39.9Very low52.9Low146 Ų146111.8 Ų111.876%0.76458%0.578SS**Hα-helixtrans-80.3-21.5168-118.2104.2000113.1Y10 V16Y10-L14 PolarHBondContact O-N 3.26Å; L14-V16 PolarHBondContact O-N 3.37Å
15M40.2Very low55.8Low135 Ų135106 Ų10667%0.66555%0.553SS**SBendtrans-90.453.2163.5-70.7-163.9-84.800110.1L11 P12 Q17L11-M15 PolarHBondContact O-N 2.85Å; P12-M15 CarbonylContact O-C 3.48Å; M15-Q17 PolarHBondContact O-N 3.17Å
16V47.5Very low58.5Low117 Ų117101.8 Ų101.871%0.70953%0.527SS*.  trans-43114.8155172.80000105.4S13 L14 K18S13-V16 WeakPolarHBondContact O-CG2 3.09Å; L14-V16 PolarHBondContact O-N 3.37Å; V16-K18 PolarHBondContact O-N 2.86Å
17Q42.7Very low61.3Low185 Ų18598.7 Ų98.786%0.86451%0.51SS*.  trans-60.274.3-173.3-163.9-179.329.600108.8M15 S19M15-Q17 PolarHBondContact O-N 3.17Å; Q17-S19 PolarHBondContact O-N 3.43Å
18K53.2Low63.8Low88 Ų8893.5 Ų93.538%0.38350%0.497SS..  trans-59.8113.8163-97.7175.1162.6-1760103.3V16 N22 T90 F91V16-K18 PolarHBondContact O-N 2.86Å; K18-N22 HydrophobicContact CB-CB 4.41Å; K18-T90 WeakPolarHBondContact CE-O 3.41Å; K18-T90 PolarHBondContact NZ-O 3.46Å; K18-F91 WeakPolarHBondContact CD-O 3.4Å; K18-F91 WeakPolarHBondContact CE-O 3.24Å; K18-F91 PolarHBondContact NZ-O 3.05Å
19S71.9Confident66.3Low43 Ų4392.6 Ų92.630%0.30149%0.487SS..  trans-46.7143179.579.50000108.4Q17 V21 N22 F23Q17-S19 PolarHBondContact O-N 3.43Å; S19-V21 CarbonylContact O-C 3.59Å; S19-V21 PolarHBondContact O-N 2.9Å; S19-N22 WeakPolarHBondContact O-CA 3.42Å; S19-N22 WeakPolarHBondContact O-CB 3.39Å; S19-N22 PolarHBondContact O-N 3.5Å; S19-N22 PolarHBondContact OG-N 3.02Å; S19-N22 VanDerWaalsContact OG-N 3.13Å; S19-N22 PolarHBondContact OG-OD1 3.4Å; S19-F23 PolarHBondContact O-N 2.9Å; S19-F23 VanDerWaalsContact O-N 3.17Å
20P83.1Confident69.1Low90 Ų9087.3 Ų87.358%0.58446%0.459SS*.Hα-helixtrans-51.2-32.4178.719.2-31.4000111F23 Y24P20-F23 WeakPolarHBondContact O-CB 3.34Å; P20-F23 PolarHBondContact O-N 3.23Å; P20-Y24 HydrophobicContact CB-CE2 4.31Å; P20-Y24 WeakPolarHBondContact O-CD2 3.39Å; P20-Y24 PolarHBondContact O-N 3.41Å
21V89.8Confident71.6Confident91 Ų9183.7 Ų83.755%0.55245%0.449SS*.Hα-helixtrans-58-49.5172.4-174.40000112.4S19 F23 Y24 I25S19-V21 CarbonylContact O-C 3.59Å; S19-V21 PolarHBondContact O-N 2.9Å; V21-F23 VanDerWaalsContact C-N 3.29Å; V21-F23 PolarHBondContact O-N 3.29Å; V21-Y24 PolarHBondContact O-N 3.33Å; V21-I25 HydrophobicContact CG1-CD1 3.83Å; V21-I25 HydrophobicContact CG1-CG1 4.38Å; V21-I25 VanDerWaalsContact O-CG1 3.27Å; V21-I25 WeakPolarHBondContact O-CG1 3.48Å; V21-I25 PolarHBondContact O-N 3.25Å
22N88.3Confident74.5Confident56 Ų5681.5 Ų81.530%0.29944%0.438SS..Hα-helixtrans-60.1-41177.1-69.9-8.5000111.4K18 S19 I25 G26 F91K18-N22 HydrophobicContact CB-CB 4.41Å; S19-N22 WeakPolarHBondContact O-CA 3.42Å; S19-N22 WeakPolarHBondContact O-CB 3.39Å; S19-N22 PolarHBondContact O-N 3.5Å; S19-N22 PolarHBondContact OG-N 3.02Å; S19-N22 VanDerWaalsContact OG-N 3.13Å; S19-N22 PolarHBondContact OG-OD1 3.4Å; N22-I25 PolarHBondContact O-N 3.48Å; N22-G26 PolarHBondContact O-N 3.46Å; N22-F91 HydrophobicContact CB-CD1 4.22Å; N22-F91 WeakPolarHBondContact O-CB 3.33Å
23F87.9Confident77.2Confident75 Ų7577.3 Ų77.333%0.32941%0.411SS..Hα-helixtrans-60.1-48.2175.9177.2-91.4000111.7S19 P20 V21 I25 G26 L27 L96S19-F23 PolarHBondContact O-N 2.9Å; S19-F23 VanDerWaalsContact O-N 3.17Å; P20-F23 WeakPolarHBondContact O-CB 3.34Å; P20-F23 PolarHBondContact O-N 3.23Å; V21-F23 VanDerWaalsContact C-N 3.29Å; V21-F23 PolarHBondContact O-N 3.29Å; F23-I25 PolarHBondContact O-N 3.36Å; F23-G26 PolarHBondContact O-N 3.46Å; F23-L27 PolarHBondContact O-N 2.85Å; F23-L96 HydrophobicContact CE2-CD2 3.75Å; F23-L96 HydrophobicContact CZ-CD1 4.22Å; F23-L96 HydrophobicContact CZ-CD2 3.79Å
24Y91.9Very high80.1Confident146 Ų14674.3 Ų74.357%0.57339%0.39SS*.Hα-helixtrans-65.9-36.5178.1-70.7-62.6000113P20 V21 L27 C28P20-Y24 HydrophobicContact CB-CE2 4.31Å; P20-Y24 WeakPolarHBondContact O-CD2 3.39Å; P20-Y24 PolarHBondContact O-N 3.41Å; V21-Y24 PolarHBondContact O-N 3.33Å; Y24-L27 HydrophobicContact CD1-CD2 4.44Å; Y24-L27 PolarHBondContact O-N 3.16Å; Y24-C28 WeakPolarHBondContact O-CB 3.42Å; Y24-C28 PolarHBondContact O-N 3.25Å; Y24-C28 PolarHBondContact O-SG 3.16Å; Y24-C28 VanDerWaalsContact O-SG 3.41Å
25I93.8Very high82.8Confident68 Ų6871.7 Ų71.735%0.34938%0.376SS..Hα-helixtrans-58.9-48.9172.9-70.7166.1000110V21 N22 F23 L27 C28 L29 F91V21-I25 HydrophobicContact CG1-CD1 3.83Å; V21-I25 HydrophobicContact CG1-CG1 4.38Å; V21-I25 VanDerWaalsContact O-CG1 3.27Å; V21-I25 WeakPolarHBondContact O-CG1 3.48Å; V21-I25 PolarHBondContact O-N 3.25Å; N22-I25 PolarHBondContact O-N 3.48Å; F23-I25 PolarHBondContact O-N 3.36Å; I25-L27 VanDerWaalsContact C-N 3.35Å; I25-L27 PolarHBondContact O-N 2.93Å; I25-C28 PolarHBondContact O-N 2.89Å; I25-L29 HydrophobicContact CG2-CD1 3.84Å; I25-L29 HydrophobicContact CG2-CG 4.46Å; I25-L29 WeakPolarHBondContact O-CB 3.16Å; I25-L29 WeakPolarHBondContact O-CG 3.43Å; I25-L29 PolarHBondContact O-N 3.38Å; I25-F91 HydrophobicContact CG2-CB 4.47Å; I25-F91 HydrophobicContact CG2-CD1 4.3Å; I25-F91 HydrophobicContact CG2-CD2 3.96Å; I25-F91 HydrophobicContact CG2-CE2 4.25Å; I25-F91 HydrophobicContact CG2-CG 3.99Å
26G92.4Very high85.5Confident0 Ų068 Ų680%036%0.356CS..Hα-helixtrans-61.4-41.7177.800000112.6N22 F23 L29 A30N22-G26 PolarHBondContact O-N 3.46Å; F23-G26 PolarHBondContact O-N 3.46Å; G26-L29 PolarHBondContact O-N 3.03Å; G26-A30 WeakPolarHBondContact O-CB 3.47Å; G26-A30 PolarHBondContact O-N 3.04Å
27L92.4Very high87.8Confident44 Ų4463 Ų6323%0.2333%0.326CS..Hα-helixtrans-62.2-47.9175.6176.661.7000112.2F23 Y24 I25 L29 A30 L31 L96 L100F23-L27 PolarHBondContact O-N 2.85Å; Y24-L27 HydrophobicContact CD1-CD2 4.44Å; Y24-L27 PolarHBondContact O-N 3.16Å; I25-L27 VanDerWaalsContact C-N 3.35Å; I25-L27 PolarHBondContact O-N 2.93Å; L27-L29 PolarHBondContact O-N 3.35Å; L27-A30 PolarHBondContact O-N 2.93Å; L27-L31 HydrophobicContact CD1-CD1 4.17Å; L27-L31 HydrophobicContact CD1-CG 4.31Å; L27-L31 HydrophobicContact CG-CD1 4.21Å; L27-L31 WeakPolarHBondContact O-CG 3.47Å; L27-L31 PolarHBondContact O-N 3.24Å; L27-L96 HydrophobicContact CB-CD2 4.33Å; L27-L96 HydrophobicContact CD1-CD2 4.18Å; L27-L100 HydrophobicContact CD1-CD1 3.59Å
28C95Very high90.3Very high81 Ų8154.2 Ų54.255%0.54728%0.284SS..Hα-helixtrans-62.1-42.5178.3-75.20000111.8Y24 I25 L31 L32Y24-C28 WeakPolarHBondContact O-CB 3.42Å; Y24-C28 PolarHBondContact O-N 3.25Å; Y24-C28 PolarHBondContact O-SG 3.16Å; Y24-C28 VanDerWaalsContact O-SG 3.41Å; I25-C28 PolarHBondContact O-N 2.89Å; C28-L31 PolarHBondContact O-N 3.48Å; C28-L32 WeakPolarHBondContact O-CB 3.4Å; C28-L32 PolarHBondContact O-N 3.25Å
29L95.6Very high92.4Very high43 Ų4351.8 Ų51.823%0.22528%0.277CS..Hα-helixtrans-63.4-42.2176.2-75.1170.2000112I25 G26 L27 L32 S33 V87 A88 F91I25-L29 HydrophobicContact CG2-CD1 3.84Å; I25-L29 HydrophobicContact CG2-CG 4.46Å; I25-L29 WeakPolarHBondContact O-CB 3.16Å; I25-L29 WeakPolarHBondContact O-CG 3.43Å; I25-L29 PolarHBondContact O-N 3.38Å; G26-L29 PolarHBondContact O-N 3.03Å; L27-L29 PolarHBondContact O-N 3.35Å; L29-L32 PolarHBondContact O-N 2.96Å; L29-S33 WeakPolarHBondContact O-CB 3.48Å; L29-S33 PolarHBondContact O-N 2.89Å; L29-V87 HydrophobicContact CD1-CB 4.37Å; L29-V87 HydrophobicContact CD1-CG1 3.75Å; L29-A88 HydrophobicContact CB-CB 3.9Å; L29-F91 HydrophobicContact CD1-CD2 3.99Å; L29-F91 HydrophobicContact CD1-CE2 4.38Å
30A94.4Very high93.6Very high1 Ų149.7 Ų49.71%0.00826%0.262CS..Hα-helixtrans-62.3-46.2176.100000111.4G26 L27 L32 S33 T34 A88 V97 L100G26-A30 WeakPolarHBondContact O-CB 3.47Å; G26-A30 PolarHBondContact O-N 3.04Å; L27-A30 PolarHBondContact O-N 2.93Å; A30-L32 PolarHBondContact O-N 3.33Å; A30-S33 WeakPolarHBondContact O-CB 3.44Å; A30-S33 PolarHBondContact O-N 3.13Å; A30-T34 PolarHBondContact O-N 3.31Å; A30-T34 PolarHBondContact O-OG1 3.41Å; A30-A88 HydrophobicContact CB-CB 4.13Å; A30-V97 HydrophobicContact CB-CG1 4.26Å; A30-L100 HydrophobicContact CB-CB 4.23Å; A30-L100 HydrophobicContact CB-CD1 3.62Å
31L94.8Very high94.2Very high74 Ų7446.3 Ų46.339%0.38724%0.238SC..Hα-helixtrans-64-38.9176.9-71.3171.7000112.9L27 C28 T34 L35 L100L27-L31 HydrophobicContact CD1-CD1 4.17Å; L27-L31 HydrophobicContact CD1-CG 4.31Å; L27-L31 HydrophobicContact CG-CD1 4.21Å; L27-L31 WeakPolarHBondContact O-CG 3.47Å; L27-L31 PolarHBondContact O-N 3.24Å; C28-L31 PolarHBondContact O-N 3.48Å; L31-T34 WeakPolarHBondContact O-CB 3.47Å; L31-T34 PolarHBondContact O-N 3.09Å; L31-L35 WeakPolarHBondContact O-CG 3.36Å; L31-L35 PolarHBondContact O-N 3.23Å; L31-L35 VanDerWaalsContact O-N 3.1Å; L31-L100 HydrophobicContact CD2-CD2 3.91Å
32L96.2Very high94.6Very high74 Ų7442.2 Ų42.239%0.38721%0.213SC..Hα-helixtrans-66.3-42.6176.4-172.767.7000111.1C28 L29 A30 T34 L35 F36C28-L32 WeakPolarHBondContact O-CB 3.4Å; C28-L32 PolarHBondContact O-N 3.25Å; L29-L32 PolarHBondContact O-N 2.96Å; A30-L32 PolarHBondContact O-N 3.33Å; L32-T34 VanDerWaalsContact C-N 3.35Å; L32-T34 PolarHBondContact O-N 3.36Å; L32-L35 PolarHBondContact O-N 3.44Å; L32-F36 HydrophobicContact CD1-CE1 4.06Å; L32-F36 HydrophobicContact CD1-CE2 3.97Å; L32-F36 HydrophobicContact CD1-CZ 3.7Å; L32-F36 HydrophobicContact CD2-CE2 3.74Å; L32-F36 HydrophobicContact CD2-CZ 4.09Å; L32-F36 HydrophobicContact CG-CD2 4.01Å; L32-F36 HydrophobicContact CG-CE1 4.5Å; L32-F36 HydrophobicContact CG-CE2 3.55Å; L32-F36 HydrophobicContact CG-CZ 3.84Å; L32-F36 WeakPolarHBondContact O-CG 3.47Å; L32-F36 PolarHBondContact O-N 3.25Å
33S96.3Very high95Very high0 Ų041.9 Ų41.90%021%0.209CC..Hα-helixtrans-54.9-50.5171.8164.10000111.2L29 A30 L35 F36 I37 G81 N85L29-S33 WeakPolarHBondContact O-CB 3.48Å; L29-S33 PolarHBondContact O-N 2.89Å; A30-S33 WeakPolarHBondContact O-CB 3.44Å; A30-S33 PolarHBondContact O-N 3.13Å; S33-L35 VanDerWaalsContact C-N 3.27Å; S33-L35 PolarHBondContact O-N 3.1Å; S33-F36 PolarHBondContact O-N 3.27Å; S33-F36 VanDerWaalsContact O-N 3.13Å; S33-I37 WeakPolarHBondContact O-CB 3.49Å; S33-I37 WeakPolarHBondContact O-CG1 3.37Å; S33-I37 PolarHBondContact O-N 3.05Å; S33-I37 WeakPolarHBondContact OG-CD1 3.34Å; S33-G81 VanDerWaalsContact CB-O 3.23Å; S33-G81 WeakPolarHBondContact CB-O 3.27Å; S33-G81 PolarHBondContact OG-O 2.86Å; S33-N85 WeakPolarHBondContact OG-CB 3.33Å
34T94.8Very high95.5Very high4 Ų438.3 Ų38.33%0.02519%0.194CC..Hα-helixtrans-52.2-45.9176.8-58.80000112.1A30 L31 L32 G38 L100 L103 S104 V107A30-T34 PolarHBondContact O-N 3.31Å; A30-T34 PolarHBondContact O-OG1 3.41Å; L31-T34 WeakPolarHBondContact O-CB 3.47Å; L31-T34 PolarHBondContact O-N 3.09Å; L32-T34 VanDerWaalsContact C-N 3.35Å; L32-T34 PolarHBondContact O-N 3.36Å; T34-G38 PolarHBondContact O-N 2.93Å; T34-L100 WeakPolarHBondContact CG2-O 3.33Å; T34-L100 PolarHBondContact OG1-O 3.36Å; T34-L103 HydrophobicContact CG2-CB 3.49Å; T34-L103 VanDerWaalsContact CG2-CB 3.49Å; T34-S104 WeakPolarHBondContact O-CB 3.48Å; T34-V107 HydrophobicContact CG2-CG2 4.11Å
35L96.4Very high95.7Very high90 Ų9031.8 Ų31.847%0.47117%0.168SC..Hα-helixtrans-66.4-45.1178.7-71.8171.8000112L31 L32 S33 T39 V107L31-L35 WeakPolarHBondContact O-CG 3.36Å; L31-L35 PolarHBondContact O-N 3.23Å; L31-L35 VanDerWaalsContact O-N 3.1Å; L32-L35 PolarHBondContact O-N 3.44Å; S33-L35 VanDerWaalsContact C-N 3.27Å; S33-L35 PolarHBondContact O-N 3.1Å; L35-T39 WeakPolarHBondContact O-CB 3.35Å; L35-T39 PolarHBondContact O-N 2.97Å; L35-T39 PolarHBondContact O-OG1 2.71Å; L35-V107 HydrophobicContact CD2-CG1 4.23Å; L35-V107 HydrophobicContact CD2-CG2 4.17Å
36F97.4Very high95.9Very high58 Ų5831 Ų3125%0.25416%0.164SC..Hα-helixtrans-65.1-47.6179-71.8-21.5000112.4L32 S33 T39 S40 L77 I80L32-F36 HydrophobicContact CD1-CE1 4.06Å; L32-F36 HydrophobicContact CD1-CE2 3.97Å; L32-F36 HydrophobicContact CD1-CZ 3.7Å; L32-F36 HydrophobicContact CD2-CE2 3.74Å; L32-F36 HydrophobicContact CD2-CZ 4.09Å; L32-F36 HydrophobicContact CG-CD2 4.01Å; L32-F36 HydrophobicContact CG-CE1 4.5Å; L32-F36 HydrophobicContact CG-CE2 3.55Å; L32-F36 HydrophobicContact CG-CZ 3.84Å; L32-F36 WeakPolarHBondContact O-CG 3.47Å; L32-F36 PolarHBondContact O-N 3.25Å; S33-F36 PolarHBondContact O-N 3.27Å; S33-F36 VanDerWaalsContact O-N 3.13Å; F36-T39 PolarHBondContact O-N 3.43Å; F36-S40 WeakPolarHBondContact O-CB 3.45Å; F36-S40 PolarHBondContact O-N 2.96Å; F36-L77 HydrophobicContact CB-CD1 4.02Å; F36-L77 HydrophobicContact CB-CG 3.98Å; F36-L77 HydrophobicContact CD1-CD1 3.45Å; F36-L77 VanDerWaalsContact CD1-CD1 3.45Å; F36-L77 HydrophobicContact CD1-CG 4.18Å; F36-L77 HydrophobicContact CE1-CD1 3.96Å; F36-L77 HydrophobicContact CG-CD1 3.76Å; F36-L77 HydrophobicContact CG-CG 4.28Å; F36-I80 HydrophobicContact CD2-CB 4.46Å; F36-I80 HydrophobicContact CD2-CG2 3.74Å; F36-I80 HydrophobicContact CE2-CG2 3.69Å
37I96.1Very high96Very high13 Ų1331 Ų317%0.06716%0.164CC..Hα-helixtrans-61.5-48.8176.8-65172.1000109.7S33 T39 S40 F41 E82S33-I37 WeakPolarHBondContact O-CB 3.49Å; S33-I37 WeakPolarHBondContact O-CG1 3.37Å; S33-I37 PolarHBondContact O-N 3.05Å; S33-I37 WeakPolarHBondContact OG-CD1 3.34Å; I37-T39 PolarHBondContact O-N 2.88Å; I37-S40 WeakPolarHBondContact O-CB 3.3Å; I37-S40 PolarHBondContact O-N 3.03Å; I37-S40 PolarHBondContact O-OG 3.28Å; I37-F41 HydrophobicContact CG2-CE2 4.11Å; I37-F41 VanDerWaalsContact O-CD2 3.25Å; I37-F41 WeakPolarHBondContact O-CD2 3.45Å; I37-E82 HydrophobicContact CD1-CG 4.36Å
38G95.1Very high96.3Very high0 Ų029 Ų290%015%0.154CC..Hα-helixtrans-61.2-43.3-179.900000113.1T34 S40 S104 S108T34-G38 PolarHBondContact O-N 2.93Å; G38-S40 VanDerWaalsContact C-N 3.33Å; G38-S40 PolarHBondContact O-N 3.47Å; G38-S104 WeakPolarHBondContact CA-O 3.13Å; G38-S108 WeakPolarHBondContact O-CB 3.44Å
39T96.6Very high96.3Very high36 Ų3629.3 Ų29.322%0.22114%0.144CC..Hα-helixtrans-69.8-30.9178.6-54.50000112.1L35 F36 I37 F41 I42 F43 L77 L111L35-T39 WeakPolarHBondContact O-CB 3.35Å; L35-T39 PolarHBondContact O-N 2.97Å; L35-T39 PolarHBondContact O-OG1 2.71Å; F36-T39 PolarHBondContact O-N 3.43Å; I37-T39 PolarHBondContact O-N 2.88Å; T39-F41 PolarHBondContact O-N 3.47Å; T39-I42 WeakPolarHBondContact O-CB 3.25Å; T39-I42 PolarHBondContact O-N 3.4Å; T39-F43 HydrophobicContact CG2-CD2 3.85Å; T39-F43 HydrophobicContact CG2-CE2 3.68Å; T39-F43 PolarHBondContact O-N 3.49Å; T39-L77 HydrophobicContact CG2-CD2 3.86Å; T39-L111 HydrophobicContact CG2-CD1 4.43Å; T39-L111 WeakPolarHBondContact OG1-CD1 3.49Å
40S97.5Very high96.2Very high0 Ų033.3 Ų33.30%016%0.156CC..Hα-helixtrans-56.4-39.1178.9800000112.7F36 I37 G38 I42 F43 K44 G74F36-S40 WeakPolarHBondContact O-CB 3.45Å; F36-S40 PolarHBondContact O-N 2.96Å; I37-S40 WeakPolarHBondContact O-CB 3.3Å; I37-S40 PolarHBondContact O-N 3.03Å; I37-S40 PolarHBondContact O-OG 3.28Å; G38-S40 VanDerWaalsContact C-N 3.33Å; G38-S40 PolarHBondContact O-N 3.47Å; S40-I42 PolarHBondContact O-N 3.4Å; S40-F43 PolarHBondContact O-N 2.83Å; S40-K44 VanDerWaalsContact O-CE 3.23Å; S40-K44 WeakPolarHBondContact O-CE 3.36Å; S40-K44 VanDerWaalsContact O-CG 3.3Å; S40-K44 WeakPolarHBondContact O-CG 3.47Å; S40-K44 PolarHBondContact O-N 3.36Å; S40-G74 VanDerWaalsContact CB-O 3.24Å; S40-G74 WeakPolarHBondContact CB-O 3.34Å
41F96.4Very high96.2Very high18 Ų1833.4 Ų33.48%0.07916%0.157CC..Hα-helixtrans-61.7-35.9178.3-77.1-81.8000112I37 T39 K45 L250 L254 T259 T263 L266I37-F41 HydrophobicContact CG2-CE2 4.11Å; I37-F41 VanDerWaalsContact O-CD2 3.25Å; I37-F41 WeakPolarHBondContact O-CD2 3.45Å; T39-F41 PolarHBondContact O-N 3.47Å; F41-K45 VanDerWaalsContact O-CB 3.26Å; F41-K45 WeakPolarHBondContact O-CB 3.36Å; F41-K45 PolarHBondContact O-N 3.48Å; F41-L250 HydrophobicContact CE1-CD1 4.13Å; F41-L250 HydrophobicContact CE1-CD2 3.94Å; F41-L254 HydrophobicContact CD1-CD1 3.91Å; F41-L254 HydrophobicContact CD1-CD2 4.15Å; F41-L254 HydrophobicContact CE1-CD1 4.4Å; F41-T259 HydrophobicContact CB-CG2 4.18Å; F41-T263 HydrophobicContact CB-CG2 4.2Å; F41-T263 HydrophobicContact CD1-CG2 3.63Å; F41-T263 HydrophobicContact CD2-CG2 4.12Å; F41-T263 HydrophobicContact CE1-CG2 3.97Å; F41-T263 HydrophobicContact CE2-CG2 4.44Å; F41-T263 HydrophobicContact CG-CG2 3.71Å; F41-T263 HydrophobicContact CZ-CG2 4.38Å; F41-L266 HydrophobicContact CE1-CD2 3.91Å; F41-L266 HydrophobicContact CZ-CD2 3.78Å
42I96.9Very high96.1Very high6 Ų632.1 Ų32.13%0.03115%0.153CC..Hα-helixtrans-69.2-49.1-178.9-49.1-59.8000110.5T39 S40 K44 K45 L46 S108 L111 F115 L116T39-I42 WeakPolarHBondContact O-CB 3.25Å; T39-I42 PolarHBondContact O-N 3.4Å; S40-I42 PolarHBondContact O-N 3.4Å; I42-K44 VanDerWaalsContact C-N 3.33Å; I42-K44 PolarHBondContact O-N 2.95Å; I42-K45 PolarHBondContact O-N 2.91Å; I42-L46 HydrophobicContact CG2-CD1 4Å; I42-L46 HydrophobicContact CG2-CG 4.41Å; I42-L46 WeakPolarHBondContact O-CB 3.42Å; I42-L46 VanDerWaalsContact O-CG 3.27Å; I42-L46 WeakPolarHBondContact O-CG 3.49Å; I42-L46 PolarHBondContact O-N 2.84Å; I42-S108 WeakPolarHBondContact CD1-O 2.97Å; I42-L111 HydrophobicContact CD1-CB 3.65Å; I42-L111 HydrophobicContact CG1-CB 3.59Å; I42-L111 HydrophobicContact CG1-CD1 4.1Å; I42-F115 HydrophobicContact CG2-CB 3.79Å; I42-F115 HydrophobicContact CG2-CG 4.4Å; I42-L116 HydrophobicContact CB-CD1 4.49Å; I42-L116 HydrophobicContact CD1-CD1 3.74Å; I42-L116 HydrophobicContact CG2-CD1 4Å; I42-L116 HydrophobicContact CG2-CG 4.42Å
43F97.4Very high96Very high48 Ų4839.3 Ų39.321%0.21118%0.175CC..Hα-helixtrans-59-45.2176.4-84-78.4000111.9T39 S40 L46 A47 M70 M73 L77T39-F43 HydrophobicContact CG2-CD2 3.85Å; T39-F43 HydrophobicContact CG2-CE2 3.68Å; T39-F43 PolarHBondContact O-N 3.49Å; S40-F43 PolarHBondContact O-N 2.83Å; F43-L46 PolarHBondContact O-N 3.25Å; F43-A47 WeakPolarHBondContact O-CB 3.41Å; F43-A47 PolarHBondContact O-N 3.45Å; F43-M70 HydrophobicContact CD1-CE 4.46Å; F43-M73 HydrophobicContact CD1-CE 4.33Å; F43-M73 HydrophobicContact CD1-CG 4.21Å; F43-M73 HydrophobicContact CD1-SD 3.68Å; F43-M73 HydrophobicContact CE1-CE 3.62Å; F43-M73 HydrophobicContact CE1-CG 4.35Å; F43-M73 HydrophobicContact CE1-SD 3.29Å; F43-M73 WeakPolarHBondContact CE1-SD 3.24Å; F43-M73 HydrophobicContact CE2-CE 3.82Å; F43-M73 HydrophobicContact CE2-SD 4.42Å; F43-M73 HydrophobicContact CG-CG 4.47Å; F43-M73 HydrophobicContact CG-SD 4.39Å; F43-M73 HydrophobicContact CZ-CE 3.32Å; F43-M73 HydrophobicContact CZ-SD 3.72Å; F43-L77 HydrophobicContact CD2-CD2 4.4Å
44K97.4Very high95.6Very high0 Ų044.9 Ų44.90%021%0.205CC..Hα-helixtrans-59.8-50.3175.8-71.1-180-73.2-175.40111.5S40 I42 L46 A47 L48 M78 M247S40-K44 VanDerWaalsContact O-CE 3.23Å; S40-K44 WeakPolarHBondContact O-CE 3.36Å; S40-K44 VanDerWaalsContact O-CG 3.3Å; S40-K44 WeakPolarHBondContact O-CG 3.47Å; S40-K44 PolarHBondContact O-N 3.36Å; I42-K44 VanDerWaalsContact C-N 3.33Å; I42-K44 PolarHBondContact O-N 2.95Å; K44-L46 PolarHBondContact O-N 3.35Å; K44-A47 PolarHBondContact O-N 3.12Å; K44-L48 VanDerWaalsContact O-CG 3.23Å; K44-L48 WeakPolarHBondContact O-CG 3.4Å; K44-L48 PolarHBondContact O-N 2.99Å; K44-M78 PolarHBondContact NZ-SD 3.49Å; K44-M247 HydrophobicContact CD-CE 3.25Å; K44-M247 HydrophobicContact CG-CE 4.32Å
45K97Very high95.3Very high10 Ų1047.8 Ų47.84%0.04324%0.236CC..Hα-helixtrans-63.1-39179.5-177.676.4-177.6-173.90112.2F41 I42 L48 R49 L116 E118 L254 D255 F257F41-K45 VanDerWaalsContact O-CB 3.26Å; F41-K45 WeakPolarHBondContact O-CB 3.36Å; F41-K45 PolarHBondContact O-N 3.48Å; I42-K45 PolarHBondContact O-N 2.91Å; K45-L48 PolarHBondContact O-N 3.13Å; K45-R49 WeakPolarHBondContact O-CG 3.42Å; K45-R49 PolarHBondContact O-N 3.29Å; K45-L116 HydrophobicContact CB-CD1 3.99Å; K45-L116 HydrophobicContact CB-CD2 3.99Å; K45-L116 HydrophobicContact CG-CD1 3.81Å; K45-L116 HydrophobicContact CG-CD2 3.38Å; K45-L116 HydrophobicContact CG-CG 4.25Å; K45-E118 WeakPolarHBondContact CE-OE1 3.31Å; K45-E118 IonicContact NZ-OE1 3.4Å; K45-L254 HydrophobicContact CD-CB 4.37Å; K45-L254 WeakPolarHBondContact CD-O 3.36Å; K45-L254 WeakPolarHBondContact CE-O 3.3Å; K45-L254 PolarHBondContact NZ-O 2.92Å; K45-D255 PolarHBondContact NZ-O 3.04Å; K45-F257 PolarHBondContact NZ-O 3.48Å
46L96.7Very high95.1Very high50 Ų5047.5 Ų47.526%0.26223%0.234SC..Hα-helixtrans-61.7-45174.7-75.3169.3000111.6I42 F43 K44 R49 R50 M70 L116I42-L46 HydrophobicContact CG2-CD1 4Å; I42-L46 HydrophobicContact CG2-CG 4.41Å; I42-L46 WeakPolarHBondContact O-CB 3.42Å; I42-L46 VanDerWaalsContact O-CG 3.27Å; I42-L46 WeakPolarHBondContact O-CG 3.49Å; I42-L46 PolarHBondContact O-N 2.84Å; F43-L46 PolarHBondContact O-N 3.25Å; K44-L46 PolarHBondContact O-N 3.35Å; L46-R49 PolarHBondContact O-N 2.85Å; L46-R50 PolarHBondContact O-N 3.38Å; L46-M70 HydrophobicContact CB-CE 3.71Å; L46-M70 HydrophobicContact CD1-CE 3.99Å; L46-M70 HydrophobicContact CG-CE 4.46Å; L46-L116 HydrophobicContact CD2-CD2 3.89Å; L46-L116 HydrophobicContact CD2-CG 4.4Å; L46-L116 HydrophobicContact CG-CD2 4.1Å
47A96.4Very high94.9Very high0 Ų045.4 Ų45.40%023%0.227CC..Hα-helixtrans-63.3-41.8176.500000112.2F43 K44 R50 S51 E68 M70 W71F43-A47 WeakPolarHBondContact O-CB 3.41Å; F43-A47 PolarHBondContact O-N 3.45Å; K44-A47 PolarHBondContact O-N 3.12Å; A47-R50 WeakPolarHBondContact O-CB 3.44Å; A47-R50 PolarHBondContact O-N 2.96Å; A47-S51 PolarHBondContact O-N 3.34Å; A47-E68 HydrophobicContact CB-CB 4.05Å; A47-M70 HydrophobicContact CB-CB 3.87Å; A47-W71 HydrophobicContact CB-CB 3.59Å; A47-W71 VanDerWaalsContact CB-N 3.35Å
48L97Very high94.8Very high2 Ų244.9 Ų44.91%0.0123%0.225CC..Hα-helixtrans-61.1-46.2175.9-68.3167.3000111.5K44 K45 R50 S51 S52 A58 Y65 N251 L254 D255K44-L48 VanDerWaalsContact O-CG 3.23Å; K44-L48 WeakPolarHBondContact O-CG 3.4Å; K44-L48 PolarHBondContact O-N 2.99Å; K45-L48 PolarHBondContact O-N 3.13Å; L48-R50 VanDerWaalsContact C-N 3.28Å; L48-R50 PolarHBondContact O-N 3.32Å; L48-S51 PolarHBondContact O-N 3.05Å; L48-S52 VanDerWaalsContact O-CB 3.32Å; L48-S52 WeakPolarHBondContact O-CB 3.3Å; L48-S52 PolarHBondContact O-N 2.98Å; L48-A58 HydrophobicContact CD2-CB 3.59Å; L48-Y65 HydrophobicContact CD2-CD1 3.67Å; L48-Y65 HydrophobicContact CD2-CD2 4.28Å; L48-Y65 HydrophobicContact CD2-CE1 4.29Å; L48-Y65 HydrophobicContact CD2-CG 3.64Å; L48-N251 HydrophobicContact CD1-CB 4.26Å; L48-N251 HydrophobicContact CD2-CB 4.07Å; L48-L254 HydrophobicContact CD1-CB 3.72Å; L48-D255 HydrophobicContact CB-CB 4.45Å; L48-D255 HydrophobicContact CD1-CB 4.48Å
49R95Very high94.7Very high89 Ų8944.9 Ų44.934%0.33623%0.225SC..Hα-helixtrans-60-38.9175-74.6-176.1177.8-170.64.8112K45 L46 S52 R53 L116 E118K45-R49 WeakPolarHBondContact O-CG 3.42Å; K45-R49 PolarHBondContact O-N 3.29Å; L46-R49 PolarHBondContact O-N 2.85Å; R49-S52 PolarHBondContact O-N 2.89Å; R49-R53 VanDerWaalsContact O-CG 3.31Å; R49-R53 WeakPolarHBondContact O-CG 3.42Å; R49-R53 PolarHBondContact O-N 3.11Å; R49-L116 PolarHBondContact NH1-O 3.4Å; R49-L116 PolarHBondContact NH2-O 3.06Å; R49-E118 IonicContact CZ-OE1 3.65Å; R49-E118 IonicContact NH2-OE1 3.05Å; R49-E118 PolarHBondContact NH2-OE1 3.32Å
50R94.5Very high94.5Very high126 Ų12648 Ų4848%0.47524%0.24SC..Hα-helixtrans-65.2-45177-174.6175.1164.91476.2111.8L46 A47 L48 R53 E68L46-R50 PolarHBondContact O-N 3.38Å; A47-R50 WeakPolarHBondContact O-CB 3.44Å; A47-R50 PolarHBondContact O-N 2.96Å; L48-R50 VanDerWaalsContact C-N 3.28Å; L48-R50 PolarHBondContact O-N 3.32Å; R50-R53 PolarHBondContact O-N 3.16Å; R50-E68 WeakPolarHBondContact CD-OE1 3.44Å; R50-E68 VanDerWaalsContact CD-OE2 3.25Å; R50-E68 WeakPolarHBondContact CD-OE2 3.28Å; R50-E68 WeakPolarHBondContact CG-OE1 3.34Å; R50-E68 IonicContact CZ-OE2 3.73Å; R50-E68 IonicContact NE-OE1 3.89Å; R50-E68 PolarHBondContact NE-OE1 3.22Å; R50-E68 IonicContact NE-OE2 3.81Å; R50-E68 PolarHBondContact NE-OE2 3.26Å
51S93.9Very high94.3Very high4 Ų449.3 Ų49.33%0.02825%0.254CS..Hα-helixtrans-61.8-43.4174.1-174.40000112.1A47 L48 R53 N54 L56 S64 Y65A47-S51 PolarHBondContact O-N 3.34Å; L48-S51 PolarHBondContact O-N 3.05Å; S51-R53 VanDerWaalsContact C-N 3.34Å; S51-R53 PolarHBondContact O-N 2.77Å; S51-N54 WeakPolarHBondContact O-CB 3.39Å; S51-N54 PolarHBondContact O-N 3.48Å; S51-N54 VanDerWaalsContact O-N 3.09Å; S51-L56 CarbonylContact C-O 3.15Å; S51-L56 PolarHBondContact O-N 3.21Å; S51-L56 PolarHBondContact OG-O 2.64Å; S51-S64 WeakPolarHBondContact OG-CB 3.33Å; S51-Y65 PolarHBondContact OG-N 3.31Å
52S93.9Very high94.2Very high46 Ų4649.8 Ų49.832%0.32226%0.259SS..Hα-helixtrans-64.8-34.9-179.3-173.90000112.7L48 R49 N54 G55L48-S52 VanDerWaalsContact O-CB 3.32Å; L48-S52 WeakPolarHBondContact O-CB 3.3Å; L48-S52 PolarHBondContact O-N 2.98Å; R49-S52 PolarHBondContact O-N 2.89Å; S52-N54 PolarHBondContact O-N 2.97Å; S52-G55 PolarHBondContact O-N 3.45Å
53R92.6Very high94.1Very high225 Ų22553.8 Ų53.885%0.84928%0.28SS*.Hα-helixtrans-60.6-24173.2-74.2174.7104.1-177.85.7113.6R49 R50 S51 G55R49-R53 VanDerWaalsContact O-CG 3.31Å; R49-R53 WeakPolarHBondContact O-CG 3.42Å; R49-R53 PolarHBondContact O-N 3.11Å; R50-R53 PolarHBondContact O-N 3.16Å; S51-R53 VanDerWaalsContact C-N 3.34Å; S51-R53 PolarHBondContact O-N 2.77Å; R53-G55 PolarHBondContact O-N 3.38Å
54N89.5Confident93.9Very high118 Ų11853.2 Ų53.263%0.63128%0.282SS*.THydrogen-bonded Turntrans-87.611.9175.1-61.4-22.3000112.6S51 S52 L56S51-N54 WeakPolarHBondContact O-CB 3.39Å; S51-N54 PolarHBondContact O-N 3.48Å; S51-N54 VanDerWaalsContact O-N 3.09Å; S52-N54 PolarHBondContact O-N 2.97Å; N54-L56 VanDerWaalsContact C-N 3.28Å; N54-L56 PolarHBondContact O-N 3.39Å
55G88.1Confident93.8Very high65 Ų6553.5 Ų53.567%0.6728%0.283SS*.THydrogen-bonded Turntrans78.87.1-177.700000114.5S52 R53S52-G55 PolarHBondContact O-N 3.45Å; R53-G55 PolarHBondContact O-N 3.38Å
56L91.6Very high93.7Very high83 Ų8356 Ų5644%0.43530%0.297SS..  trans-115.571.6-174.6-64.2169.9000109.7S51 N54 S64S51-L56 CarbonylContact C-O 3.15Å; S51-L56 PolarHBondContact O-N 3.21Å; S51-L56 PolarHBondContact OG-O 2.64Å; N54-L56 VanDerWaalsContact C-N 3.28Å; N54-L56 PolarHBondContact O-N 3.39Å; L56-S64 WeakPolarHBondContact CB-OG 3.43Å; L56-S64 VanDerWaalsContact CD1-OG 3.28Å; L56-S64 WeakPolarHBondContact CD1-OG 3.45Å
57S93.6Very high93.6Very high15 Ų1559.4 Ų59.411%0.10532%0.323CS..  trans-76133.7-179.1166.50000112G59 D60 S62 D255S57-G59 PolarHBondContact O-N 3.33Å; S57-G59 PolarHBondContact OG-N 2.95Å; S57-G59 VanDerWaalsContact OG-N 3.12Å; S57-D60 PolarHBondContact O-N 3.45Å; S57-S62 VanDerWaalsContact O-CB 3.22Å; S57-S62 WeakPolarHBondContact O-CB 3.35Å; S57-S62 PolarHBondContact O-N 3.34Å; S57-S62 VanDerWaalsContact O-N 3.15Å; S57-D255 WeakPolarHBondContact CB-OD2 3.39Å; S57-D255 PolarHBondContact OG-OD2 3.49Å
58A94.6Very high93.5Very high2 Ų260.5 Ų60.52%0.01733%0.328CS..G310 helixtrans-66.2-31.9171.600000111.3L48 D60 G61 S62 Y65 R252 D255L48-A58 HydrophobicContact CD2-CB 3.59Å; A58-D60 PolarHBondContact O-N 3.38Å; A58-G61 WeakPolarHBondContact O-CA 3.35Å; A58-G61 PolarHBondContact O-N 3.27Å; A58-S62 WeakPolarHBondContact CA-O 2.98Å; A58-Y65 HydrophobicContact CB-CD1 3.61Å; A58-Y65 HydrophobicContact CB-CE1 3.57Å; A58-R252 WeakPolarHBondContact O-CG 3.31Å; A58-D255 HydrophobicContact CB-CB 3.98Å; A58-D255 PolarHBondContact N-OD2 2.95Å
59G91.8Very high93.5Very high0 Ų068 Ų680%036%0.356CS..G310 helixtrans-53.5-33.5172.700000113.2S57 G61 R252 D255S57-G59 PolarHBondContact O-N 3.33Å; S57-G59 PolarHBondContact OG-N 2.95Å; S57-G59 VanDerWaalsContact OG-N 3.12Å; G59-G61 VanDerWaalsContact C-N 3.34Å; G59-R252 PolarHBondContact O-NE 3.41Å; G59-R252 PolarHBondContact O-NH2 2.9Å; G59-D255 PolarHBondContact N-OD2 2.88Å
60D92.6Very high93.5Very high102 Ų10265.3 Ų65.355%0.54535%0.348SS..G310 helixtrans-86.8-1.6176.4-65.1-31.3000114.1S57 A58 K187S57-D60 PolarHBondContact O-N 3.45Å; A58-D60 PolarHBondContact O-N 3.38Å; D60-K187 WeakPolarHBondContact OD1-CE 3.31Å; D60-K187 IonicContact OD1-NZ 2.64Å; D60-K187 PolarHBondContact OD1-NZ 3.03Å
61G92.4Very high93.7Very high27 Ų2759.9 Ų59.928%0.27833%0.328SS..THydrogen-bonded Turntrans96.34.5179.700000114.4A58 G59 Y248A58-G61 WeakPolarHBondContact O-CA 3.35Å; A58-G61 PolarHBondContact O-N 3.27Å; G59-G61 VanDerWaalsContact C-N 3.34Å; G61-Y248 WeakPolarHBondContact CA-OH 3.13Å
62S94.3Very high93.9Very high27 Ų2765.3 Ų65.319%0.18935%0.348CS..  trans-66.9144174.4-177.80000111.7S57 A58 S64 Y65S57-S62 VanDerWaalsContact O-CB 3.22Å; S57-S62 WeakPolarHBondContact O-CB 3.35Å; S57-S62 PolarHBondContact O-N 3.34Å; S57-S62 VanDerWaalsContact O-N 3.15Å; A58-S62 WeakPolarHBondContact CA-O 2.98Å; S62-S64 PolarHBondContact OG-N 3.48Å; S62-S64 PolarHBondContact OG-OG 2.83Å; S62-Y65 WeakPolarHBondContact O-CE1 3.42Å
63L95.6Very high94Very high90 Ų9066.8 Ų66.847%0.47135%0.35SS..  trans-103.910.8175.2-63.4179.5000113.1Y65 L66 Y248L63-Y65 HydrophobicContact CD2-CE1 4.14Å; L63-Y65 WeakPolarHBondContact CD2-OH 3.44Å; L63-Y65 PolarHBondContact O-N 2.89Å; L63-Y65 VanDerWaalsContact O-N 3.08Å; L63-L66 HydrophobicContact CB-CD1 4.04Å; L63-L66 HydrophobicContact CB-CG 4.49Å; L63-L66 VanDerWaalsContact O-CB 3.31Å; L63-L66 WeakPolarHBondContact O-CB 3.39Å; L63-L66 WeakPolarHBondContact O-CG 3.29Å; L63-L66 PolarHBondContact O-N 3.21Å; L63-Y248 HydrophobicContact CD2-CD2 3.63Å; L63-Y248 HydrophobicContact CD2-CE2 3.66Å
64S93.9Very high94.3Very high37 Ų3756 Ų5626%0.25931%0.31SS..G310 helixtrans-61.4-21.6-175.1-58.70000114.4S51 L56 S62 L66 C67S51-S64 WeakPolarHBondContact OG-CB 3.33Å; L56-S64 WeakPolarHBondContact CB-OG 3.43Å; L56-S64 VanDerWaalsContact CD1-OG 3.28Å; L56-S64 WeakPolarHBondContact CD1-OG 3.45Å; S62-S64 PolarHBondContact OG-N 3.48Å; S62-S64 PolarHBondContact OG-OG 2.83Å; S64-L66 PolarHBondContact O-N 3.43Å; S64-C67 WeakPolarHBondContact O-CB 3.35Å; S64-C67 PolarHBondContact O-N 3.41Å
65Y94.7Very high94.6Very high5 Ų553.3 Ų53.32%0.0229%0.292CS..G310 helixtrans-62.1-19.4172.562.2-98.6000113.3L48 S51 A58 S62 L63 C67 E68 W71 N251L48-Y65 HydrophobicContact CD2-CD1 3.67Å; L48-Y65 HydrophobicContact CD2-CD2 4.28Å; L48-Y65 HydrophobicContact CD2-CE1 4.29Å; L48-Y65 HydrophobicContact CD2-CG 3.64Å; S51-Y65 PolarHBondContact OG-N 3.31Å; A58-Y65 HydrophobicContact CB-CD1 3.61Å; A58-Y65 HydrophobicContact CB-CE1 3.57Å; S62-Y65 WeakPolarHBondContact O-CE1 3.42Å; L63-Y65 HydrophobicContact CD2-CE1 4.14Å; L63-Y65 WeakPolarHBondContact CD2-OH 3.44Å; L63-Y65 PolarHBondContact O-N 2.89Å; L63-Y65 VanDerWaalsContact O-N 3.08Å; Y65-C67 PolarHBondContact O-N 3.34Å; Y65-E68 WeakPolarHBondContact O-CB 3.41Å; Y65-E68 PolarHBondContact O-N 2.97Å; Y65-E68 VanDerWaalsContact O-N 3.09Å; Y65-W71 AromaticContact CD2-CD1 3.62Å; Y65-W71 AromaticContact CD2-CD2 3.91Å; Y65-W71 HydrophobicContact CD2-CD2 3.91Å; Y65-W71 AromaticContact CD2-CE2 3.71Å; Y65-W71 AromaticContact CD2-CG 3.88Å; Y65-W71 HydrophobicContact CD2-CG 3.88Å; Y65-W71 HydrophobicContact CD2-CZ2 4.37Å; Y65-W71 AromaticContact CD2-NE1 3.5Å; Y65-W71 HydrophobicContact CE2-CD2 4.32Å; Y65-W71 AromaticContact CE2-CE2 3.71Å; Y65-W71 AromaticContact CE2-CZ2 3.94Å; Y65-W71 HydrophobicContact CE2-CZ2 3.94Å; Y65-W71 AromaticContact CE2-NE1 3.69Å; Y65-W71 WeakPolarHBondContact O-CB 3.45Å; Y65-N251 HydrophobicContact CE1-CB 4.39Å; Y65-N251 HydrophobicContact CE2-CB 4.41Å; Y65-N251 WeakPolarHBondContact CE2-ND2 3.45Å; Y65-N251 PolarHBondContact OH-ND2 3.23Å
66L95.6Very high95.1Very high64 Ų6454.8 Ų54.834%0.33528%0.284SS..G310 helixtrans-68-19174-63.3178.9000112.5L63 S64 E68 W71 W72L63-L66 HydrophobicContact CB-CD1 4.04Å; L63-L66 HydrophobicContact CB-CG 4.49Å; L63-L66 VanDerWaalsContact O-CB 3.31Å; L63-L66 WeakPolarHBondContact O-CB 3.39Å; L63-L66 WeakPolarHBondContact O-CG 3.29Å; L63-L66 PolarHBondContact O-N 3.21Å; S64-L66 PolarHBondContact O-N 3.43Å; L66-E68 VanDerWaalsContact C-N 3.33Å; L66-W71 HydrophobicContact CD2-CD2 4.25Å; L66-W71 HydrophobicContact CD2-CE3 3.81Å; L66-W71 HydrophobicContact CD2-CH2 3.43Å; L66-W71 VanDerWaalsContact CD2-CH2 3.43Å; L66-W71 HydrophobicContact CD2-CZ2 3.88Å; L66-W71 HydrophobicContact CD2-CZ3 3.38Å; L66-W72 PolarHBondContact O-NE1 3.37Å
67C93.6Very high95.4Very high120 Ų12052 Ų5281%0.81127%0.27SS*.G310 helixtrans-83.6-12.5172.8-60.30000112.4S64 Y65S64-C67 WeakPolarHBondContact O-CB 3.35Å; S64-C67 PolarHBondContact O-N 3.41Å; Y65-C67 PolarHBondContact O-N 3.34Å
68E94.7Very high95.5Very high24 Ų2453 Ų5311%0.11227%0.273CS..  trans-84.5116-179.4-71.2-70.7175.300110.4A47 R50 Y65 L66 M70 W71A47-E68 HydrophobicContact CB-CB 4.05Å; R50-E68 WeakPolarHBondContact CD-OE1 3.44Å; R50-E68 VanDerWaalsContact CD-OE2 3.25Å; R50-E68 WeakPolarHBondContact CD-OE2 3.28Å; R50-E68 WeakPolarHBondContact CG-OE1 3.34Å; R50-E68 IonicContact CZ-OE2 3.73Å; R50-E68 IonicContact NE-OE1 3.89Å; R50-E68 PolarHBondContact NE-OE1 3.22Å; R50-E68 IonicContact NE-OE2 3.81Å; R50-E68 PolarHBondContact NE-OE2 3.26Å; Y65-E68 WeakPolarHBondContact O-CB 3.41Å; Y65-E68 PolarHBondContact O-N 2.97Å; Y65-E68 VanDerWaalsContact O-N 3.09Å; L66-E68 VanDerWaalsContact C-N 3.33Å; E68-M70 PolarHBondContact O-N 3.33Å; E68-M70 VanDerWaalsContact O-N 3.14Å; E68-W71 HydrophobicContact CB-CB 4.46Å; E68-W71 WeakPolarHBondContact O-CB 3.29Å; E68-W71 PolarHBondContact O-N 2.85Å
69W96.4Very high95.5Very high158 Ų15854.9 Ų54.960%0.59829%0.293SS*.Hα-helixtrans-58.3-30.4179.575-90.5000112.7W71 W72 M73W69-W71 VanDerWaalsContact C-N 3.26Å; W69-W71 PolarHBondContact O-N 3.35Å; W69-W72 PolarHBondContact O-N 2.91Å; W69-M73 HydrophobicContact CE3-CB 4.43Å; W69-M73 HydrophobicContact CH2-SD 4.37Å; W69-M73 HydrophobicContact CZ3-CB 4.38Å; W69-M73 HydrophobicContact CZ3-SD 3.71Å; W69-M73 PolarHBondContact O-N 3.17Å
70M96Very high95.7Very high33 Ų3358.8 Ų58.816%0.16331%0.313CS..Hα-helixtrans-63.9-32.1176.4-66.1-179.969.600112F43 L46 A47 E68 G74F43-M70 HydrophobicContact CD1-CE 4.46Å; L46-M70 HydrophobicContact CB-CE 3.71Å; L46-M70 HydrophobicContact CD1-CE 3.99Å; L46-M70 HydrophobicContact CG-CE 4.46Å; A47-M70 HydrophobicContact CB-CB 3.87Å; E68-M70 PolarHBondContact O-N 3.33Å; E68-M70 VanDerWaalsContact O-N 3.14Å; M70-G74 PolarHBondContact O-N 2.97Å; M70-G74 VanDerWaalsContact O-N 3.09Å
71W97.5Very high95.9Very high12 Ų1254 Ų545%0.04529%0.287CS..Hα-helixtrans-67.9-45.5176.8-17885.7000110.4A47 Y65 L66 E68 W69 M73 G74 F75 M247 N251A47-W71 HydrophobicContact CB-CB 3.59Å; A47-W71 VanDerWaalsContact CB-N 3.35Å; Y65-W71 AromaticContact CD2-CD1 3.62Å; Y65-W71 AromaticContact CD2-CD2 3.91Å; Y65-W71 HydrophobicContact CD2-CD2 3.91Å; Y65-W71 AromaticContact CD2-CE2 3.71Å; Y65-W71 AromaticContact CD2-CG 3.88Å; Y65-W71 HydrophobicContact CD2-CG 3.88Å; Y65-W71 HydrophobicContact CD2-CZ2 4.37Å; Y65-W71 AromaticContact CD2-NE1 3.5Å; Y65-W71 HydrophobicContact CE2-CD2 4.32Å; Y65-W71 AromaticContact CE2-CE2 3.71Å; Y65-W71 AromaticContact CE2-CZ2 3.94Å; Y65-W71 HydrophobicContact CE2-CZ2 3.94Å; Y65-W71 AromaticContact CE2-NE1 3.69Å; Y65-W71 WeakPolarHBondContact O-CB 3.45Å; L66-W71 HydrophobicContact CD2-CD2 4.25Å; L66-W71 HydrophobicContact CD2-CE3 3.81Å; L66-W71 HydrophobicContact CD2-CH2 3.43Å; L66-W71 VanDerWaalsContact CD2-CH2 3.43Å; L66-W71 HydrophobicContact CD2-CZ2 3.88Å; L66-W71 HydrophobicContact CD2-CZ3 3.38Å; E68-W71 HydrophobicContact CB-CB 4.46Å; E68-W71 WeakPolarHBondContact O-CB 3.29Å; E68-W71 PolarHBondContact O-N 2.85Å; W69-W71 VanDerWaalsContact C-N 3.26Å; W69-W71 PolarHBondContact O-N 3.35Å; W71-M73 VanDerWaalsContact C-N 3.35Å; W71-M73 PolarHBondContact O-N 3.14Å; W71-G74 PolarHBondContact O-N 3.35Å; W71-G74 VanDerWaalsContact O-N 3.15Å; W71-F75 HydrophobicContact CH2-CB 4.43Å; W71-F75 HydrophobicContact CH2-CD2 4.29Å; W71-F75 HydrophobicContact CH2-CG 4.3Å; W71-F75 HydrophobicContact CZ2-CD2 4.48Å; W71-F75 HydrophobicContact CZ3-CB 4.38Å; W71-F75 PolarHBondContact O-N 3.19Å; W71-M247 HydrophobicContact CZ2-CE 3.83Å; W71-M247 HydrophobicContact CZ2-CG 3.96Å; W71-N251 WeakPolarHBondContact CZ2-ND2 3.24Å; W71-N251 PolarHBondContact NE1-ND2 3.14Å; W71-N251 PolarHBondContact NE1-OD1 3.47Å
72W97.9Very high95.9Very high119 Ų11957 Ų5745%0.45129%0.293SS..Hα-helixtrans-61.6-41.3175.2-73.8102.9000112.4L66 W69 G74 F75 I76L66-W72 PolarHBondContact O-NE1 3.37Å; W69-W72 PolarHBondContact O-N 2.91Å; W72-G74 VanDerWaalsContact C-N 3.3Å; W72-G74 PolarHBondContact O-N 3.13Å; W72-F75 HydrophobicContact CE3-CD1 4.37Å; W72-F75 HydrophobicContact CZ3-CD1 4.33Å; W72-F75 PolarHBondContact O-N 2.93Å; W72-I76 WeakPolarHBondContact O-CB 3.43Å; W72-I76 VanDerWaalsContact O-CG1 3.28Å; W72-I76 WeakPolarHBondContact O-CG1 3.19Å; W72-I76 PolarHBondContact O-N 3.49Å
73M97.7Very high95.8Very high76 Ų7662.4 Ų62.437%0.37431%0.314SS..Hα-helixtrans-56.5-46.2173.1-178.1178.6176.800111.1F43 W69 W71 L77F43-M73 HydrophobicContact CD1-CE 4.33Å; F43-M73 HydrophobicContact CD1-CG 4.21Å; F43-M73 HydrophobicContact CD1-SD 3.68Å; F43-M73 HydrophobicContact CE1-CE 3.62Å; F43-M73 HydrophobicContact CE1-CG 4.35Å; F43-M73 HydrophobicContact CE1-SD 3.29Å; F43-M73 WeakPolarHBondContact CE1-SD 3.24Å; F43-M73 HydrophobicContact CE2-CE 3.82Å; F43-M73 HydrophobicContact CE2-SD 4.42Å; F43-M73 HydrophobicContact CG-CG 4.47Å; F43-M73 HydrophobicContact CG-SD 4.39Å; F43-M73 HydrophobicContact CZ-CE 3.32Å; F43-M73 HydrophobicContact CZ-SD 3.72Å; W69-M73 HydrophobicContact CE3-CB 4.43Å; W69-M73 HydrophobicContact CH2-SD 4.37Å; W69-M73 HydrophobicContact CZ3-CB 4.38Å; W69-M73 HydrophobicContact CZ3-SD 3.71Å; W69-M73 PolarHBondContact O-N 3.17Å; W71-M73 VanDerWaalsContact C-N 3.35Å; W71-M73 PolarHBondContact O-N 3.14Å; M73-L77 VanDerWaalsContact O-CB 3.26Å; M73-L77 WeakPolarHBondContact O-CB 3.45Å; M73-L77 PolarHBondContact O-N 3.27Å
74G97.4Very high95.8Very high0 Ų058.6 Ų58.60%030%0.295CS..Hα-helixtrans-62.3-45.417500000112.8S40 M70 W71 W72 L77 M78S40-G74 VanDerWaalsContact CB-O 3.24Å; S40-G74 WeakPolarHBondContact CB-O 3.34Å; M70-G74 PolarHBondContact O-N 2.97Å; M70-G74 VanDerWaalsContact O-N 3.09Å; W71-G74 PolarHBondContact O-N 3.35Å; W71-G74 VanDerWaalsContact O-N 3.15Å; W72-G74 VanDerWaalsContact C-N 3.3Å; W72-G74 PolarHBondContact O-N 3.13Å; G74-L77 PolarHBondContact O-N 2.76Å; G74-M78 PolarHBondContact O-N 3.42Å
75F96.9Very high95.7Very high60 Ų6057.9 Ų57.926%0.26329%0.288SS..Hα-helixtrans-62-45.5178.9-175.2-102.1000112.6W71 W72 M78 G79 I243 M247W71-F75 HydrophobicContact CH2-CB 4.43Å; W71-F75 HydrophobicContact CH2-CD2 4.29Å; W71-F75 HydrophobicContact CH2-CG 4.3Å; W71-F75 HydrophobicContact CZ2-CD2 4.48Å; W71-F75 HydrophobicContact CZ3-CB 4.38Å; W71-F75 PolarHBondContact O-N 3.19Å; W72-F75 HydrophobicContact CE3-CD1 4.37Å; W72-F75 HydrophobicContact CZ3-CD1 4.33Å; W72-F75 PolarHBondContact O-N 2.93Å; F75-M78 WeakPolarHBondContact O-CB 3.31Å; F75-M78 PolarHBondContact O-N 3.5Å; F75-G79 PolarHBondContact O-N 3.41Å; F75-G79 VanDerWaalsContact O-N 3.11Å; F75-I243 HydrophobicContact CE2-CG2 4.34Å; F75-I243 HydrophobicContact CZ-CG2 4.22Å; F75-M247 HydrophobicContact CD2-CE 4.24Å; F75-M247 HydrophobicContact CD2-CG 4.24Å; F75-M247 HydrophobicContact CD2-SD 4.08Å; F75-M247 HydrophobicContact CE2-CG 4.15Å; F75-M247 HydrophobicContact CE2-SD 4.25Å
76I97.7Very high95.4Very high96 Ų9663.8 Ų63.849%0.49232%0.315SS..Hα-helixtrans-63.7-43.1176.9-67.6165.4000110.5W72 M78 G79 I80W72-I76 WeakPolarHBondContact O-CB 3.43Å; W72-I76 VanDerWaalsContact O-CG1 3.28Å; W72-I76 WeakPolarHBondContact O-CG1 3.19Å; W72-I76 PolarHBondContact O-N 3.49Å; I76-M78 VanDerWaalsContact C-N 3.28Å; I76-M78 PolarHBondContact O-N 2.89Å; I76-G79 PolarHBondContact O-N 2.98Å; I76-G79 VanDerWaalsContact O-N 3.08Å; I76-I80 HydrophobicContact CG2-CD1 3.94Å; I76-I80 HydrophobicContact CG2-CG1 4.37Å; I76-I80 WeakPolarHBondContact O-CG1 3.4Å; I76-I80 PolarHBondContact O-N 3.48Å
77L97.7Very high95.2Very high26 Ų2662.5 Ų62.514%0.13631%0.309CS..Hα-helixtrans-61-38.9178.4-166.365.6000111.9F36 T39 F43 M73 G74 I80 G81F36-L77 HydrophobicContact CB-CD1 4.02Å; F36-L77 HydrophobicContact CB-CG 3.98Å; F36-L77 HydrophobicContact CD1-CD1 3.45Å; F36-L77 VanDerWaalsContact CD1-CD1 3.45Å; F36-L77 HydrophobicContact CD1-CG 4.18Å; F36-L77 HydrophobicContact CE1-CD1 3.96Å; F36-L77 HydrophobicContact CG-CD1 3.76Å; F36-L77 HydrophobicContact CG-CG 4.28Å; T39-L77 HydrophobicContact CG2-CD2 3.86Å; F43-L77 HydrophobicContact CD2-CD2 4.4Å; M73-L77 VanDerWaalsContact O-CB 3.26Å; M73-L77 WeakPolarHBondContact O-CB 3.45Å; M73-L77 PolarHBondContact O-N 3.27Å; G74-L77 PolarHBondContact O-N 2.76Å; L77-I80 PolarHBondContact O-N 3.11Å; L77-G81 PolarHBondContact O-N 3.46Å
78M96.3Very high95.2Very high36 Ų3656.8 Ų56.818%0.17727%0.27CS..Hα-helixtrans-60.4-46.7172.6-170.8-180115.300111.1K44 G74 F75 I76 I80 G81 E82K44-M78 PolarHBondContact NZ-SD 3.49Å; G74-M78 PolarHBondContact O-N 3.42Å; F75-M78 WeakPolarHBondContact O-CB 3.31Å; F75-M78 PolarHBondContact O-N 3.5Å; I76-M78 VanDerWaalsContact C-N 3.28Å; I76-M78 PolarHBondContact O-N 2.89Å; M78-I80 PolarHBondContact O-N 3.43Å; M78-G81 PolarHBondContact O-N 2.84Å; M78-E82 WeakPolarHBondContact O-CG 3.45Å; M78-E82 PolarHBondContact O-N 3.33Å
79G94.9Very high94.8Very high41 Ų4159.7 Ų59.742%0.42328%0.281SS..Hα-helixtrans-61.5-42.3177.800000113.6F75 I76 G81 E82 F83F75-G79 PolarHBondContact O-N 3.41Å; F75-G79 VanDerWaalsContact O-N 3.11Å; I76-G79 PolarHBondContact O-N 2.98Å; I76-G79 VanDerWaalsContact O-N 3.08Å; G79-G81 VanDerWaalsContact C-N 3.34Å; G79-E82 PolarHBondContact O-N 3.25Å; G79-F83 WeakPolarHBondContact O-CB 3.29Å; G79-F83 PolarHBondContact O-N 2.88Å
80I96.9Very high94.4Very high82 Ų8256 Ų5642%0.42128%0.276SS..Hα-helixtrans-62.7-43.2174.8-64.7170.1000110.4F36 I76 L77 M78 F83 A84F36-I80 HydrophobicContact CD2-CB 4.46Å; F36-I80 HydrophobicContact CD2-CG2 3.74Å; F36-I80 HydrophobicContact CE2-CG2 3.69Å; I76-I80 HydrophobicContact CG2-CD1 3.94Å; I76-I80 HydrophobicContact CG2-CG1 4.37Å; I76-I80 WeakPolarHBondContact O-CG1 3.4Å; I76-I80 PolarHBondContact O-N 3.48Å; L77-I80 PolarHBondContact O-N 3.11Å; M78-I80 PolarHBondContact O-N 3.43Å; I80-F83 PolarHBondContact O-N 2.97Å; I80-A84 WeakPolarHBondContact O-CB 3.42Å; I80-A84 PolarHBondContact O-N 3.1Å
81G96.3Very high94.1Very high0 Ų057.5 Ų57.50%028%0.282CS..Hα-helixtrans-60.1-50.7176.900000112.5S33 L77 M78 G79 F83 A84 N85S33-G81 VanDerWaalsContact CB-O 3.23Å; S33-G81 WeakPolarHBondContact CB-O 3.27Å; S33-G81 PolarHBondContact OG-O 2.86Å; L77-G81 PolarHBondContact O-N 3.46Å; M78-G81 PolarHBondContact O-N 2.84Å; G79-G81 VanDerWaalsContact C-N 3.34Å; G81-F83 VanDerWaalsContact C-N 3.32Å; G81-F83 PolarHBondContact O-N 3.44Å; G81-A84 PolarHBondContact O-N 3.16Å; G81-N85 PolarHBondContact O-N 3.45Å
82E92.7Very high93.7Very high90 Ų9057 Ų5742%0.42128%0.28SS..Hα-helixtrans-60.2-40.4176.9-71.1-64.3165.800112.5I37 M78 G79 N85 F86I37-E82 HydrophobicContact CD1-CG 4.36Å; M78-E82 WeakPolarHBondContact O-CG 3.45Å; M78-E82 PolarHBondContact O-N 3.33Å; G79-E82 PolarHBondContact O-N 3.25Å; E82-N85 WeakPolarHBondContact O-CB 3.44Å; E82-N85 PolarHBondContact O-N 3.38Å; E82-F86 PolarHBondContact O-N 2.82Å
83F91.8Very high92.9Very high142 Ų14254 Ų5462%0.62328%0.276SS*.Hα-helixtrans-64-44.2175-176.8-102.4000111.9G79 I80 G81 N85 F86 V87G79-F83 WeakPolarHBondContact O-CB 3.29Å; G79-F83 PolarHBondContact O-N 2.88Å; I80-F83 PolarHBondContact O-N 2.97Å; G81-F83 VanDerWaalsContact C-N 3.32Å; G81-F83 PolarHBondContact O-N 3.44Å; F83-N85 VanDerWaalsContact C-N 3.27Å; F83-N85 PolarHBondContact O-N 3.11Å; F83-F86 WeakPolarHBondContact O-CB 3.26Å; F83-F86 PolarHBondContact O-N 2.86Å; F83-V87 HydrophobicContact CD1-CG2 4.27Å; F83-V87 HydrophobicContact CE1-CG2 3.87Å; F83-V87 HydrophobicContact CE2-CG2 4.47Å; F83-V87 HydrophobicContact CZ-CG2 3.98Å; F83-V87 WeakPolarHBondContact O-CG2 3.36Å; F83-V87 PolarHBondContact O-N 3.47Å
84A94.4Very high92.2Very high9 Ų953.1 Ų53.17%0.07428%0.28CS..Hα-helixtrans-61.1-37.8174.400000111.7I80 G81 V87 A88I80-A84 WeakPolarHBondContact O-CB 3.42Å; I80-A84 PolarHBondContact O-N 3.1Å; G81-A84 PolarHBondContact O-N 3.16Å; A84-V87 PolarHBondContact O-N 3.29Å; A84-A88 WeakPolarHBondContact O-CB 3.4Å; A84-A88 PolarHBondContact O-N 3.22Å
85N92.9Very high91.3Very high22 Ų2258.7 Ų58.712%0.11831%0.309CS..Hα-helixtrans-61.2-46.6174.1-158.834.7000111.5S33 G81 E82 F83 V87 A88 Y89 V97S33-N85 WeakPolarHBondContact OG-CB 3.33Å; G81-N85 PolarHBondContact O-N 3.45Å; E82-N85 WeakPolarHBondContact O-CB 3.44Å; E82-N85 PolarHBondContact O-N 3.38Å; F83-N85 VanDerWaalsContact C-N 3.27Å; F83-N85 PolarHBondContact O-N 3.11Å; N85-V87 VanDerWaalsContact C-N 3.35Å; N85-V87 PolarHBondContact O-N 3.38Å; N85-A88 WeakPolarHBondContact O-CB 3.42Å; N85-A88 PolarHBondContact O-N 3.47Å; N85-A88 VanDerWaalsContact O-N 3.15Å; N85-Y89 WeakPolarHBondContact O-CD2 3.48Å; N85-Y89 PolarHBondContact O-N 3.13Å; N85-V97 WeakPolarHBondContact OD1-CG1 3.43Å
86F88.6Confident90.6Very high130 Ų13058 Ų5857%0.5731%0.308SS*.Hα-helixtrans-59-45.6176.7-178.9-99.2000111.8E82 F83 A88 Y89E82-F86 PolarHBondContact O-N 2.82Å; F83-F86 WeakPolarHBondContact O-CB 3.26Å; F83-F86 PolarHBondContact O-N 2.86Å; F86-A88 VanDerWaalsContact C-N 3.32Å; F86-A88 PolarHBondContact O-N 3.14Å; F86-Y89 PolarHBondContact O-N 2.95Å
87V91.2Very high90.1Very high36 Ų3653.5 Ų53.522%0.21829%0.285CS..Hα-helixtrans-64.7-37.5176.1179.50000111L29 F83 A84 N85 Y89 T90 F91L29-V87 HydrophobicContact CD1-CB 4.37Å; L29-V87 HydrophobicContact CD1-CG1 3.75Å; F83-V87 HydrophobicContact CD1-CG2 4.27Å; F83-V87 HydrophobicContact CE1-CG2 3.87Å; F83-V87 HydrophobicContact CE2-CG2 4.47Å; F83-V87 HydrophobicContact CZ-CG2 3.98Å; F83-V87 WeakPolarHBondContact O-CG2 3.36Å; F83-V87 PolarHBondContact O-N 3.47Å; A84-V87 PolarHBondContact O-N 3.29Å; N85-V87 VanDerWaalsContact C-N 3.35Å; N85-V87 PolarHBondContact O-N 3.38Å; V87-Y89 VanDerWaalsContact C-N 3.28Å; V87-Y89 PolarHBondContact O-N 2.99Å; V87-T90 WeakPolarHBondContact O-CB 3.35Å; V87-T90 PolarHBondContact O-N 2.95Å; V87-T90 PolarHBondContact O-OG1 3.17Å; V87-F91 HydrophobicContact CG1-CD2 3.96Å; V87-F91 HydrophobicContact CG1-CE2 3.66Å; V87-F91 WeakPolarHBondContact O-CD2 3.46Å
88A92.8Very high89.4Confident0 Ų053.7 Ų53.70%029%0.287CS..Hα-helixtrans-57.9-37.8177.800000112.5L29 A30 A84 N85 F86 T90 F91 A92 V97L29-A88 HydrophobicContact CB-CB 3.9Å; A30-A88 HydrophobicContact CB-CB 4.13Å; A84-A88 WeakPolarHBondContact O-CB 3.4Å; A84-A88 PolarHBondContact O-N 3.22Å; N85-A88 WeakPolarHBondContact O-CB 3.42Å; N85-A88 PolarHBondContact O-N 3.47Å; N85-A88 VanDerWaalsContact O-N 3.15Å; F86-A88 VanDerWaalsContact C-N 3.32Å; F86-A88 PolarHBondContact O-N 3.14Å; A88-T90 PolarHBondContact O-N 3.36Å; A88-F91 PolarHBondContact O-N 2.97Å; A88-A92 PolarHBondContact O-N 3.28Å; A88-V97 HydrophobicContact CB-CG1 4.12Å; A88-V97 HydrophobicContact CB-CG2 4.2Å
89Y86.7Confident88.7Confident86 Ų8653.5 Ų53.534%0.33729%0.289SS..Hα-helixtrans-62-23.5175.4-75.1-69.8000113.7N85 F86 V87 F91 A94 V97 T98N85-Y89 WeakPolarHBondContact O-CD2 3.48Å; N85-Y89 PolarHBondContact O-N 3.13Å; F86-Y89 PolarHBondContact O-N 2.95Å; V87-Y89 VanDerWaalsContact C-N 3.28Å; V87-Y89 PolarHBondContact O-N 2.99Å; Y89-F91 VanDerWaalsContact C-N 3.34Å; Y89-A94 HydrophobicContact CD1-CB 3.94Å; Y89-A94 HydrophobicContact CE1-CB 3.73Å; Y89-V97 HydrophobicContact CD1-CB 3.97Å; Y89-V97 HydrophobicContact CD1-CG1 4.08Å; Y89-V97 HydrophobicContact CD1-CG2 4.31Å; Y89-V97 HydrophobicContact CD2-CG1 4.14Å; Y89-V97 HydrophobicContact CE1-CB 3.67Å; Y89-V97 HydrophobicContact CE1-CG1 3.76Å; Y89-V97 HydrophobicContact CE1-CG2 4.5Å; Y89-V97 HydrophobicContact CE2-CG1 3.83Å; Y89-V97 HydrophobicContact CG-CG1 4.25Å; Y89-T98 PolarHBondContact OH-OG1 3.2Å
90T88.5Confident88.2Confident80 Ų8052.7 Ų52.749%0.49128%0.275SS..Hα-helixtrans-73.7-30.4174.974.60000111.5K18 V87 A88K18-T90 WeakPolarHBondContact CE-O 3.41Å; K18-T90 PolarHBondContact NZ-O 3.46Å; V87-T90 WeakPolarHBondContact O-CB 3.35Å; V87-T90 PolarHBondContact O-N 2.95Å; V87-T90 PolarHBondContact O-OG1 3.17Å; A88-T90 PolarHBondContact O-N 3.36Å
91F89.3Confident87.6Confident65 Ų6549.4 Ų49.429%0.28526%0.261SS..Hα-helixtrans-101.5-32.6-174.1-70.3-67.7000114.2K18 N22 I25 L29 V87 A88 Y89K18-F91 WeakPolarHBondContact CD-O 3.4Å; K18-F91 WeakPolarHBondContact CE-O 3.24Å; K18-F91 PolarHBondContact NZ-O 3.05Å; N22-F91 HydrophobicContact CB-CD1 4.22Å; N22-F91 WeakPolarHBondContact O-CB 3.33Å; I25-F91 HydrophobicContact CG2-CB 4.47Å; I25-F91 HydrophobicContact CG2-CD1 4.3Å; I25-F91 HydrophobicContact CG2-CD2 3.96Å; I25-F91 HydrophobicContact CG2-CE2 4.25Å; I25-F91 HydrophobicContact CG2-CG 3.99Å; L29-F91 HydrophobicContact CD1-CD2 3.99Å; L29-F91 HydrophobicContact CD1-CE2 4.38Å; V87-F91 HydrophobicContact CG1-CD2 3.96Å; V87-F91 HydrophobicContact CG1-CE2 3.66Å; V87-F91 WeakPolarHBondContact O-CD2 3.46Å; A88-F91 PolarHBondContact O-N 2.97Å; Y89-F91 VanDerWaalsContact C-N 3.34Å
92A88.6Confident87.2Confident1 Ų149.4 Ų49.41%0.00826%0.261CS..SBendtrans-119.7153.5-179.700000111.7A88 L96 V97A88-A92 PolarHBondContact O-N 3.28Å; A92-L96 HydrophobicContact CB-CD2 3.93Å; A92-V97 HydrophobicContact CB-CG2 3.65Å
93P81.9Confident87Confident57 Ų5748.1 Ų48.137%0.3726%0.256SS..  trans-69.5148.1177.730.4-35.3000111.1I95 L96 V97P93-I95 HydrophobicContact CB-CG2 4.09Å; P93-I95 HydrophobicContact CG-CG2 4.1Å; P93-I95 PolarHBondContact O-N 3.09Å; P93-I95 VanDerWaalsContact O-N 3.16Å; P93-L96 HydrophobicContact CG-CB 4.16Å; P93-L96 WeakPolarHBondContact O-CB 3.23Å; P93-L96 PolarHBondContact O-N 2.62Å; P93-V97 PolarHBondContact O-N 2.87Å
94A81.9Confident87.1Confident56 Ų5641.9 Ų41.946%0.46323%0.23SC..Hα-helixtrans-58.2-32.4-178.100000113.5Y89 L96 V97 T98Y89-A94 HydrophobicContact CD1-CB 3.94Å; Y89-A94 HydrophobicContact CE1-CB 3.73Å; A94-L96 PolarHBondContact O-N 2.95Å; A94-L96 VanDerWaalsContact O-N 3.15Å; A94-V97 PolarHBondContact O-N 3.15Å; A94-T98 PolarHBondContact O-N 3.11Å; A94-T98 PolarHBondContact O-OG1 3.02Å
95I78.9Confident87Confident118 Ų11841.7 Ų41.761%0.60523%0.228SC*.Hα-helixtrans-59.3-24.6176.1-157173000113.3P93 P99 L140P93-I95 HydrophobicContact CB-CG2 4.09Å; P93-I95 HydrophobicContact CG-CG2 4.1Å; P93-I95 PolarHBondContact O-N 3.09Å; P93-I95 VanDerWaalsContact O-N 3.16Å; I95-P99 VanDerWaalsContact O-CD 3.29Å; I95-P99 WeakPolarHBondContact O-CD 3.42Å; I95-P99 VanDerWaalsContact O-CG 3.26Å; I95-P99 WeakPolarHBondContact O-CG 3.32Å; I95-L140 HydrophobicContact CB-CD2 4.47Å; I95-L140 HydrophobicContact CD1-CD2 4.17Å; I95-L140 HydrophobicContact CG1-CD2 3.33Å
96L83.2Confident86.8Confident46 Ų4643.8 Ų43.824%0.24124%0.239CC..Hα-helixtrans-91.5-47.6175.2-17585.1000111.2F23 L27 A92 P93 A94 P99 L100F23-L96 HydrophobicContact CE2-CD2 3.75Å; F23-L96 HydrophobicContact CZ-CD1 4.22Å; F23-L96 HydrophobicContact CZ-CD2 3.79Å; L27-L96 HydrophobicContact CB-CD2 4.33Å; L27-L96 HydrophobicContact CD1-CD2 4.18Å; A92-L96 HydrophobicContact CB-CD2 3.93Å; P93-L96 HydrophobicContact CG-CB 4.16Å; P93-L96 WeakPolarHBondContact O-CB 3.23Å; P93-L96 PolarHBondContact O-N 2.62Å; A94-L96 PolarHBondContact O-N 2.95Å; A94-L96 VanDerWaalsContact O-N 3.15Å; L96-P99 WeakPolarHBondContact O-CD 3.19Å; L96-L100 HydrophobicContact CG-CD1 4.18Å; L96-L100 WeakPolarHBondContact O-CG 3.21Å
97V86.5Confident87Confident0 Ų038.9 Ų38.90%022%0.22CC..Hα-helixtrans-68.1-41.6-170.6178.80000111.4A30 N85 A88 Y89 A92 P93 A94 L100 G101A30-V97 HydrophobicContact CB-CG1 4.26Å; N85-V97 WeakPolarHBondContact OD1-CG1 3.43Å; A88-V97 HydrophobicContact CB-CG1 4.12Å; A88-V97 HydrophobicContact CB-CG2 4.2Å; Y89-V97 HydrophobicContact CD1-CB 3.97Å; Y89-V97 HydrophobicContact CD1-CG1 4.08Å; Y89-V97 HydrophobicContact CD1-CG2 4.31Å; Y89-V97 HydrophobicContact CD2-CG1 4.14Å; Y89-V97 HydrophobicContact CE1-CB 3.67Å; Y89-V97 HydrophobicContact CE1-CG1 3.76Å; Y89-V97 HydrophobicContact CE1-CG2 4.5Å; Y89-V97 HydrophobicContact CE2-CG1 3.83Å; Y89-V97 HydrophobicContact CG-CG1 4.25Å; A92-V97 HydrophobicContact CB-CG2 3.65Å; P93-V97 PolarHBondContact O-N 2.87Å; A94-V97 PolarHBondContact O-N 3.15Å; V97-L100 WeakPolarHBondContact O-CB 3.41Å; V97-L100 PolarHBondContact O-N 3.09Å; V97-G101 PolarHBondContact O-N 2.84Å
98T83.8Confident87.1Confident30 Ų3037.2 Ų37.218%0.18421%0.209CC..Hα-helixtrans-68.8-43-173.6-43.60000113.8Y89 A94 L100 G101 A102 V139Y89-T98 PolarHBondContact OH-OG1 3.2Å; A94-T98 PolarHBondContact O-N 3.11Å; A94-T98 PolarHBondContact O-OG1 3.02Å; T98-L100 VanDerWaalsContact C-N 3.25Å; T98-L100 PolarHBondContact O-N 3.31Å; T98-G101 WeakPolarHBondContact O-CA 3.19Å; T98-G101 PolarHBondContact O-N 3.46Å; T98-A102 PolarHBondContact O-N 2.92Å; T98-V139 HydrophobicContact CG2-CB 4.23Å; T98-V139 HydrophobicContact CG2-CG1 3.29Å; T98-V139 HydrophobicContact CG2-CG2 3.97Å
99P81Confident86.9Confident33 Ų3337.5 Ų37.521%0.21421%0.212CC..Hα-helixtrans-59-34.3171.1-23.331.4000113.6I95 L96 G101 A102 T136 L140I95-P99 VanDerWaalsContact O-CD 3.29Å; I95-P99 WeakPolarHBondContact O-CD 3.42Å; I95-P99 VanDerWaalsContact O-CG 3.26Å; I95-P99 WeakPolarHBondContact O-CG 3.32Å; L96-P99 WeakPolarHBondContact O-CD 3.19Å; P99-G101 VanDerWaalsContact C-N 3.3Å; P99-G101 PolarHBondContact O-N 2.92Å; P99-A102 VanDerWaalsContact O-CB 3.24Å; P99-A102 WeakPolarHBondContact O-CB 3.33Å; P99-A102 PolarHBondContact O-N 3.22Å; P99-A102 VanDerWaalsContact O-N 3.16Å; P99-T136 HydrophobicContact CB-CG2 3.74Å; P99-T136 HydrophobicContact CG-CG2 3.81Å; P99-L140 HydrophobicContact CG-CD2 4.23Å
100L84.7Confident87Confident24 Ų2438.8 Ų38.813%0.12622%0.224CC..Hα-helixtrans-67.6-31.7175.2-66.3172.2000111.8L27 A30 L31 T34 L96 V97 T98 A102 L103L27-L100 HydrophobicContact CD1-CD1 3.59Å; A30-L100 HydrophobicContact CB-CB 4.23Å; A30-L100 HydrophobicContact CB-CD1 3.62Å; L31-L100 HydrophobicContact CD2-CD2 3.91Å; T34-L100 WeakPolarHBondContact CG2-O 3.33Å; T34-L100 PolarHBondContact OG1-O 3.36Å; L96-L100 HydrophobicContact CG-CD1 4.18Å; L96-L100 WeakPolarHBondContact O-CG 3.21Å; V97-L100 WeakPolarHBondContact O-CB 3.41Å; V97-L100 PolarHBondContact O-N 3.09Å; T98-L100 VanDerWaalsContact C-N 3.25Å; T98-L100 PolarHBondContact O-N 3.31Å; L100-A102 VanDerWaalsContact C-N 3.27Å; L100-A102 PolarHBondContact O-N 3.4Å; L100-L103 HydrophobicContact CD2-CD1 3.57Å; L100-L103 VanDerWaalsContact O-CB 3.31Å; L100-L103 WeakPolarHBondContact O-CB 3.21Å; L100-L103 PolarHBondContact O-N 3.49Å; L100-L103 VanDerWaalsContact O-N 3.13Å
101G84.6Confident87.3Confident12 Ų1236.9 Ų36.912%0.12421%0.211CC..Hα-helixtrans-56.6-40.8169.200000112.3V97 T98 P99 L103 S104V97-G101 PolarHBondContact O-N 2.84Å; T98-G101 WeakPolarHBondContact O-CA 3.19Å; T98-G101 PolarHBondContact O-N 3.46Å; P99-G101 VanDerWaalsContact C-N 3.3Å; P99-G101 PolarHBondContact O-N 2.92Å; G101-L103 PolarHBondContact O-N 3.08Å; G101-S104 VanDerWaalsContact O-CB 3.26Å; G101-S104 WeakPolarHBondContact O-CB 3.4Å; G101-S104 PolarHBondContact O-N 3.38Å; G101-S104 PolarHBondContact O-OG 2.91Å
102A87.2Confident87.5Confident0 Ų033.8 Ų33.80%020%0.197CC..Hα-helixtrans-61.9-29.8177.100000113.2T98 P99 L100 S104 V105 I132 Y267T98-A102 PolarHBondContact O-N 2.92Å; P99-A102 VanDerWaalsContact O-CB 3.24Å; P99-A102 WeakPolarHBondContact O-CB 3.33Å; P99-A102 PolarHBondContact O-N 3.22Å; P99-A102 VanDerWaalsContact O-N 3.16Å; L100-A102 VanDerWaalsContact C-N 3.27Å; L100-A102 PolarHBondContact O-N 3.4Å; A102-S104 PolarHBondContact O-N 3.41Å; A102-S104 VanDerWaalsContact O-N 3.15Å; A102-V105 VanDerWaalsContact O-CB 3.3Å; A102-V105 WeakPolarHBondContact O-CB 3.49Å; A102-V105 WeakPolarHBondContact O-CG2 3.12Å; A102-V105 PolarHBondContact O-N 2.92Å; A102-I132 HydrophobicContact CB-CG2 3.78Å; A102-Y267 VanDerWaalsContact CA-CZ 3.48Å; A102-Y267 WeakPolarHBondContact CA-OH 3.41Å; A102-Y267 HydrophobicContact CB-CE1 3.62Å; A102-Y267 HydrophobicContact CB-CE2 4.32Å; A102-Y267 VanDerWaalsContact CB-CZ 3.47Å; A102-Y267 WeakPolarHBondContact CB-OH 3.28Å
103L89.3Confident87.6Confident64 Ų6436.9 Ų36.934%0.33522%0.216SC..Hα-helixtrans-63.3-18.8176.1-62.6176.8000112.5T34 L100 G101 V105 L106 V107T34-L103 HydrophobicContact CG2-CB 3.49Å; T34-L103 VanDerWaalsContact CG2-CB 3.49Å; L100-L103 HydrophobicContact CD2-CD1 3.57Å; L100-L103 VanDerWaalsContact O-CB 3.31Å; L100-L103 WeakPolarHBondContact O-CB 3.21Å; L100-L103 PolarHBondContact O-N 3.49Å; L100-L103 VanDerWaalsContact O-N 3.13Å; G101-L103 PolarHBondContact O-N 3.08Å; L103-V105 PolarHBondContact O-N 3.37Å; L103-L106 WeakPolarHBondContact O-CB 3.49Å; L103-L106 PolarHBondContact O-N 2.98Å; L103-V107 WeakPolarHBondContact O-CG2 3.18Å; L103-V107 PolarHBondContact O-N 3.24Å
104S93Very high88Confident10 Ų1042.5 Ų42.57%0.0723%0.23CC..Hα-helixtrans-65.4-30.9178.967.10000110.8T34 G38 G101 A102 V107 S108T34-S104 WeakPolarHBondContact O-CB 3.48Å; G38-S104 WeakPolarHBondContact CA-O 3.13Å; G101-S104 VanDerWaalsContact O-CB 3.26Å; G101-S104 WeakPolarHBondContact O-CB 3.4Å; G101-S104 PolarHBondContact O-N 3.38Å; G101-S104 PolarHBondContact O-OG 2.91Å; A102-S104 PolarHBondContact O-N 3.41Å; A102-S104 VanDerWaalsContact O-N 3.15Å; S104-V107 PolarHBondContact O-N 2.92Å; S104-S108 WeakPolarHBondContact O-CB 3.45Å; S104-S108 PolarHBondContact O-N 2.86Å; S104-S108 PolarHBondContact O-OG 3.17Å
105V92Very high88.6Confident5 Ų545.6 Ų45.63%0.0323%0.233CC..Hα-helixtrans-61.9-48.2171.5-177.60000109.8A102 L103 V107 S108 A109 I132 P264 Y267A102-V105 VanDerWaalsContact O-CB 3.3Å; A102-V105 WeakPolarHBondContact O-CB 3.49Å; A102-V105 WeakPolarHBondContact O-CG2 3.12Å; A102-V105 PolarHBondContact O-N 2.92Å; L103-V105 PolarHBondContact O-N 3.37Å; V105-V107 PolarHBondContact O-N 3.15Å; V105-S108 PolarHBondContact O-N 3.25Å; V105-S108 PolarHBondContact O-OG 3.2Å; V105-A109 WeakPolarHBondContact O-CB 3.43Å; V105-A109 PolarHBondContact O-N 2.97Å; V105-I132 HydrophobicContact CB-CD1 4.05Å; V105-I132 HydrophobicContact CB-CG1 4.41Å; V105-I132 HydrophobicContact CG1-CD1 4.14Å; V105-I132 HydrophobicContact CG1-CG1 4.48Å; V105-P264 HydrophobicContact CG1-CB 3.92Å; V105-P264 HydrophobicContact CG1-CG 3.63Å; V105-Y267 VanDerWaalsContact CG2-CB 3.47Å; V105-Y267 HydrophobicContact CG2-CD1 4.03Å; V105-Y267 HydrophobicContact CG2-CD2 3.89Å; V105-Y267 HydrophobicContact CG2-CG 3.52Å
106L88.6Confident89.2Confident66 Ų6640.1 Ų40.135%0.34621%0.205SC..Hα-helixtrans-63.3-43.8178.1-17565.5000111.5L103 S108 A109 L110 I132L103-L106 WeakPolarHBondContact O-CB 3.49Å; L103-L106 PolarHBondContact O-N 2.98Å; L106-S108 VanDerWaalsContact C-N 3.34Å; L106-S108 PolarHBondContact O-N 2.87Å; L106-A109 PolarHBondContact O-N 3.29Å; L106-L110 HydrophobicContact CD1-CD1 4.46Å; L106-L110 HydrophobicContact CD1-CG 4.38Å; L106-L110 HydrophobicContact CG-CD1 4.07Å; L106-L110 HydrophobicContact CG-CG 4.4Å; L106-L110 WeakPolarHBondContact O-CG 3.22Å; L106-L110 PolarHBondContact O-N 3.01Å; L106-I132 HydrophobicContact CB-CD1 4.39Å
107V92.6Very high89.4Confident28 Ų2844 Ų4417%0.1723%0.226CC..Hα-helixtrans-57.4-48.1174.8172.60000110.4T34 L35 L103 S104 V105 A109 L110 L111T34-V107 HydrophobicContact CG2-CG2 4.11Å; L35-V107 HydrophobicContact CD2-CG1 4.23Å; L35-V107 HydrophobicContact CD2-CG2 4.17Å; L103-V107 WeakPolarHBondContact O-CG2 3.18Å; L103-V107 PolarHBondContact O-N 3.24Å; S104-V107 PolarHBondContact O-N 2.92Å; V105-V107 PolarHBondContact O-N 3.15Å; V107-A109 VanDerWaalsContact C-N 3.32Å; V107-A109 PolarHBondContact O-N 2.78Å; V107-L110 PolarHBondContact O-N 3.03Å; V107-L111 HydrophobicContact CG1-CD1 3.65Å; V107-L111 HydrophobicContact CG1-CG 4.22Å; V107-L111 WeakPolarHBondContact O-CB 3.27Å; V107-L111 VanDerWaalsContact O-CG 3.23Å; V107-L111 WeakPolarHBondContact O-CG 3.36Å; V107-L111 PolarHBondContact O-N 3.34Å
108S93.1Very high89.6Confident0 Ų044.7 Ų44.70%023%0.229CC..Hα-helixtrans-62.8-37.117873.70000113G38 I42 S104 V105 L106 S112 T263G38-S108 WeakPolarHBondContact O-CB 3.44Å; I42-S108 WeakPolarHBondContact CD1-O 2.97Å; S104-S108 WeakPolarHBondContact O-CB 3.45Å; S104-S108 PolarHBondContact O-N 2.86Å; S104-S108 PolarHBondContact O-OG 3.17Å; V105-S108 PolarHBondContact O-N 3.25Å; V105-S108 PolarHBondContact O-OG 3.2Å; L106-S108 VanDerWaalsContact C-N 3.34Å; L106-S108 PolarHBondContact O-N 2.87Å; S108-S112 VanDerWaalsContact O-CB 3.3Å; S108-S112 WeakPolarHBondContact O-CB 3.31Å; S108-S112 PolarHBondContact O-N 3.19Å; S108-S112 PolarHBondContact O-OG 3.31Å; S108-T263 VanDerWaalsContact OG-CB 3.25Å; S108-T263 WeakPolarHBondContact OG-CB 3.34Å; S108-T263 WeakPolarHBondContact OG-CG2 3.19Å; S108-T263 PolarHBondContact OG-OG1 3.29Å
109A89.2Confident89.5Confident7 Ų751.3 Ų51.36%0.05826%0.258CS..Hα-helixtrans-69.5-41.5177.900000111.9V105 L106 V107 S112 V113 L120V105-A109 WeakPolarHBondContact O-CB 3.43Å; V105-A109 PolarHBondContact O-N 2.97Å; L106-A109 PolarHBondContact O-N 3.29Å; V107-A109 VanDerWaalsContact C-N 3.32Å; V107-A109 PolarHBondContact O-N 2.78Å; A109-S112 PolarHBondContact O-N 3.23Å; A109-S112 PolarHBondContact O-OG 3.29Å; A109-V113 WeakPolarHBondContact O-CG2 3.35Å; A109-V113 PolarHBondContact O-N 3.09Å; A109-L120 HydrophobicContact CB-CD1 3.88Å
110L89.9Confident89.1Confident113 Ų11351.9 Ų51.959%0.59226%0.259SS*.Hα-helixtrans-67.9-44.5176.8-69.4173.7000111.6L106 V107 S112 V113 R114L106-L110 HydrophobicContact CD1-CD1 4.46Å; L106-L110 HydrophobicContact CD1-CG 4.38Å; L106-L110 HydrophobicContact CG-CD1 4.07Å; L106-L110 HydrophobicContact CG-CG 4.4Å; L106-L110 WeakPolarHBondContact O-CG 3.22Å; L106-L110 PolarHBondContact O-N 3.01Å; V107-L110 PolarHBondContact O-N 3.03Å; L110-S112 VanDerWaalsContact C-N 3.29Å; L110-S112 PolarHBondContact O-N 2.81Å; L110-V113 PolarHBondContact O-N 2.85Å; L110-R114 PolarHBondContact O-N 3.27Å
111L93.6Very high88.7Confident39 Ų3953.1 Ų53.120%0.20427%0.265CS..Hα-helixtrans-67.9-29.8178.4-66.1175.3000111.9T39 I42 V107 R114 F115T39-L111 HydrophobicContact CG2-CD1 4.43Å; T39-L111 WeakPolarHBondContact OG1-CD1 3.49Å; I42-L111 HydrophobicContact CD1-CB 3.65Å; I42-L111 HydrophobicContact CG1-CB 3.59Å; I42-L111 HydrophobicContact CG1-CD1 4.1Å; V107-L111 HydrophobicContact CG1-CD1 3.65Å; V107-L111 HydrophobicContact CG1-CG 4.22Å; V107-L111 WeakPolarHBondContact O-CB 3.27Å; V107-L111 VanDerWaalsContact O-CG 3.23Å; V107-L111 WeakPolarHBondContact O-CG 3.36Å; V107-L111 PolarHBondContact O-N 3.34Å; L111-R114 PolarHBondContact O-N 2.98Å; L111-F115 HydrophobicContact CB-CD2 4.19Å; L111-F115 HydrophobicContact CD2-CD2 3.86Å; L111-F115 HydrophobicContact CD2-CE2 3.58Å; L111-F115 WeakPolarHBondContact O-CB 3.48Å; L111-F115 PolarHBondContact O-N 3.11Å
112S93.5Very high88.5Confident0 Ų055.4 Ų55.40%028%0.279CS..Hα-helixtrans-68.8-36.8177.172.90000112.6S108 A109 L110 R114 L116 N117 E118S108-S112 VanDerWaalsContact O-CB 3.3Å; S108-S112 WeakPolarHBondContact O-CB 3.31Å; S108-S112 PolarHBondContact O-N 3.19Å; S108-S112 PolarHBondContact O-OG 3.31Å; A109-S112 PolarHBondContact O-N 3.23Å; A109-S112 PolarHBondContact O-OG 3.29Å; L110-S112 VanDerWaalsContact C-N 3.29Å; L110-S112 PolarHBondContact O-N 2.81Å; S112-R114 VanDerWaalsContact C-N 3.3Å; S112-R114 PolarHBondContact O-N 3.31Å; S112-L116 CarbonylContact O-C 3.6Å; S112-L116 WeakPolarHBondContact O-CA 3.43Å; S112-L116 VanDerWaalsContact O-CB 3.24Å; S112-L116 WeakPolarHBondContact O-CB 3.06Å; S112-L116 PolarHBondContact O-N 3.15Å; S112-N117 PolarHBondContact O-N 2.96Å; S112-E118 PolarHBondContact O-N 3.08Å
113V90.1Very high88.3Confident67 Ų6756.8 Ų56.841%0.40629%0.286SS..Hα-helixtrans-60.7-43.7170.8178.40000110.5A109 L110 N117 E118 L120A109-V113 WeakPolarHBondContact O-CG2 3.35Å; A109-V113 PolarHBondContact O-N 3.09Å; L110-V113 PolarHBondContact O-N 2.85Å; V113-N117 WeakPolarHBondContact O-CA 3.49Å; V113-E118 WeakPolarHBondContact CA-O 3.22Å; V113-E118 WeakPolarHBondContact CG2-O 3.44Å; V113-L120 HydrophobicContact CG2-CB 4.39Å; V113-L120 HydrophobicContact CG2-CD1 4.1Å
114R91.5Very high87.9Confident175 Ų17554 Ų5466%0.6627%0.273SS*.Hα-helixtrans-78.2-43.6-173.4-176.761.7-174.998.4-5.4115L110 L111 S112L110-R114 PolarHBondContact O-N 3.27Å; L111-R114 PolarHBondContact O-N 2.98Å; S112-R114 VanDerWaalsContact C-N 3.3Å; S112-R114 PolarHBondContact O-N 3.31Å
115F93.3Very high87.5Confident121 Ų12155 Ų5553%0.53128%0.284SS..Hα-helixtrans-102.5-26.6-170.6-73.3-82.3000113.2I42 L111I42-F115 HydrophobicContact CG2-CB 3.79Å; I42-F115 HydrophobicContact CG2-CG 4.4Å; L111-F115 HydrophobicContact CB-CD2 4.19Å; L111-F115 HydrophobicContact CD2-CD2 3.86Å; L111-F115 HydrophobicContact CD2-CE2 3.58Å; L111-F115 WeakPolarHBondContact O-CB 3.48Å; L111-F115 PolarHBondContact O-N 3.11Å
116L91.8Very high87.3Confident3 Ų360.6 Ų60.62%0.01631%0.308CS..SBendtrans-103.8-3179.2-71.1146.1000112.4I42 K45 L46 R49 S112 E118I42-L116 HydrophobicContact CB-CD1 4.49Å; I42-L116 HydrophobicContact CD1-CD1 3.74Å; I42-L116 HydrophobicContact CG2-CD1 4Å; I42-L116 HydrophobicContact CG2-CG 4.42Å; K45-L116 HydrophobicContact CB-CD1 3.99Å; K45-L116 HydrophobicContact CB-CD2 3.99Å; K45-L116 HydrophobicContact CG-CD1 3.81Å; K45-L116 HydrophobicContact CG-CD2 3.38Å; K45-L116 HydrophobicContact CG-CG 4.25Å; L46-L116 HydrophobicContact CD2-CD2 3.89Å; L46-L116 HydrophobicContact CD2-CG 4.4Å; L46-L116 HydrophobicContact CG-CD2 4.1Å; R49-L116 PolarHBondContact NH1-O 3.4Å; R49-L116 PolarHBondContact NH2-O 3.06Å; S112-L116 CarbonylContact O-C 3.6Å; S112-L116 WeakPolarHBondContact O-CA 3.43Å; S112-L116 VanDerWaalsContact O-CB 3.24Å; S112-L116 WeakPolarHBondContact O-CB 3.06Å; S112-L116 PolarHBondContact O-N 3.15Å; L116-E118 HydrophobicContact CB-CG 3.89Å; L116-E118 PolarHBondContact O-N 3.18Å
117N89Confident87.3Confident127 Ų12757.5 Ų57.568%0.67929%0.292SS*.  trans48.837.6-173.1-64.1-37.5000111.6S112 V113S112-N117 PolarHBondContact O-N 2.96Å; V113-N117 WeakPolarHBondContact O-CA 3.49Å
118E89.2Confident87.1Confident15 Ų1556.3 Ų56.37%0.0729%0.285CS..  trans-84.8136.4175.6-70.5-178.7168.100109.7K45 R49 S112 V113 L116 T259K45-E118 WeakPolarHBondContact CE-OE1 3.31Å; K45-E118 IonicContact NZ-OE1 3.4Å; R49-E118 IonicContact CZ-OE1 3.65Å; R49-E118 IonicContact NH2-OE1 3.05Å; R49-E118 PolarHBondContact NH2-OE1 3.32Å; S112-E118 PolarHBondContact O-N 3.08Å; V113-E118 WeakPolarHBondContact CA-O 3.22Å; V113-E118 WeakPolarHBondContact CG2-O 3.44Å; L116-E118 HydrophobicContact CB-CG 3.89Å; L116-E118 PolarHBondContact O-N 3.18Å; E118-T259 WeakPolarHBondContact OE2-CA 3.45Å; E118-T259 WeakPolarHBondContact OE2-CB 3.45Å; E118-T259 PolarHBondContact OE2-N 2.9Å; E118-T259 PolarHBondContact OE2-OG1 3.05Å
119H81.3Confident87Confident168 Ų16859.6 Ų59.678%0.77831%0.307SS*.  trans-91.5123.4175.2-68.1-78.4000109.9
120L73.4Confident87.1Confident46 Ų4660 Ų6024%0.24131%0.309CS..  trans-100.3109.2166.4-97.8149.9000107.5A109 V113A109-L120 HydrophobicContact CB-CD1 3.88Å; V113-L120 HydrophobicContact CG2-CB 4.39Å; V113-L120 HydrophobicContact CG2-CD1 4.1Å
121N77Confident87.1Confident49 Ų4954.7 Ų54.726%0.26228%0.281SS..  trans-58146.7171.5-81.4-8.4000109.6I123 G124 G125 K314 N317N121-I123 PolarHBondContact O-N 3.34Å; N121-I123 VanDerWaalsContact O-N 3.11Å; N121-G124 WeakPolarHBondContact O-CA 3.06Å; N121-G124 PolarHBondContact O-N 3.28Å; N121-G125 PolarHBondContact O-N 2.94Å; N121-K314 PolarHBondContact ND2-O 2.96Å; N121-N317 PolarHBondContact ND2-OD1 2.73Å
122C79.8Confident86.9Confident60 Ų6054 Ų5441%0.40528%0.277SS..Hα-helixtrans-56.7-33.7-175.4-67.80000112.5G125 F126 W320C122-G125 PolarHBondContact O-N 3.12Å; C122-F126 WeakPolarHBondContact O-CB 3.39Å; C122-F126 PolarHBondContact O-N 2.63Å; C122-W320 VanDerWaalsContact SG-CD1 3.57Å
123I83.6Confident86.8Confident30 Ų3058.3 Ų58.315%0.15430%0.3CS..Hα-helixtrans-65.3-43.4174.2-59.2173.8000111.2N121 F126 G127 M309 L313 F318N121-I123 PolarHBondContact O-N 3.34Å; N121-I123 VanDerWaalsContact O-N 3.11Å; I123-F126 PolarHBondContact O-N 3.17Å; I123-G127 PolarHBondContact O-N 3.47Å; I123-M309 HydrophobicContact CG2-CB 4.31Å; I123-M309 HydrophobicContact CG2-CE 3.74Å; I123-L313 HydrophobicContact CG2-CB 3.52Å; I123-L313 HydrophobicContact CG2-CD1 3.87Å; I123-L313 HydrophobicContact CG2-CG 4.36Å; I123-F318 HydrophobicContact CD1-CB 3.64Å; I123-F318 HydrophobicContact CG1-CB 4.13Å
124G81Confident86.9Confident6 Ų655.1 Ų55.16%0.06228%0.28CS..Hα-helixtrans-63.8-40.4175.600000112.3N121 G127 C128N121-G124 WeakPolarHBondContact O-CA 3.06Å; N121-G124 PolarHBondContact O-N 3.28Å; G124-G127 PolarHBondContact O-N 3.36Å; G124-C128 WeakPolarHBondContact O-CB 3.09Å; G124-C128 PolarHBondContact O-N 2.86Å
125G83.5Confident86.8Confident29 Ų2946.9 Ų46.930%0.29925%0.25SC..Hα-helixtrans-62.2-44.9173.100000112.7N121 C122 C128 C129N121-G125 PolarHBondContact O-N 2.94Å; C122-G125 PolarHBondContact O-N 3.12Å; G125-C128 WeakPolarHBondContact O-CB 3.37Å; G125-C128 PolarHBondContact O-N 3.42Å; G125-C129 PolarHBondContact O-N 3.1Å; G125-C129 VanDerWaalsContact O-N 3.13Å; G125-C129 PolarHBondContact O-SG 2.94Å
126F88.2Confident86.6Confident124 Ų12442.2 Ų42.254%0.54423%0.231SC..Hα-helixtrans-65.1-43.7175.2-175.2-92.1000111.7C122 I123 C128 C129 V130 M309C122-F126 WeakPolarHBondContact O-CB 3.39Å; C122-F126 PolarHBondContact O-N 2.63Å; I123-F126 PolarHBondContact O-N 3.17Å; F126-C128 VanDerWaalsContact C-N 3.26Å; F126-C128 PolarHBondContact O-N 2.64Å; F126-C129 WeakPolarHBondContact O-CB 3.43Å; F126-C129 PolarHBondContact O-N 3.4Å; F126-V130 HydrophobicContact CD1-CG2 3.68Å; F126-V130 HydrophobicContact CE1-CG2 3.38Å; F126-V130 HydrophobicContact CG-CG2 4.47Å; F126-V130 HydrophobicContact CZ-CG2 3.89Å; F126-V130 WeakPolarHBondContact O-CG2 3.44Å; F126-V130 PolarHBondContact O-N 3.43Å; F126-M309 HydrophobicContact CB-CE 4.5Å; F126-M309 HydrophobicContact CD1-CE 3.36Å; F126-M309 HydrophobicContact CD1-SD 3.77Å; F126-M309 HydrophobicContact CE1-CE 3.98Å; F126-M309 HydrophobicContact CE1-SD 4.08Å; F126-M309 HydrophobicContact CG-CE 4.35Å
127G89.1Confident86.5Confident0 Ų044.3 Ų44.30%024%0.242CC..Hα-helixtrans-56.8-40.1174.400000112.4I123 G124 V130 C131 G306I123-G127 PolarHBondContact O-N 3.47Å; G124-G127 PolarHBondContact O-N 3.36Å; G127-V130 PolarHBondContact O-N 3.18Å; G127-C131 WeakPolarHBondContact O-CB 3.39Å; G127-C131 PolarHBondContact O-N 3.41Å; G127-G306 WeakPolarHBondContact O-CA 3.46Å
128C88.3Confident86.5Confident4 Ų439.4 Ų39.43%0.02722%0.216CC..Hα-helixtrans-59.6-47172.5-178.90000111.9G124 G125 F126 V130 C131 I132 P264 I310G124-C128 WeakPolarHBondContact O-CB 3.09Å; G124-C128 PolarHBondContact O-N 2.86Å; G125-C128 WeakPolarHBondContact O-CB 3.37Å; G125-C128 PolarHBondContact O-N 3.42Å; F126-C128 VanDerWaalsContact C-N 3.26Å; F126-C128 PolarHBondContact O-N 2.64Å; C128-V130 VanDerWaalsContact C-N 3.34Å; C128-V130 PolarHBondContact O-N 3.35Å; C128-C131 WeakPolarHBondContact O-CB 3.43Å; C128-C131 PolarHBondContact O-N 3.07Å; C128-I132 WeakPolarHBondContact O-CG1 3.24Å; C128-I132 PolarHBondContact O-N 2.85Å; C128-P264 HydrophobicContact CB-CB 4.5Å; C128-P264 HydrophobicContact CB-CG 4.08Å; C128-P264 VanDerWaalsContact SG-CG 3.52Å; C128-I310 HydrophobicContact CB-CD1 4.31Å
129C90.2Very high86.4Confident68 Ų6840 Ų4046%0.45922%0.22SC..Hα-helixtrans-61.2-42.6176.8-65.70000112G125 F126 I132 L133G125-C129 PolarHBondContact O-N 3.1Å; G125-C129 VanDerWaalsContact O-N 3.13Å; G125-C129 PolarHBondContact O-SG 2.94Å; F126-C129 WeakPolarHBondContact O-CB 3.43Å; F126-C129 PolarHBondContact O-N 3.4Å; C129-I132 PolarHBondContact O-N 3.18Å; C129-L133 WeakPolarHBondContact O-CB 3.4Å; C129-L133 PolarHBondContact O-N 3.42Å
130V92.5Very high86.6Confident16 Ų1635.2 Ų35.210%0.09720%0.2CC..Hα-helixtrans-63.8-42.2176.9177.10000110.8F126 G127 C128 L133 G134 F302 L305F126-V130 HydrophobicContact CD1-CG2 3.68Å; F126-V130 HydrophobicContact CE1-CG2 3.38Å; F126-V130 HydrophobicContact CG-CG2 4.47Å; F126-V130 HydrophobicContact CZ-CG2 3.89Å; F126-V130 WeakPolarHBondContact O-CG2 3.44Å; F126-V130 PolarHBondContact O-N 3.43Å; G127-V130 PolarHBondContact O-N 3.18Å; C128-V130 VanDerWaalsContact C-N 3.34Å; C128-V130 PolarHBondContact O-N 3.35Å; V130-L133 PolarHBondContact O-N 2.66Å; V130-G134 PolarHBondContact O-N 3.36Å; V130-F302 HydrophobicContact CG1-CB 4.34Å; V130-F302 HydrophobicContact CG1-CD1 3.8Å; V130-F302 VanDerWaalsContact CG1-O 3.25Å; V130-F302 WeakPolarHBondContact CG1-O 3.4Å; V130-L305 HydrophobicContact CG1-CB 4.31Å
131C90.1Very high87.3Confident1 Ų135.2 Ų35.21%0.00720%0.199CC..Hα-helixtrans-60.6-46.3173.4-86.20000112.4G127 C128 L133 G134 S135 V268 G306 I307 I310G127-C131 WeakPolarHBondContact O-CB 3.39Å; G127-C131 PolarHBondContact O-N 3.41Å; C128-C131 WeakPolarHBondContact O-CB 3.43Å; C128-C131 PolarHBondContact O-N 3.07Å; C131-L133 VanDerWaalsContact C-N 3.35Å; C131-G134 PolarHBondContact O-N 3.29Å; C131-S135 WeakPolarHBondContact O-CB 3.32Å; C131-S135 PolarHBondContact O-N 3.46Å; C131-S135 PolarHBondContact O-OG 3.47Å; C131-V268 HydrophobicContact CB-CG2 3.79Å; C131-G306 WeakPolarHBondContact SG-CA 3.37Å; C131-I307 PolarHBondContact SG-N 2.92Å; C131-I310 HydrophobicContact CB-CD1 4.43Å
132I89Confident87.7Confident24 Ų2434.1 Ų34.112%0.12320%0.197CC..Hα-helixtrans-62.6-43.7178.4-71.7168.2000110.3A102 V105 L106 C128 C129 S135 T136A102-I132 HydrophobicContact CB-CG2 3.78Å; V105-I132 HydrophobicContact CB-CD1 4.05Å; V105-I132 HydrophobicContact CB-CG1 4.41Å; V105-I132 HydrophobicContact CG1-CD1 4.14Å; V105-I132 HydrophobicContact CG1-CG1 4.48Å; L106-I132 HydrophobicContact CB-CD1 4.39Å; C128-I132 WeakPolarHBondContact O-CG1 3.24Å; C128-I132 PolarHBondContact O-N 2.85Å; C129-I132 PolarHBondContact O-N 3.18Å; I132-S135 WeakPolarHBondContact CA-OG 3.49Å; I132-S135 PolarHBondContact O-OG 2.79Å; I132-T136 VanDerWaalsContact O-CB 3.26Å; I132-T136 WeakPolarHBondContact O-CB 3.33Å; I132-T136 PolarHBondContact O-N 2.95Å; I132-T136 PolarHBondContact O-OG1 3.49Å
133L92.1Very high87.6Confident91 Ų9132 Ų3248%0.47618%0.182SC..Hα-helixtrans-61.1-51.2176.5-171.691.2000111C129 V130 C131 T136 L137 F302C129-L133 WeakPolarHBondContact O-CB 3.4Å; C129-L133 PolarHBondContact O-N 3.42Å; V130-L133 PolarHBondContact O-N 2.66Å; C131-L133 VanDerWaalsContact C-N 3.35Å; L133-T136 PolarHBondContact O-N 2.82Å; L133-L137 WeakPolarHBondContact O-CG 3.36Å; L133-L137 PolarHBondContact O-N 2.96Å; L133-F302 HydrophobicContact CD2-CD1 3.72Å; L133-F302 HydrophobicContact CD2-CE1 3.7Å; L133-F302 HydrophobicContact CD2-CG 4.26Å; L133-F302 HydrophobicContact CD2-CZ 4.23Å
134G92Very high87.1Confident0 Ų039 Ų390%021%0.212CC..Hα-helixtrans-60-49.3-179.600000112.2V130 C131 T136 L137 I138 G299 F302V130-G134 PolarHBondContact O-N 3.36Å; C131-G134 PolarHBondContact O-N 3.29Å; G134-T136 VanDerWaalsContact C-N 3.31Å; G134-T136 PolarHBondContact O-N 2.92Å; G134-L137 WeakPolarHBondContact O-CB 3.25Å; G134-L137 PolarHBondContact O-N 3.38Å; G134-L137 VanDerWaalsContact O-N 3.11Å; G134-I138 WeakPolarHBondContact O-CG1 3.31Å; G134-I138 PolarHBondContact O-N 3.26Å; G134-G299 CarbonylContact C-O 3.37Å; G134-G299 WeakPolarHBondContact CA-O 3.48Å; G134-G299 VanDerWaalsContact O-CA 3.28Å; G134-G299 WeakPolarHBondContact O-CA 3.45Å; G134-F302 VanDerWaalsContact CA-CB 3.42Å
135S88.3Confident86.6Confident2 Ų243 Ų431%0.01423%0.229CC..Hα-helixtrans-63.6-36.8178.750.70000112.3C131 I132 I138 V139 Y267C131-S135 WeakPolarHBondContact O-CB 3.32Å; C131-S135 PolarHBondContact O-N 3.46Å; C131-S135 PolarHBondContact O-OG 3.47Å; I132-S135 WeakPolarHBondContact CA-OG 3.49Å; I132-S135 PolarHBondContact O-OG 2.79Å; S135-I138 PolarHBondContact O-N 3.05Å; S135-V139 WeakPolarHBondContact O-CG2 3.2Å; S135-V139 PolarHBondContact O-N 2.82Å; S135-Y267 WeakPolarHBondContact OG-CE1 3.35Å
136T88.6Confident85.9Confident24 Ų2445.7 Ų45.715%0.14723%0.233CC..Hα-helixtrans-61.9-44.6172.2-58.30000110.9P99 I132 L133 G134 I138 V139 L140P99-T136 HydrophobicContact CB-CG2 3.74Å; P99-T136 HydrophobicContact CG-CG2 3.81Å; I132-T136 VanDerWaalsContact O-CB 3.26Å; I132-T136 WeakPolarHBondContact O-CB 3.33Å; I132-T136 PolarHBondContact O-N 2.95Å; I132-T136 PolarHBondContact O-OG1 3.49Å; L133-T136 PolarHBondContact O-N 2.82Å; G134-T136 VanDerWaalsContact C-N 3.31Å; G134-T136 PolarHBondContact O-N 2.92Å; T136-I138 VanDerWaalsContact C-N 3.34Å; T136-I138 PolarHBondContact O-N 3.45Å; T136-V139 PolarHBondContact O-N 2.85Å; T136-L140 HydrophobicContact CG2-CD1 3.89Å; T136-L140 HydrophobicContact CG2-CG 4.17Å; T136-L140 WeakPolarHBondContact O-CB 3.27Å; T136-L140 WeakPolarHBondContact O-CG 3.43Å; T136-L140 PolarHBondContact O-N 3.22Å
137L91Very high85Confident47 Ų4746.4 Ų46.425%0.24624%0.243CC..Hα-helixtrans-60.3-41.9174.9-73.6173.1000112.5L133 G134 L140 H141 F302L133-L137 WeakPolarHBondContact O-CG 3.36Å; L133-L137 PolarHBondContact O-N 2.96Å; G134-L137 WeakPolarHBondContact O-CB 3.25Å; G134-L137 PolarHBondContact O-N 3.38Å; G134-L137 VanDerWaalsContact O-N 3.11Å; L137-L140 PolarHBondContact O-N 2.91Å; L137-H141 PolarHBondContact O-N 3.49Å; L137-H141 PolarHBondContact O-ND1 3.24Å; L137-F302 HydrophobicContact CD1-CD2 4.25Å
138I89.3Confident84.4Confident23 Ų2346.6 Ų46.612%0.11824%0.244CC..Hα-helixtrans-60.9-47.8177.2-59.3173.8000109.8G134 S135 T136 L140 H141 A142 I275 L296 G299 T303G134-I138 WeakPolarHBondContact O-CG1 3.31Å; G134-I138 PolarHBondContact O-N 3.26Å; S135-I138 PolarHBondContact O-N 3.05Å; T136-I138 VanDerWaalsContact C-N 3.34Å; T136-I138 PolarHBondContact O-N 3.45Å; I138-L140 PolarHBondContact O-N 3.26Å; I138-H141 CarbonylContact O-C 3.59Å; I138-H141 PolarHBondContact O-N 3.4Å; I138-A142 WeakPolarHBondContact O-CB 3.44Å; I138-A142 PolarHBondContact O-N 3.03Å; I138-I275 HydrophobicContact CB-CD1 4.26Å; I138-I275 HydrophobicContact CG2-CD1 3.46Å; I138-I275 VanDerWaalsContact CG2-CD1 3.46Å; I138-L296 HydrophobicContact CB-CD2 4.38Å; I138-L296 HydrophobicContact CG2-CD2 3.65Å; I138-L296 WeakPolarHBondContact O-CD2 3.32Å; I138-G299 VanDerWaalsContact CG1-C 3.48Å; I138-T303 HydrophobicContact CD1-CG2 3.93Å
139V85.7Confident83.9Confident27 Ų2751 Ų5116%0.16427%0.271CS..Hα-helixtrans-60.9-44.2178.6166.40000112T98 S135 T136 H141 A142 T271 I275T98-V139 HydrophobicContact CG2-CB 4.23Å; T98-V139 HydrophobicContact CG2-CG1 3.29Å; T98-V139 HydrophobicContact CG2-CG2 3.97Å; S135-V139 WeakPolarHBondContact O-CG2 3.2Å; S135-V139 PolarHBondContact O-N 2.82Å; T136-V139 PolarHBondContact O-N 2.85Å; V139-H141 PolarHBondContact O-N 3.47Å; V139-A142 WeakPolarHBondContact O-CB 3.4Å; V139-A142 PolarHBondContact O-N 2.9Å; V139-T271 HydrophobicContact CG2-CG2 3.64Å; V139-I275 HydrophobicContact CG2-CD1 3.94Å
140L86.3Confident83.7Confident68 Ų6849.3 Ų49.336%0.35626%0.259SS..Hα-helixtrans-64.8-28.6-175.5-73.2174.9000112.9I95 P99 T136 L137 I138I95-L140 HydrophobicContact CB-CD2 4.47Å; I95-L140 HydrophobicContact CD1-CD2 4.17Å; I95-L140 HydrophobicContact CG1-CD2 3.33Å; P99-L140 HydrophobicContact CG-CD2 4.23Å; T136-L140 HydrophobicContact CG2-CD1 3.89Å; T136-L140 HydrophobicContact CG2-CG 4.17Å; T136-L140 WeakPolarHBondContact O-CB 3.27Å; T136-L140 WeakPolarHBondContact O-CG 3.43Å; T136-L140 PolarHBondContact O-N 3.22Å; L137-L140 PolarHBondContact O-N 2.91Å; I138-L140 PolarHBondContact O-N 3.26Å
141H88.5Confident83.6Confident47 Ų4749.1 Ų49.122%0.21826%0.258CS..THydrogen-bonded Turntrans-106.18.8178.9-59.390.5000112.4L137 I138 V139 D292 L296L137-H141 PolarHBondContact O-N 3.49Å; L137-H141 PolarHBondContact O-ND1 3.24Å; I138-H141 CarbonylContact O-C 3.59Å; I138-H141 PolarHBondContact O-N 3.4Å; V139-H141 PolarHBondContact O-N 3.47Å; H141-D292 HydrophobicContact CB-CB 4.19Å; H141-D292 WeakPolarHBondContact CB-O 3.35Å; H141-D292 IonicContact CD2-OD1 3.7Å; H141-L296 HydrophobicContact CB-CD2 4.43Å; H141-L296 HydrophobicContact CB-CG 4.11Å
142A83.8Confident83.6Confident26 Ų2656 Ų5622%0.21529%0.29CS..SBendtrans-70.5148.6175.200000110.1I138 V139 I275I138-A142 WeakPolarHBondContact O-CB 3.44Å; I138-A142 PolarHBondContact O-N 3.03Å; V139-A142 WeakPolarHBondContact O-CB 3.4Å; V139-A142 PolarHBondContact O-N 2.9Å; A142-I275 HydrophobicContact CB-CD1 4.39Å; A142-I275 HydrophobicContact CB-CG2 4.2Å
143P79.4Confident83.6Confident16 Ų1657.7 Ų57.710%0.10430%0.297CS..  trans-60.1144.6179.722.9-31000111.6E145 T279 E284 L288P143-E145 PolarHBondContact O-N 3.47Å; P143-T279 HydrophobicContact CG-CG2 4.14Å; P143-T279 WeakPolarHBondContact CG-OG1 3.46Å; P143-E284 HydrophobicContact CB-CB 3.61Å; P143-E284 HydrophobicContact CG-CB 4.22Å; P143-L288 HydrophobicContact CB-CD2 3.82Å; P143-L288 HydrophobicContact CB-CG 4.36Å; P143-L288 HydrophobicContact CG-CD2 4.41Å
144K72.4Confident83.5Confident177 Ų17753.6 Ų53.677%0.7728%0.275SS*.  trans-79.5106.5-177-69.3-177.1-176.9173.80110.4Q146 E284K144-Q146 PolarHBondContact O-N 2.92Å; K144-E284 VanDerWaalsContact O-CD 3.22Å; K144-E284 VanDerWaalsContact O-OE1 3.12Å
145E70.4Confident83.5Confident90 Ų9057.9 Ų57.942%0.42129%0.292SS..  trans-53.5130.7-177.1-52.8-176.2146.100113.9P143 K209 S278 F282 E284P143-E145 PolarHBondContact O-N 3.47Å; E145-K209 IonicContact OE1-NZ 3.16Å; E145-K209 IonicContact OE2-NZ 2.76Å; E145-K209 PolarHBondContact OE2-NZ 3.36Å; E145-S278 VanDerWaalsContact OE1-CB 3.22Å; E145-S278 WeakPolarHBondContact OE1-CB 3.44Å; E145-S278 PolarHBondContact OE1-OG 2.89Å; E145-F282 HydrophobicContact CB-CD2 4.15Å; E145-F282 HydrophobicContact CB-CE2 4.24Å; E145-F282 HydrophobicContact CG-CD2 4.23Å; E145-F282 HydrophobicContact CG-CE2 4.31Å; E145-E284 WeakPolarHBondContact CA-OE1 3.45Å; E145-E284 WeakPolarHBondContact CA-OE2 3.34Å; E145-E284 PolarHBondContact N-OE2 3.4Å
146Q68.1Low83.7Confident85 Ų8560.6 Ų60.640%0.39731%0.311SS..  trans-61.7140170.6-82.1169.134.600112.6K144 L148 F282 E284K144-Q146 PolarHBondContact O-N 2.92Å; Q146-L148 PolarHBondContact O-N 3.22Å; Q146-L148 VanDerWaalsContact O-N 3.13Å; Q146-F282 HydrophobicContact CB-CD1 4.22Å; Q146-E284 VanDerWaalsContact CG-OE1 3.29Å; Q146-E284 WeakPolarHBondContact CG-OE1 2.96Å; Q146-E284 PolarHBondContact N-OE1 2.88Å
147N69.8Low83.8Confident138 Ų13862.5 Ų62.574%0.73832%0.315SS*.  trans-79.791.1173.8-75-53.4000110
148L77.2Confident83.8Confident5 Ų561.4 Ų61.43%0.02631%0.313CS..  trans-61.7137.8169.5-60178.3000110.3Q146 E153 M154 R157 V213 F282Q146-L148 PolarHBondContact O-N 3.22Å; Q146-L148 VanDerWaalsContact O-N 3.13Å; L148-E153 HydrophobicContact CD2-CB 4.47Å; L148-E153 HydrophobicContact CD2-CG 3.81Å; L148-E153 WeakPolarHBondContact CD2-OE1 3.46Å; L148-M154 HydrophobicContact CD1-CB 3.97Å; L148-M154 HydrophobicContact CD1-CE 3.63Å; L148-M154 HydrophobicContact CD1-CG 4.29Å; L148-M154 HydrophobicContact CD1-SD 3.4Å; L148-M154 WeakPolarHBondContact CD1-SD 3.44Å; L148-R157 HydrophobicContact CD2-CG 4.29Å; L148-V213 HydrophobicContact CB-CG1 4.15Å; L148-V213 HydrophobicContact CB-CG2 4.03Å; L148-F282 HydrophobicContact CD1-CE1 3.64Å; L148-F282 HydrophobicContact CD1-CZ 4.26Å; L148-F282 HydrophobicContact CD2-CE1 4.11Å; L148-F282 HydrophobicContact CG-CE1 3.69Å
149T77.6Confident84Confident96 Ų9662.8 Ų62.859%0.58932%0.323SS*.  trans-102.1-24-174.657.70000113.1E153T149-E153 PolarHBondContact N-OE2 2.86Å; T149-E153 PolarHBondContact OG1-OE2 3.31Å; T149-E153 VanDerWaalsContact OG1-OE2 3.1Å
150S86.7Confident84.3Confident32 Ų3263.3 Ų63.322%0.22432%0.324CS..  trans-141.9157.5-175.172.80000113.7H152 E153 M154S150-H152 PolarHBondContact O-N 3.36Å; S150-E153 PolarHBondContact O-N 2.83Å; S150-E153 PolarHBondContact OG-N 3.4Å; S150-M154 PolarHBondContact O-N 3.24Å; S150-M154 VanDerWaalsContact O-N 3.13Å
151L89.4Confident84.6Confident12 Ų1264.6 Ų64.66%0.06334%0.337CS..Hα-helixtrans-62.7-29.6173.2-78.1172.3000112.8M154 W155 G210 G214 M226 F232 L235L151-M154 PolarHBondContact O-N 2.91Å; L151-W155 WeakPolarHBondContact O-CB 3.33Å; L151-W155 PolarHBondContact O-N 2.81Å; L151-G210 VanDerWaalsContact CD2-O 3.3Å; L151-G210 WeakPolarHBondContact CD2-O 3.41Å; L151-G214 VanDerWaalsContact CG-CA 3.48Å; L151-M226 HydrophobicContact CD1-CG 4.17Å; L151-F232 HydrophobicContact CD1-CB 4.08Å; L151-F232 HydrophobicContact CD1-CD2 4.32Å; L151-L235 HydrophobicContact CD2-CD1 4.37Å
152H89.2Confident84.8Confident147 Ų14764.3 Ų64.368%0.68134%0.34SS*.Hα-helixtrans-68.3-41.5177.7-177.966.3000111.3S150 W155 S156S150-H152 PolarHBondContact O-N 3.36Å; H152-W155 WeakPolarHBondContact O-CB 3.36Å; H152-W155 PolarHBondContact O-N 3.49Å; H152-S156 PolarHBondContact O-N 3.22Å
153E89.3Confident85.3Confident59 Ų5963.9 Ų63.928%0.27633%0.333SS..Hα-helixtrans-63.2-43.2173.8-161-173.817200110.9L148 T149 S150 W155 S156 R157L148-E153 HydrophobicContact CD2-CB 4.47Å; L148-E153 HydrophobicContact CD2-CG 3.81Å; L148-E153 WeakPolarHBondContact CD2-OE1 3.46Å; T149-E153 PolarHBondContact N-OE2 2.86Å; T149-E153 PolarHBondContact OG1-OE2 3.31Å; T149-E153 VanDerWaalsContact OG1-OE2 3.1Å; S150-E153 PolarHBondContact O-N 2.83Å; S150-E153 PolarHBondContact OG-N 3.4Å; E153-W155 VanDerWaalsContact C-N 3.33Å; E153-W155 PolarHBondContact O-N 3.41Å; E153-S156 WeakPolarHBondContact O-CB 3.25Å; E153-S156 PolarHBondContact O-N 3.05Å; E153-R157 WeakPolarHBondContact O-CG 3.4Å; E153-R157 PolarHBondContact O-N 3.45Å
154M90.9Very high86.1Confident4 Ų466.7 Ų66.72%0.0235%0.347CS..Hα-helixtrans-60.4-41.4174.1-176.559.5105.400112.2L148 S150 L151 R157 A158 K209 G210 F231 L281L148-M154 HydrophobicContact CD1-CB 3.97Å; L148-M154 HydrophobicContact CD1-CE 3.63Å; L148-M154 HydrophobicContact CD1-CG 4.29Å; L148-M154 HydrophobicContact CD1-SD 3.4Å; L148-M154 WeakPolarHBondContact CD1-SD 3.44Å; S150-M154 PolarHBondContact O-N 3.24Å; S150-M154 VanDerWaalsContact O-N 3.13Å; L151-M154 PolarHBondContact O-N 2.91Å; M154-R157 PolarHBondContact O-N 2.89Å; M154-A158 VanDerWaalsContact O-CB 3.31Å; M154-A158 WeakPolarHBondContact O-CB 3.37Å; M154-A158 PolarHBondContact O-N 2.88Å; M154-K209 HydrophobicContact CE-CB 4.26Å; M154-K209 HydrophobicContact CE-CG 4.18Å; M154-G210 VanDerWaalsContact CE-N 3.34Å; M154-F231 HydrophobicContact CB-CE1 4.3Å; M154-F231 HydrophobicContact CG-CE1 4.04Å; M154-F231 HydrophobicContact CG-CZ 4.42Å; M154-L281 HydrophobicContact CE-CD2 4.39Å; M154-L281 HydrophobicContact SD-CD2 4.09Å
155W92.1Very high87.2Confident91 Ų9163.8 Ų63.835%0.34534%0.338SS..Hα-helixtrans-60.2-48.6174.8170.5-104.5000111.4L151 H152 E153 R157 A158 T159 W230 F231L151-W155 WeakPolarHBondContact O-CB 3.33Å; L151-W155 PolarHBondContact O-N 2.81Å; H152-W155 WeakPolarHBondContact O-CB 3.36Å; H152-W155 PolarHBondContact O-N 3.49Å; E153-W155 VanDerWaalsContact C-N 3.33Å; E153-W155 PolarHBondContact O-N 3.41Å; W155-R157 VanDerWaalsContact C-N 3.29Å; W155-R157 PolarHBondContact O-N 3.41Å; W155-A158 PolarHBondContact O-N 3.33Å; W155-A158 VanDerWaalsContact O-N 3.11Å; W155-T159 HydrophobicContact CD2-CG2 3.88Å; W155-T159 HydrophobicContact CE3-CG2 4.12Å; W155-T159 HydrophobicContact CH2-CG2 3.79Å; W155-T159 HydrophobicContact CZ2-CG2 3.48Å; W155-T159 VanDerWaalsContact CZ2-CG2 3.48Å; W155-T159 HydrophobicContact CZ3-CG2 4.1Å; W155-T159 PolarHBondContact O-N 2.93Å; W155-T159 PolarHBondContact O-OG1 2.98Å; W155-T159 VanDerWaalsContact O-OG1 3.05Å; W155-W230 AromaticContact CH2-CH2 3.68Å; W155-W230 HydrophobicContact CH2-CH2 3.68Å; W155-W230 AromaticContact CH2-CZ2 3.59Å; W155-W230 HydrophobicContact CH2-CZ2 3.59Å; W155-W230 HydrophobicContact CZ2-CH2 4.48Å; W155-W230 AromaticContact CZ2-CZ2 3.97Å; W155-W230 HydrophobicContact CZ2-CZ2 3.97Å; W155-W230 AromaticContact CZ3-CH2 3.91Å; W155-W230 HydrophobicContact CZ3-CH2 3.91Å; W155-W230 AromaticContact CZ3-CZ2 3.93Å; W155-W230 HydrophobicContact CZ3-CZ2 3.93Å; W155-F231 HydrophobicContact CB-CD1 3.92Å; W155-F231 HydrophobicContact CB-CE1 3.93Å; W155-F231 HydrophobicContact CB-CG 4.4Å; W155-F231 HydrophobicContact CB-CZ 4.43Å; W155-F231 HydrophobicContact CD2-CD2 4.36Å; W155-F231 HydrophobicContact CD2-CG 4.49Å; W155-F231 HydrophobicContact CE3-CB 4.48Å; W155-F231 HydrophobicContact CE3-CD1 4.31Å; W155-F231 AromaticContact CE3-CD2 3.29Å; W155-F231 HydrophobicContact CE3-CD2 3.29Å; W155-F231 HydrophobicContact CE3-CE1 4.37Å; W155-F231 AromaticContact CE3-CE2 3.39Å; W155-F231 HydrophobicContact CE3-CE2 3.39Å; W155-F231 AromaticContact CE3-CG 3.79Å; W155-F231 HydrophobicContact CE3-CG 3.79Å; W155-F231 AromaticContact CE3-CZ 3.94Å; W155-F231 HydrophobicContact CE3-CZ 3.94Å; W155-F231 AromaticContact CZ3-CD2 3.66Å; W155-F231 HydrophobicContact CZ3-CD2 3.66Å; W155-F231 AromaticContact CZ3-CE2 3.82Å; W155-F231 HydrophobicContact CZ3-CE2 3.82Å; W155-F231 HydrophobicContact CZ3-CG 4.48Å
156S92.1Very high88.4Confident58 Ų5860.2 Ų60.241%0.40632%0.321SS..Hα-helixtrans-55.1-46.1178.4-171.20000111.5H152 E153 T159 D160H152-S156 PolarHBondContact O-N 3.22Å; E153-S156 WeakPolarHBondContact O-CB 3.25Å; E153-S156 PolarHBondContact O-N 3.05Å; S156-T159 PolarHBondContact O-N 3.5Å; S156-T159 PolarHBondContact O-OG1 2.99Å; S156-D160 PolarHBondContact O-N 3.28Å
157R90.9Very high89.7Confident64 Ų6457.2 Ų57.224%0.24231%0.31CS..Hα-helixtrans-66.6-39.3177.3-63.2-56.9-171.7169.46.9112.9L148 E153 M154 W155 T159 D160 L281L148-R157 HydrophobicContact CD2-CG 4.29Å; E153-R157 WeakPolarHBondContact O-CG 3.4Å; E153-R157 PolarHBondContact O-N 3.45Å; M154-R157 PolarHBondContact O-N 2.89Å; W155-R157 VanDerWaalsContact C-N 3.29Å; W155-R157 PolarHBondContact O-N 3.41Å; R157-T159 PolarHBondContact O-N 3.38Å; R157-D160 IonicContact NH1-OD2 3.79Å; R157-D160 WeakPolarHBondContact O-CB 3.35Å; R157-D160 PolarHBondContact O-N 3.05Å; R157-L281 HydrophobicContact CB-CD1 3.84Å; R157-L281 HydrophobicContact CB-CG 4.34Å
158A91.1Very high91Very high24 Ų2455.7 Ų55.720%0.19830%0.301CS..Hα-helixtrans-67.9-25177.600000112.7M154 W155 F163 F231M154-A158 VanDerWaalsContact O-CB 3.31Å; M154-A158 WeakPolarHBondContact O-CB 3.37Å; M154-A158 PolarHBondContact O-N 2.88Å; W155-A158 PolarHBondContact O-N 3.33Å; W155-A158 VanDerWaalsContact O-N 3.11Å; A158-F163 HydrophobicContact CB-CD1 4.35Å; A158-F163 HydrophobicContact CB-CE1 4.49Å; A158-F231 HydrophobicContact CB-CZ 4.26Å
159T92.8Very high91.9Very high53 Ų5361 Ų6133%0.32532%0.324SS..THydrogen-bonded Turntrans-90-3.1174.853.10000114.3W155 S156 R157 I164W155-T159 HydrophobicContact CD2-CG2 3.88Å; W155-T159 HydrophobicContact CE3-CG2 4.12Å; W155-T159 HydrophobicContact CH2-CG2 3.79Å; W155-T159 HydrophobicContact CZ2-CG2 3.48Å; W155-T159 VanDerWaalsContact CZ2-CG2 3.48Å; W155-T159 HydrophobicContact CZ3-CG2 4.1Å; W155-T159 PolarHBondContact O-N 2.93Å; W155-T159 PolarHBondContact O-OG1 2.98Å; W155-T159 VanDerWaalsContact O-OG1 3.05Å; S156-T159 PolarHBondContact O-N 3.5Å; S156-T159 PolarHBondContact O-OG1 2.99Å; R157-T159 PolarHBondContact O-N 3.38Å; T159-I164 VanDerWaalsContact O-CD1 3.3Å; T159-I164 WeakPolarHBondContact O-CD1 3.23Å
160D92Very high92.9Very high38 Ų3856.5 Ų56.520%0.20330%0.296CS..SBendtrans-62.4139.8175.5-76.3-30.1000110S156 R157 S162 F163 I164 H283S156-D160 PolarHBondContact O-N 3.28Å; R157-D160 IonicContact NH1-OD2 3.79Å; R157-D160 WeakPolarHBondContact O-CB 3.35Å; R157-D160 PolarHBondContact O-N 3.05Å; D160-S162 PolarHBondContact O-N 3.06Å; D160-S162 VanDerWaalsContact O-N 3.11Å; D160-F163 PolarHBondContact O-N 3.13Å; D160-F163 VanDerWaalsContact O-N 3.1Å; D160-I164 PolarHBondContact O-N 2.89Å; D160-I164 VanDerWaalsContact O-N 3.11Å; D160-H283 IonicContact OD2-CE1 2.6Å; D160-H283 PolarHBondContact OD2-CE1 2.94Å; D160-H283 IonicContact OD2-ND1 3.63Å
161P93.8Very high93.4Very high94 Ų9457.9 Ų57.961%0.6130%0.3SS*.Hα-helixtrans-55.5-35.2-175.4-27.534.1000113.6I164 I165P161-I164 PolarHBondContact O-N 3.23Å; P161-I165 WeakPolarHBondContact O-CB 3.48Å; P161-I165 WeakPolarHBondContact O-CD1 3.47Å; P161-I165 WeakPolarHBondContact O-CG1 3.3Å; P161-I165 PolarHBondContact O-N 3.49Å
162S92.3Very high93.7Very high41 Ų4162.5 Ų62.529%0.28732%0.324SS..Hα-helixtrans-61.2-47.5179.258.80000111.6D160 I165 Y166 V280 H283D160-S162 PolarHBondContact O-N 3.06Å; D160-S162 VanDerWaalsContact O-N 3.11Å; S162-I165 PolarHBondContact O-N 3.39Å; S162-Y166 PolarHBondContact O-N 2.92Å; S162-V280 VanDerWaalsContact O-CG1 3.32Å; S162-V280 WeakPolarHBondContact O-CG1 3.46Å; S162-H283 PolarHBondContact OG-CE1 3.38Å; S162-H283 PolarHBondContact OG-NE2 3.42Å
163F93.5Very high94.1Very high18 Ų1857.4 Ų57.48%0.07930%0.302CS..Hα-helixtrans-72.7-34.8-179.5-170.2-100.6000112.5A158 D160 Y166 S167 V206 V280 L281A158-F163 HydrophobicContact CB-CD1 4.35Å; A158-F163 HydrophobicContact CB-CE1 4.49Å; D160-F163 PolarHBondContact O-N 3.13Å; D160-F163 VanDerWaalsContact O-N 3.1Å; F163-Y166 HydrophobicContact CD2-CD1 4.38Å; F163-Y166 HydrophobicContact CE2-CD1 4.14Å; F163-Y166 PolarHBondContact O-N 3.31Å; F163-S167 WeakPolarHBondContact CE1-OG 3.47Å; F163-S167 WeakPolarHBondContact O-CB 3.34Å; F163-S167 PolarHBondContact O-N 3.31Å; F163-S167 PolarHBondContact O-OG 3.24Å; F163-V206 HydrophobicContact CE1-CG1 4.5Å; F163-V206 HydrophobicContact CE2-CG1 4.16Å; F163-V206 HydrophobicContact CE2-CG2 4.32Å; F163-V206 HydrophobicContact CZ-CB 4.33Å; F163-V206 HydrophobicContact CZ-CG1 3.66Å; F163-V206 HydrophobicContact CZ-CG2 4.37Å; F163-V280 HydrophobicContact CB-CG1 4.18Å; F163-V280 HydrophobicContact CD2-CG1 4.31Å; F163-L281 HydrophobicContact CB-CD1 4.38Å; F163-L281 HydrophobicContact CD1-CD1 4.05Å; F163-L281 HydrophobicContact CD2-CB 3.73Å; F163-L281 HydrophobicContact CD2-CD1 3.7Å; F163-L281 HydrophobicContact CD2-CG 4.29Å; F163-L281 HydrophobicContact CE1-CD1 4.28Å; F163-L281 HydrophobicContact CE2-CB 3.99Å; F163-L281 HydrophobicContact CE2-CD1 3.97Å; F163-L281 HydrophobicContact CE2-CG 4.41Å; F163-L281 HydrophobicContact CG-CD1 3.75Å; F163-L281 HydrophobicContact CZ-CD1 4.26Å
164I95.4Very high94.5Very high74 Ų7454.9 Ų54.938%0.37929%0.291SS..Hα-helixtrans-62.2-47.5172.7-65.7175.8000110.3T159 D160 P161 Y166 S167 L168T159-I164 VanDerWaalsContact O-CD1 3.3Å; T159-I164 WeakPolarHBondContact O-CD1 3.23Å; D160-I164 PolarHBondContact O-N 2.89Å; D160-I164 VanDerWaalsContact O-N 3.11Å; P161-I164 PolarHBondContact O-N 3.23Å; I164-Y166 VanDerWaalsContact C-N 3.35Å; I164-Y166 PolarHBondContact O-N 3.46Å; I164-S167 PolarHBondContact O-N 2.94Å; I164-L168 HydrophobicContact CG2-CD1 3.88Å; I164-L168 HydrophobicContact CG2-CG 4.3Å; I164-L168 WeakPolarHBondContact O-CB 3.35Å; I164-L168 VanDerWaalsContact O-CG 3.31Å; I164-L168 WeakPolarHBondContact O-CG 3.25Å; I164-L168 PolarHBondContact O-N 2.93Å
165I96Very high94.8Very high116 Ų11658.6 Ų58.660%0.59531%0.31SS*.Hα-helixtrans-60-45.4178-70.3164.3000110.7P161 S162 L168 F169P161-I165 WeakPolarHBondContact O-CB 3.48Å; P161-I165 WeakPolarHBondContact O-CD1 3.47Å; P161-I165 WeakPolarHBondContact O-CG1 3.3Å; P161-I165 PolarHBondContact O-N 3.49Å; S162-I165 PolarHBondContact O-N 3.39Å; I165-L168 PolarHBondContact O-N 3.43Å; I165-F169 WeakPolarHBondContact O-CB 3.4Å; I165-F169 PolarHBondContact O-N 2.93Å
166Y95.4Very high95.1Very high16 Ų1656.8 Ų56.86%0.06331%0.309CS..Hα-helixtrans-59.9-46.8175.8169.4-96.2000112.2S162 F163 I164 L168 F169 V170 S202 L203 F273 I276 A277S162-Y166 PolarHBondContact O-N 2.92Å; F163-Y166 HydrophobicContact CD2-CD1 4.38Å; F163-Y166 HydrophobicContact CE2-CD1 4.14Å; F163-Y166 PolarHBondContact O-N 3.31Å; I164-Y166 VanDerWaalsContact C-N 3.35Å; I164-Y166 PolarHBondContact O-N 3.46Å; Y166-L168 PolarHBondContact O-N 3.37Å; Y166-F169 WeakPolarHBondContact O-CB 3.23Å; Y166-F169 PolarHBondContact O-N 3.41Å; Y166-V170 HydrophobicContact CD2-CG2 4.36Å; Y166-V170 HydrophobicContact CE1-CG2 3.96Å; Y166-V170 HydrophobicContact CE2-CG2 3.82Å; Y166-V170 WeakPolarHBondContact O-CG2 3.48Å; Y166-V170 PolarHBondContact O-N 3.2Å; Y166-S202 PolarHBondContact OH-OG 3.37Å; Y166-L203 HydrophobicContact CD1-CD2 4.39Å; Y166-L203 HydrophobicContact CE1-CD2 3.78Å; Y166-F273 HydrophobicContact CE2-CD1 4.44Å; Y166-F273 PolarHBondContact OH-O 2.96Å; Y166-I276 HydrophobicContact CD2-CG2 3.68Å; Y166-I276 HydrophobicContact CE2-CB 4.02Å; Y166-I276 HydrophobicContact CE2-CG2 3.44Å; Y166-I276 VanDerWaalsContact CE2-CG2 3.44Å; Y166-A277 HydrophobicContact CD1-CB 4.37Å; Y166-A277 HydrophobicContact CE1-CB 3.46Å; Y166-A277 VanDerWaalsContact CE1-CB 3.46Å; Y166-A277 WeakPolarHBondContact OH-CB 3.36Å
167S95.9Very high95.4Very high22 Ų2254.3 Ų54.315%0.15429%0.291CS..Hα-helixtrans-63.1-44.2-179.5-61.20000111.4F163 I164 F169 V170 I171F163-S167 WeakPolarHBondContact CE1-OG 3.47Å; F163-S167 WeakPolarHBondContact O-CB 3.34Å; F163-S167 PolarHBondContact O-N 3.31Å; F163-S167 PolarHBondContact O-OG 3.24Å; I164-S167 PolarHBondContact O-N 2.94Å; S167-F169 VanDerWaalsContact C-N 3.35Å; S167-F169 PolarHBondContact O-N 3.48Å; S167-V170 PolarHBondContact O-N 3.47Å; S167-I171 WeakPolarHBondContact O-CD1 3.35Å; S167-I171 VanDerWaalsContact O-CG1 3.24Å; S167-I171 WeakPolarHBondContact O-CG1 3.2Å; S167-I171 PolarHBondContact O-N 2.94Å
168L96.7Very high95.6Very high106 Ų10652.7 Ų52.756%0.55529%0.287SS*.Hα-helixtrans-62.8-40.8174.7-71.2175000111.9I164 I165 Y166 I171 L172I164-L168 HydrophobicContact CG2-CD1 3.88Å; I164-L168 HydrophobicContact CG2-CG 4.3Å; I164-L168 WeakPolarHBondContact O-CB 3.35Å; I164-L168 VanDerWaalsContact O-CG 3.31Å; I164-L168 WeakPolarHBondContact O-CG 3.25Å; I164-L168 PolarHBondContact O-N 2.93Å; I165-L168 PolarHBondContact O-N 3.43Å; Y166-L168 PolarHBondContact O-N 3.37Å; L168-I171 PolarHBondContact O-N 3.24Å; L168-L172 VanDerWaalsContact O-CB 3.27Å; L168-L172 WeakPolarHBondContact O-CB 3.32Å; L168-L172 PolarHBondContact O-N 3.43Å
169F97.4Very high95.9Very high117 Ų11758.5 Ų58.551%0.51331%0.308SS..Hα-helixtrans-60-47.6174.8169.4-98.8000111.6I165 Y166 S167 I171 L172 L173 F273I165-F169 WeakPolarHBondContact O-CB 3.4Å; I165-F169 PolarHBondContact O-N 2.93Å; Y166-F169 WeakPolarHBondContact O-CB 3.23Å; Y166-F169 PolarHBondContact O-N 3.41Å; S167-F169 VanDerWaalsContact C-N 3.35Å; S167-F169 PolarHBondContact O-N 3.48Å; F169-I171 PolarHBondContact O-N 2.99Å; F169-L172 PolarHBondContact O-N 3.43Å; F169-L173 HydrophobicContact CE1-CD2 4.22Å; F169-L173 HydrophobicContact CZ-CD2 4.33Å; F169-L173 WeakPolarHBondContact O-CB 3.36Å; F169-L173 PolarHBondContact O-N 3.06Å; F169-F273 HydrophobicContact CE1-CE1 4.35Å
170V97.6Very high96.1Very high0 Ų060.1 Ų60.10%031%0.314CS..Hα-helixtrans-63.2-42178.6168.90000111.7Y166 S167 S174 S199 L203 F273Y166-V170 HydrophobicContact CD2-CG2 4.36Å; Y166-V170 HydrophobicContact CE1-CG2 3.96Å; Y166-V170 HydrophobicContact CE2-CG2 3.82Å; Y166-V170 WeakPolarHBondContact O-CG2 3.48Å; Y166-V170 PolarHBondContact O-N 3.2Å; S167-V170 PolarHBondContact O-N 3.47Å; V170-S174 WeakPolarHBondContact O-CB 3.35Å; V170-S174 PolarHBondContact O-N 3.39Å; V170-S174 PolarHBondContact O-OG 3.02Å; V170-S199 WeakPolarHBondContact CG1-O 3.45Å; V170-L203 HydrophobicContact CB-CD1 4.17Å; V170-L203 HydrophobicContact CG1-CD1 3.63Å; V170-L203 HydrophobicContact CG1-CG 3.94Å; V170-F273 HydrophobicContact CG2-CD1 4.15Å; V170-F273 HydrophobicContact CG2-CE1 4.25Å
171I96.6Very high96.3Very high61 Ų6160.8 Ų60.831%0.31332%0.317SS..Hα-helixtrans-63.7-47.4176.9-67.8163.8000110.2S167 L168 F169 S174 I175 L203 W238S167-I171 WeakPolarHBondContact O-CD1 3.35Å; S167-I171 VanDerWaalsContact O-CG1 3.24Å; S167-I171 WeakPolarHBondContact O-CG1 3.2Å; S167-I171 PolarHBondContact O-N 2.94Å; L168-I171 PolarHBondContact O-N 3.24Å; F169-I171 PolarHBondContact O-N 2.99Å; I171-S174 WeakPolarHBondContact O-CB 3.46Å; I171-S174 PolarHBondContact O-N 3.44Å; I171-I175 HydrophobicContact CG2-CD1 3.88Å; I171-I175 VanDerWaalsContact O-CG1 3.31Å; I171-I175 WeakPolarHBondContact O-CG1 3.36Å; I171-I175 PolarHBondContact O-N 3.21Å; I171-L203 HydrophobicContact CG1-CD1 4.43Å; I171-W238 HydrophobicContact CD1-CH2 3.79Å; I171-W238 HydrophobicContact CD1-CZ2 4.36Å; I171-W238 HydrophobicContact CG1-CH2 4.38Å
172L97.5Very high96.4Very high109 Ų10956.6 Ų56.657%0.57129%0.291SS*.Hα-helixtrans-63.7-44.9179.1-178.463.5000111.7L168 F169 S174 I175 V176L168-L172 VanDerWaalsContact O-CB 3.27Å; L168-L172 WeakPolarHBondContact O-CB 3.32Å; L168-L172 PolarHBondContact O-N 3.43Å; F169-L172 PolarHBondContact O-N 3.43Å; L172-S174 VanDerWaalsContact C-N 3.28Å; L172-S174 PolarHBondContact O-N 3.28Å; L172-I175 PolarHBondContact O-N 2.88Å; L172-V176 WeakPolarHBondContact O-CG2 3.27Å; L172-V176 PolarHBondContact O-N 3.42Å
173L97.7Very high96.5Very high41 Ų4159.6 Ų59.622%0.21531%0.309CS..Hα-helixtrans-55.8-46.4174175.864.4000110.4F169 V176 L177 F273F169-L173 HydrophobicContact CE1-CD2 4.22Å; F169-L173 HydrophobicContact CZ-CD2 4.33Å; F169-L173 WeakPolarHBondContact O-CB 3.36Å; F169-L173 PolarHBondContact O-N 3.06Å; L173-V176 PolarHBondContact O-N 2.94Å; L173-L177 HydrophobicContact CD1-CD1 3.95Å; L173-L177 HydrophobicContact CD1-CG 4.21Å; L173-L177 HydrophobicContact CG-CD1 3.79Å; L173-L177 HydrophobicContact CG-CG 4.46Å; L173-L177 WeakPolarHBondContact O-CB 3.22Å; L173-L177 WeakPolarHBondContact O-CD1 3.01Å; L173-L177 VanDerWaalsContact O-CG 3.22Å; L173-L177 WeakPolarHBondContact O-CG 3.42Å; L173-L177 PolarHBondContact O-N 3.46Å; L173-F273 HydrophobicContact CD2-CE1 4.13Å; L173-F273 HydrophobicContact CD2-CZ 3.66Å
174S97.3Very high96.5Very high6 Ų667.1 Ų67.14%0.04234%0.337CS..Hα-helixtrans-62.3-44.5177.6-61.50000111.8V170 I171 L172 V176 L177 I178 S199 I200V170-S174 WeakPolarHBondContact O-CB 3.35Å; V170-S174 PolarHBondContact O-N 3.39Å; V170-S174 PolarHBondContact O-OG 3.02Å; I171-S174 WeakPolarHBondContact O-CB 3.46Å; I171-S174 PolarHBondContact O-N 3.44Å; L172-S174 VanDerWaalsContact C-N 3.28Å; L172-S174 PolarHBondContact O-N 3.28Å; S174-V176 PolarHBondContact O-N 2.9Å; S174-L177 PolarHBondContact O-N 3.25Å; S174-I178 VanDerWaalsContact O-CB 3.25Å; S174-I178 WeakPolarHBondContact O-CB 3.31Å; S174-I178 WeakPolarHBondContact O-CD1 3.25Å; S174-I178 WeakPolarHBondContact O-CG1 3.46Å; S174-I178 PolarHBondContact O-N 3.35Å; S174-S199 PolarHBondContact OG-OG 2.59Å; S174-I200 WeakPolarHBondContact OG-CG1 3.31Å
175I97.6Very high96.5Very high81 Ų8168.9 Ų68.942%0.41534%0.34SS..Hα-helixtrans-59.1-47.8176.1-71.2169000110.8I171 L172 L177 I178 F179I171-I175 HydrophobicContact CG2-CD1 3.88Å; I171-I175 VanDerWaalsContact O-CG1 3.31Å; I171-I175 WeakPolarHBondContact O-CG1 3.36Å; I171-I175 PolarHBondContact O-N 3.21Å; L172-I175 PolarHBondContact O-N 2.88Å; I175-L177 PolarHBondContact O-N 3.49Å; I175-I178 PolarHBondContact O-N 3.41Å; I175-F179 HydrophobicContact CB-CD2 4.47Å; I175-F179 HydrophobicContact CG2-CD2 3.85Å; I175-F179 HydrophobicContact CG2-CE2 4.34Å; I175-F179 WeakPolarHBondContact O-CD2 3.45Å; I175-F179 PolarHBondContact O-N 2.83Å
176V97.9Very high96.3Very high54 Ų5463.4 Ų63.433%0.32731%0.312SS..Hα-helixtrans-61.3-46177.9169.70000111L172 L173 S174 I178 I180 L181L172-V176 WeakPolarHBondContact O-CG2 3.27Å; L172-V176 PolarHBondContact O-N 3.42Å; L173-V176 PolarHBondContact O-N 2.94Å; S174-V176 PolarHBondContact O-N 2.9Å; V176-I178 VanDerWaalsContact C-N 3.31Å; V176-I178 PolarHBondContact O-N 3.39Å; V176-I180 HydrophobicContact CG1-CD1 4.35Å; V176-I180 HydrophobicContact CG2-CD1 4.45Å; V176-I180 WeakPolarHBondContact O-CA 3.38Å; V176-I180 VanDerWaalsContact O-CB 3.31Å; V176-I180 WeakPolarHBondContact O-CB 3.48Å; V176-I180 PolarHBondContact O-N 3.47Å; V176-L181 HydrophobicContact CG1-CD1 4.39Å; V176-L181 PolarHBondContact O-N 2.92Å; V176-L181 VanDerWaalsContact O-N 3.1Å
177L97.3Very high96.3Very high5 Ų568 Ų683%0.02633%0.332CS..Iπ-helixtrans-63.8-37.1177.8-71.8165.6000112.1L173 S174 I175 L181 G182 I192 L195 V196L173-L177 HydrophobicContact CD1-CD1 3.95Å; L173-L177 HydrophobicContact CD1-CG 4.21Å; L173-L177 HydrophobicContact CG-CD1 3.79Å; L173-L177 HydrophobicContact CG-CG 4.46Å; L173-L177 WeakPolarHBondContact O-CB 3.22Å; L173-L177 WeakPolarHBondContact O-CD1 3.01Å; L173-L177 VanDerWaalsContact O-CG 3.22Å; L173-L177 WeakPolarHBondContact O-CG 3.42Å; L173-L177 PolarHBondContact O-N 3.46Å; S174-L177 PolarHBondContact O-N 3.25Å; I175-L177 PolarHBondContact O-N 3.49Å; L177-L181 HydrophobicContact CD2-CD1 3.83Å; L177-G182 VanDerWaalsContact O-CA 3.25Å; L177-G182 WeakPolarHBondContact O-CA 3.3Å; L177-G182 PolarHBondContact O-N 3.17Å; L177-I192 HydrophobicContact CD2-CD1 4.14Å; L177-I192 HydrophobicContact CD2-CG2 4.16Å; L177-L195 HydrophobicContact CD1-CB 4.02Å; L177-L195 HydrophobicContact CD1-CD2 3.65Å; L177-L195 HydrophobicContact CD1-CG 3.85Å; L177-L195 HydrophobicContact CD2-CD2 4.05Å; L177-L195 HydrophobicContact CG-CD2 4.47Å; L177-V196 HydrophobicContact CB-CG2 3.39Å; L177-V196 HydrophobicContact CD1-CG2 3.86Å; L177-V196 HydrophobicContact CG-CG2 4.26Å
178I96.5Very high96.1Very high30 Ų3071.4 Ų71.415%0.15435%0.352CS..Iπ-helixtrans-75.5-50.7-177.1-72.6171.1000111.8S174 I175 V176 P183 V196 Y249S174-I178 VanDerWaalsContact O-CB 3.25Å; S174-I178 WeakPolarHBondContact O-CB 3.31Å; S174-I178 WeakPolarHBondContact O-CD1 3.25Å; S174-I178 WeakPolarHBondContact O-CG1 3.46Å; S174-I178 PolarHBondContact O-N 3.35Å; I175-I178 PolarHBondContact O-N 3.41Å; V176-I178 VanDerWaalsContact C-N 3.31Å; V176-I178 PolarHBondContact O-N 3.39Å; I178-P183 WeakPolarHBondContact O-CD 3.39Å; I178-V196 HydrophobicContact CD1-CG1 3.87Å; I178-V196 HydrophobicContact CG1-CG1 3.93Å; I178-V196 HydrophobicContact CG1-CG2 3.98Å; I178-Y249 HydrophobicContact CD1-CD2 4.39Å; I178-Y249 HydrophobicContact CD1-CE2 3.54Å; I178-Y249 HydrophobicContact CG1-CE1 4.09Å; I178-Y249 HydrophobicContact CG1-CE2 3.76Å; I178-Y249 VanDerWaalsContact CG1-CZ 3.48Å; I178-Y249 WeakPolarHBondContact CG1-OH 3.41Å; I178-Y249 WeakPolarHBondContact CG2-OH 3.34Å
179F97Very high95.8Very high147 Ų14769.7 Ų69.765%0.64534%0.343SS*.Iπ-helixtrans-94.3-26.9-168.9-67-72.5000113.6I175 P183I175-F179 HydrophobicContact CB-CD2 4.47Å; I175-F179 HydrophobicContact CG2-CD2 3.85Å; I175-F179 HydrophobicContact CG2-CE2 4.34Å; I175-F179 WeakPolarHBondContact O-CD2 3.45Å; I175-F179 PolarHBondContact O-N 2.83Å; F179-P183 WeakPolarHBondContact O-CG 3.2Å
180I96.5Very high95.6Very high86 Ų8664.5 Ų64.544%0.44132%0.322SS..Iπ-helixtrans-104.3-56.8-176.1-53.9178.7000110.6V176V176-I180 HydrophobicContact CG1-CD1 4.35Å; V176-I180 HydrophobicContact CG2-CD1 4.45Å; V176-I180 WeakPolarHBondContact O-CA 3.38Å; V176-I180 VanDerWaalsContact O-CB 3.31Å; V176-I180 WeakPolarHBondContact O-CB 3.48Å; V176-I180 PolarHBondContact O-N 3.47Å
181L96.7Very high95.4Very high53 Ų5367.2 Ų67.228%0.27734%0.335SS..Iπ-helixtrans-83.6-30-174.3-59.9176.1000112.5V176 L177 R184 Y185 G186 I192V176-L181 HydrophobicContact CG1-CD1 4.39Å; V176-L181 PolarHBondContact O-N 2.92Å; V176-L181 VanDerWaalsContact O-N 3.1Å; L177-L181 HydrophobicContact CD2-CD1 3.83Å; L181-R184 PolarHBondContact O-N 2.82Å; L181-Y185 HydrophobicContact CD2-CD2 3.88Å; L181-Y185 HydrophobicContact CD2-CE2 4.07Å; L181-Y185 WeakPolarHBondContact O-CA 3.25Å; L181-Y185 PolarHBondContact O-N 2.84Å; L181-G186 PolarHBondContact O-N 3.42Å; L181-I192 HydrophobicContact CB-CD1 4.14Å; L181-I192 HydrophobicContact CB-CG2 4.19Å; L181-I192 HydrophobicContact CD1-CD1 4.4Å
182G95.1Very high95.4Very high6 Ų665.2 Ų65.26%0.06233%0.325CS..Hα-helixtrans-58.3-53.4-179.900000113L177 R184 G186L177-G182 VanDerWaalsContact O-CA 3.25Å; L177-G182 WeakPolarHBondContact O-CA 3.3Å; L177-G182 PolarHBondContact O-N 3.17Å; G182-R184 VanDerWaalsContact C-N 3.31Å; G182-R184 PolarHBondContact O-N 3.09Å; G182-G186 WeakPolarHBondContact O-CA 3.46Å; G182-G186 PolarHBondContact O-N 3.03Å
183P94.3Very high95.3Very high103 Ų10360 Ų6067%0.66930%0.298SS*.Hα-helixtrans-65.8-32.9179.2-23.235.3000113.2I178 F179I178-P183 WeakPolarHBondContact O-CD 3.39Å; F179-P183 WeakPolarHBondContact O-CG 3.2Å
184R94.6Very high95.2Very high176 Ų17658.1 Ų58.166%0.66429%0.288SS*.Hα-helixtrans-83.7-40.6-175.7-67.2-176.5179.1174.61.6113.5L181 G182L181-R184 PolarHBondContact O-N 2.82Å; G182-R184 VanDerWaalsContact C-N 3.31Å; G182-R184 PolarHBondContact O-N 3.09Å
185Y94.4Very high95.2Very high112 Ų11259.1 Ų59.144%0.43929%0.293SS..Hα-helixtrans-132.1-9.1-165.6-57-61.5000114L181 K187 T188 N189L181-Y185 HydrophobicContact CD2-CD2 3.88Å; L181-Y185 HydrophobicContact CD2-CE2 4.07Å; L181-Y185 WeakPolarHBondContact O-CA 3.25Å; L181-Y185 PolarHBondContact O-N 2.84Å; Y185-K187 VanDerWaalsContact C-N 3.28Å; Y185-K187 PolarHBondContact O-N 2.84Å; Y185-T188 PolarHBondContact O-N 3.21Å; Y185-T188 VanDerWaalsContact O-N 3.15Å; Y185-T188 PolarHBondContact O-OG1 3.07Å; Y185-T188 VanDerWaalsContact O-OG1 3.13Å; Y185-N189 WeakPolarHBondContact O-CB 3.48Å; Y185-N189 PolarHBondContact O-N 3.28Å
186G93.4Very high95.2Very high0 Ų055.3 Ų55.30%027%0.273CS..THydrogen-bonded Turntrans-64.2-29.1-174.100000114.5L181 G182 F193L181-G186 PolarHBondContact O-N 3.42Å; G182-G186 WeakPolarHBondContact O-CA 3.46Å; G182-G186 PolarHBondContact O-N 3.03Å; G186-F193 VanDerWaalsContact C-CE2 3.46Å; G186-F193 WeakPolarHBondContact O-CD2 3.22Å; G186-F193 VanDerWaalsContact O-CE2 3.23Å; G186-F193 WeakPolarHBondContact O-CE2 3.39Å
187K93.8Very high95.2Very high114 Ų11452.9 Ų52.950%0.49626%0.259SS..THydrogen-bonded Turntrans-80.7-19.2177-62.4-168.1-174.6-173.80114.1D60 Y185 L256 F257D60-K187 WeakPolarHBondContact OD1-CE 3.31Å; D60-K187 IonicContact OD1-NZ 2.64Å; D60-K187 PolarHBondContact OD1-NZ 3.03Å; Y185-K187 VanDerWaalsContact C-N 3.28Å; Y185-K187 PolarHBondContact O-N 2.84Å; K187-L256 HydrophobicContact CB-CD2 4.49Å; K187-L256 HydrophobicContact CG-CD1 4.32Å; K187-L256 HydrophobicContact CG-CD2 4.33Å; K187-F257 WeakPolarHBondContact O-CZ 3.49Å
188T91.7Very high95.2Very high92 Ų9252.7 Ų52.756%0.56426%0.257SS*.THydrogen-bonded Turntrans-106.2-29.3-176.452.90000112.5Y185Y185-T188 PolarHBondContact O-N 3.21Å; Y185-T188 VanDerWaalsContact O-N 3.15Å; Y185-T188 PolarHBondContact O-OG1 3.07Å; Y185-T188 VanDerWaalsContact O-OG1 3.13Å
189N91.7Very high95.2Very high71 Ų7151.2 Ų51.238%0.3825%0.25SS..  trans-114.6114.1-175.7-67.9-75.7000111.2Y185 I191 I192Y185-N189 WeakPolarHBondContact O-CB 3.48Å; Y185-N189 PolarHBondContact O-N 3.28Å; N189-I191 PolarHBondContact O-N 3.23Å; N189-I191 VanDerWaalsContact O-N 3.14Å; N189-I192 HydrophobicContact CB-CG1 4.12Å; N189-I192 PolarHBondContact O-N 3.16Å
190P92.3Very high95.3Very high8 Ų845 Ų455%0.05222%0.224CC..Hα-helixtrans-63.6-23.6-17825.2-33.8000113.1I192 T194 F257 I261 I262 L265P190-I192 VanDerWaalsContact C-N 3.33Å; P190-I192 PolarHBondContact O-N 3.15Å; P190-T194 VanDerWaalsContact O-CB 3.27Å; P190-T194 WeakPolarHBondContact O-CB 3.27Å; P190-T194 PolarHBondContact O-N 3.42Å; P190-T194 PolarHBondContact O-OG1 3.23Å; P190-F257 VanDerWaalsContact CA-CE2 3.46Å; P190-F257 HydrophobicContact CB-CB 4.41Å; P190-F257 HydrophobicContact CB-CD1 3.99Å; P190-F257 HydrophobicContact CB-CD2 3.81Å; P190-F257 HydrophobicContact CB-CE1 4.19Å; P190-F257 HydrophobicContact CB-CE2 4.04Å; P190-F257 HydrophobicContact CB-CG 3.79Å; P190-F257 HydrophobicContact CB-CZ 4.22Å; P190-F257 HydrophobicContact CG-CD1 4.45Å; P190-F257 HydrophobicContact CG-CE1 4.5Å; P190-I261 HydrophobicContact CB-CG2 4.16Å; P190-I261 HydrophobicContact CG-CG2 4.1Å; P190-I262 HydrophobicContact CB-CD1 3.73Å; P190-L265 HydrophobicContact CB-CD1 4.03Å; P190-L265 HydrophobicContact CG-CD1 4.11Å
191I93.6Very high95.2Very high56 Ų5641 Ų4129%0.28720%0.203SC..Hα-helixtrans-62.1-39.2-177.8-64174.4000111.4N189 T194 L195 F269 T311N189-I191 PolarHBondContact O-N 3.23Å; N189-I191 VanDerWaalsContact O-N 3.14Å; I191-T194 PolarHBondContact O-N 3.15Å; I191-L195 HydrophobicContact CG2-CB 4.48Å; I191-L195 WeakPolarHBondContact O-CB 3.49Å; I191-L195 PolarHBondContact O-N 3.47Å; I191-F269 HydrophobicContact CG1-CE2 4.48Å; I191-F269 HydrophobicContact CG1-CZ 4.48Å; I191-F269 HydrophobicContact CG2-CE2 3.97Å; I191-F269 HydrophobicContact CG2-CZ 3.88Å; I191-T311 HydrophobicContact CD1-CG2 4.26Å; I191-T311 HydrophobicContact CG1-CG2 4.32Å
192I95.9Very high95.2Very high20 Ų2038.4 Ų38.410%0.10319%0.189CC..Hα-helixtrans-61.5-58.7-168-55.5-58.1000112L177 L181 N189 P190 T194 L195 V196L177-I192 HydrophobicContact CD2-CD1 4.14Å; L177-I192 HydrophobicContact CD2-CG2 4.16Å; L181-I192 HydrophobicContact CB-CD1 4.14Å; L181-I192 HydrophobicContact CB-CG2 4.19Å; L181-I192 HydrophobicContact CD1-CD1 4.4Å; N189-I192 HydrophobicContact CB-CG1 4.12Å; N189-I192 PolarHBondContact O-N 3.16Å; P190-I192 VanDerWaalsContact C-N 3.33Å; P190-I192 PolarHBondContact O-N 3.15Å; I192-T194 VanDerWaalsContact C-N 3.32Å; I192-T194 PolarHBondContact O-N 3.44Å; I192-L195 PolarHBondContact O-N 2.88Å; I192-V196 WeakPolarHBondContact O-CG2 3.45Å; I192-V196 PolarHBondContact O-N 3.12Å
193F96.5Very high95.2Very high0 Ų038.6 Ų38.60%019%0.189CC..Hα-helixtrans-70.2-31.2-180-63.6-35.6000112.5G186 V196 S197 Y249 R252 A253 L256G186-F193 VanDerWaalsContact C-CE2 3.46Å; G186-F193 WeakPolarHBondContact O-CD2 3.22Å; G186-F193 VanDerWaalsContact O-CE2 3.23Å; G186-F193 WeakPolarHBondContact O-CE2 3.39Å; F193-V196 PolarHBondContact O-N 2.96Å; F193-S197 PolarHBondContact O-N 3.18Å; F193-Y249 HydrophobicContact CB-CD1 4.39Å; F193-Y249 AromaticContact CD1-CD1 3.48Å; F193-Y249 HydrophobicContact CD1-CD1 3.48Å; F193-Y249 VanDerWaalsContact CD1-CD1 3.48Å; F193-Y249 AromaticContact CD1-CE1 3.87Å; F193-Y249 HydrophobicContact CD1-CE1 3.87Å; F193-Y249 HydrophobicContact CE1-CD1 4.04Å; F193-Y249 AromaticContact CE1-CE1 3.98Å; F193-Y249 HydrophobicContact CE1-CE1 3.98Å; F193-Y249 HydrophobicContact CG-CD1 4.15Å; F193-R252 HydrophobicContact CD2-CB 3.95Å; F193-R252 HydrophobicContact CE2-CB 4.26Å; F193-R252 HydrophobicContact CG-CB 4.35Å; F193-R252 VanDerWaalsContact CZ-CZ 3.46Å; F193-A253 HydrophobicContact CB-CB 3.93Å; F193-L256 HydrophobicContact CD2-CD1 3.86Å; F193-L256 HydrophobicContact CE2-CD1 3.54Å
194T96.2Very high95.2Very high0 Ų034 Ų340%016%0.159CC..Hα-helixtrans-67.3-38.7176.7-51.20000111.6P190 I191 I192 S197 G198 L265 L266 F269P190-T194 VanDerWaalsContact O-CB 3.27Å; P190-T194 WeakPolarHBondContact O-CB 3.27Å; P190-T194 PolarHBondContact O-N 3.42Å; P190-T194 PolarHBondContact O-OG1 3.23Å; I191-T194 PolarHBondContact O-N 3.15Å; I192-T194 VanDerWaalsContact C-N 3.32Å; I192-T194 PolarHBondContact O-N 3.44Å; T194-S197 PolarHBondContact O-N 2.9Å; T194-G198 PolarHBondContact O-N 3.42Å; T194-L265 HydrophobicContact CG2-CB 3.83Å; T194-L266 HydrophobicContact CG2-CB 3.8Å; T194-L266 HydrophobicContact CG2-CD1 4.16Å; T194-L266 VanDerWaalsContact CG2-N 3.29Å; T194-F269 HydrophobicContact CG2-CD2 4.06Å
195L96.4Very high95.1Very high28 Ų2828 Ų2815%0.14714%0.142CC..Hα-helixtrans-68.5-38.5178.1-166.169.7000111.5L177 I191 I192 G198 S199 F269 F273L177-L195 HydrophobicContact CD1-CB 4.02Å; L177-L195 HydrophobicContact CD1-CD2 3.65Å; L177-L195 HydrophobicContact CD1-CG 3.85Å; L177-L195 HydrophobicContact CD2-CD2 4.05Å; L177-L195 HydrophobicContact CG-CD2 4.47Å; I191-L195 HydrophobicContact CG2-CB 4.48Å; I191-L195 WeakPolarHBondContact O-CB 3.49Å; I191-L195 PolarHBondContact O-N 3.47Å; I192-L195 PolarHBondContact O-N 2.88Å; L195-G198 PolarHBondContact O-N 3.04Å; L195-S199 VanDerWaalsContact O-CB 3.25Å; L195-S199 WeakPolarHBondContact O-CB 3.19Å; L195-S199 PolarHBondContact O-N 2.84Å; L195-S199 PolarHBondContact O-OG 3.2Å; L195-F269 HydrophobicContact CD1-CB 4.18Å; L195-F269 HydrophobicContact CD1-CD1 3.57Å; L195-F269 HydrophobicContact CD1-CD2 4Å; L195-F269 HydrophobicContact CD1-CE1 3.88Å; L195-F269 HydrophobicContact CD1-CE2 4.28Å; L195-F269 HydrophobicContact CD1-CG 3.65Å; L195-F269 HydrophobicContact CD1-CZ 4.23Å; L195-F273 HydrophobicContact CD1-CE2 3.68Å; L195-F273 HydrophobicContact CD1-CZ 4.35Å; L195-F273 HydrophobicContact CG-CE2 4.45Å
196V97.8Very high95.1Very high0 Ų023.2 Ų23.20%013%0.125CC..Hα-helixtrans-60-51171.5176.50000110.4L177 I178 I192 F193 G198 S199 I200 Y249L177-V196 HydrophobicContact CB-CG2 3.39Å; L177-V196 HydrophobicContact CD1-CG2 3.86Å; L177-V196 HydrophobicContact CG-CG2 4.26Å; I178-V196 HydrophobicContact CD1-CG1 3.87Å; I178-V196 HydrophobicContact CG1-CG1 3.93Å; I178-V196 HydrophobicContact CG1-CG2 3.98Å; I192-V196 WeakPolarHBondContact O-CG2 3.45Å; I192-V196 PolarHBondContact O-N 3.12Å; F193-V196 PolarHBondContact O-N 2.96Å; V196-G198 PolarHBondContact O-N 3.31Å; V196-S199 PolarHBondContact O-OG 2.87Å; V196-I200 HydrophobicContact CG1-CD1 3.79Å; V196-I200 WeakPolarHBondContact O-CB 3.36Å; V196-I200 WeakPolarHBondContact O-CG1 3.44Å; V196-I200 PolarHBondContact O-N 2.81Å; V196-Y249 HydrophobicContact CB-CD2 4.38Å; V196-Y249 HydrophobicContact CB-CG 4.15Å; V196-Y249 HydrophobicContact CG1-CD1 4.34Å; V196-Y249 HydrophobicContact CG1-CD2 3.41Å; V196-Y249 VanDerWaalsContact CG1-CD2 3.41Å; V196-Y249 HydrophobicContact CG1-CE2 3.94Å; V196-Y249 HydrophobicContact CG1-CG 3.66Å
197S97.9Very high95.1Very high4 Ų423.6 Ų23.63%0.02813%0.127CC..Hα-helixtrans-61.7-42.1178.6-179.70000112.5F193 T194 G201 Q246 L266F193-S197 PolarHBondContact O-N 3.18Å; T194-S197 PolarHBondContact O-N 2.9Å; S197-G201 WeakPolarHBondContact O-CA 3.38Å; S197-G201 PolarHBondContact O-N 2.94Å; S197-Q246 PolarHBondContact OG-O 3.37Å; S197-Q246 VanDerWaalsContact OG-O 3.12Å; S197-L266 WeakPolarHBondContact OG-CD1 3.39Å
198G96.9Very high95Very high0 Ų021 Ų210%012%0.123CC..Hα-helixtrans-69.6-43-177.900000112.8T194 L195 V196 G201 S202T194-G198 PolarHBondContact O-N 3.42Å; L195-G198 PolarHBondContact O-N 3.04Å; V196-G198 PolarHBondContact O-N 3.31Å; G198-G201 PolarHBondContact O-N 3.12Å; G198-S202 PolarHBondContact O-N 3.38Å; G198-S202 VanDerWaalsContact O-N 3.07Å
199S97.4Very high94.9Very high0 Ų019.1 Ų19.10%011%0.106CC..Hα-helixtrans-73.1-43.8-178.561.20000112.8V170 S174 L195 V196 G201 S202V170-S199 WeakPolarHBondContact CG1-O 3.45Å; S174-S199 PolarHBondContact OG-OG 2.59Å; L195-S199 VanDerWaalsContact O-CB 3.25Å; L195-S199 WeakPolarHBondContact O-CB 3.19Å; L195-S199 PolarHBondContact O-N 2.84Å; L195-S199 PolarHBondContact O-OG 3.2Å; V196-S199 PolarHBondContact O-OG 2.87Å; S199-G201 PolarHBondContact O-N 2.83Å; S199-S202 PolarHBondContact O-N 3.05Å; S199-S202 PolarHBondContact O-OG 3.47Å
200I97.6Very high94.9Very high17 Ų1715.8 Ų15.89%0.0879%0.089CC..Hα-helixtrans-65.8-35.1171.1-64.1176.5000110.5S174 V196 S202 L203 S204 A242 I245 Q246S174-I200 WeakPolarHBondContact OG-CG1 3.31Å; V196-I200 HydrophobicContact CG1-CD1 3.79Å; V196-I200 WeakPolarHBondContact O-CB 3.36Å; V196-I200 WeakPolarHBondContact O-CG1 3.44Å; V196-I200 PolarHBondContact O-N 2.81Å; I200-S202 VanDerWaalsContact C-N 3.3Å; I200-S202 PolarHBondContact O-N 3.26Å; I200-L203 PolarHBondContact O-N 3.46Å; I200-S204 PolarHBondContact O-N 3.44Å; I200-S204 VanDerWaalsContact O-N 3.14Å; I200-A242 HydrophobicContact CG2-CB 3.93Å; I200-I245 HydrophobicContact CD1-CB 4.17Å; I200-I245 HydrophobicContact CD1-CG2 3.35Å; I200-I245 HydrophobicContact CG2-CB 4.48Å; I200-Q246 HydrophobicContact CB-CB 4.39Å; I200-Q246 HydrophobicContact CG2-CB 4.2Å
201G96.1Very high95Very high0 Ų016.8 Ų16.80%09%0.094CC..Hα-helixtrans-52.2-43.8172.400000113.6S197 G198 S199 L203 S204 V205 Q246 F270S197-G201 WeakPolarHBondContact O-CA 3.38Å; S197-G201 PolarHBondContact O-N 2.94Å; G198-G201 PolarHBondContact O-N 3.12Å; S199-G201 PolarHBondContact O-N 2.83Å; G201-L203 VanDerWaalsContact C-N 3.33Å; G201-L203 PolarHBondContact O-N 3.46Å; G201-S204 WeakPolarHBondContact O-CB 3.48Å; G201-S204 PolarHBondContact O-N 3.44Å; G201-S204 VanDerWaalsContact O-N 3.17Å; G201-S204 PolarHBondContact O-OG 3.34Å; G201-V205 PolarHBondContact O-N 2.87Å; G201-V205 VanDerWaalsContact O-N 3.14Å; G201-Q246 VanDerWaalsContact CA-OE1 3.3Å; G201-F270 VanDerWaalsContact C-CE2 3.48Å
202S95.1Very high94.8Very high0 Ų015.3 Ų15.30%09%0.092CC..Hα-helixtrans-63.8-38.1179.270.70000113.2Y166 G198 S199 I200 S204 V205 V206 F273Y166-S202 PolarHBondContact OH-OG 3.37Å; G198-S202 PolarHBondContact O-N 3.38Å; G198-S202 VanDerWaalsContact O-N 3.07Å; S199-S202 PolarHBondContact O-N 3.05Å; S199-S202 PolarHBondContact O-OG 3.47Å; I200-S202 VanDerWaalsContact C-N 3.3Å; I200-S202 PolarHBondContact O-N 3.26Å; S202-S204 VanDerWaalsContact C-N 3.31Å; S202-S204 PolarHBondContact O-N 3.46Å; S202-V205 WeakPolarHBondContact O-CB 3.26Å; S202-V205 PolarHBondContact O-N 2.94Å; S202-V206 PolarHBondContact O-N 3.48Å; S202-V206 VanDerWaalsContact O-N 3.13Å; S202-F273 VanDerWaalsContact CB-C 3.42Å
203L95.3Very high94.5Very high9 Ų915 Ų155%0.0479%0.091CC..Hα-helixtrans-64.4-39.6175.7-59.9-177.8000110.6Y166 V170 I171 I200 G201 V205 V206 T207 W238Y166-L203 HydrophobicContact CD1-CD2 4.39Å; Y166-L203 HydrophobicContact CE1-CD2 3.78Å; V170-L203 HydrophobicContact CB-CD1 4.17Å; V170-L203 HydrophobicContact CG1-CD1 3.63Å; V170-L203 HydrophobicContact CG1-CG 3.94Å; I171-L203 HydrophobicContact CG1-CD1 4.43Å; I200-L203 PolarHBondContact O-N 3.46Å; G201-L203 VanDerWaalsContact C-N 3.33Å; G201-L203 PolarHBondContact O-N 3.46Å; L203-V205 VanDerWaalsContact C-N 3.27Å; L203-V205 PolarHBondContact O-N 3.4Å; L203-V206 PolarHBondContact O-N 2.83Å; L203-T207 PolarHBondContact O-N 2.96Å; L203-T207 PolarHBondContact O-OG1 3.31Å; L203-W238 HydrophobicContact CD1-CZ2 4.01Å
204S95.4Very high94.3Very high7 Ų715 Ų155%0.0499%0.091CC..Hα-helixtrans-58.8-38.9174.6840000112.1I200 G201 S202 T207 C208 Q246I200-S204 PolarHBondContact O-N 3.44Å; I200-S204 VanDerWaalsContact O-N 3.14Å; G201-S204 WeakPolarHBondContact O-CB 3.48Å; G201-S204 PolarHBondContact O-N 3.44Å; G201-S204 VanDerWaalsContact O-N 3.17Å; G201-S204 PolarHBondContact O-OG 3.34Å; S202-S204 VanDerWaalsContact C-N 3.31Å; S202-S204 PolarHBondContact O-N 3.46Å; S204-T207 PolarHBondContact O-N 3.13Å; S204-C208 WeakPolarHBondContact O-CB 3.42Å; S204-C208 PolarHBondContact O-N 3.23Å; S204-C208 PolarHBondContact O-SG 3.4Å; S204-Q246 PolarHBondContact OG-OE1 3.45Å
205V92.8Very high94.1Very high49 Ų4918.6 Ų18.630%0.29711%0.109SC..Hα-helixtrans-66-45178172.90000111.3G201 S202 L203 T207 C208 K209 F270 V274G201-V205 PolarHBondContact O-N 2.87Å; G201-V205 VanDerWaalsContact O-N 3.14Å; S202-V205 WeakPolarHBondContact O-CB 3.26Å; S202-V205 PolarHBondContact O-N 2.94Å; L203-V205 VanDerWaalsContact C-N 3.27Å; L203-V205 PolarHBondContact O-N 3.4Å; V205-T207 VanDerWaalsContact C-N 3.28Å; V205-T207 PolarHBondContact O-N 3.3Å; V205-C208 WeakPolarHBondContact O-CB 3.42Å; V205-C208 PolarHBondContact O-N 2.71Å; V205-K209 PolarHBondContact O-N 3.09Å; V205-F270 HydrophobicContact CG2-CE1 4.11Å; V205-F270 HydrophobicContact CG2-CE2 3.94Å; V205-F270 HydrophobicContact CG2-CZ 3.3Å; V205-V274 HydrophobicContact CB-CG2 4.09Å; V205-V274 HydrophobicContact CG1-CG1 4.12Å; V205-V274 HydrophobicContact CG1-CG2 4.35Å; V205-V274 HydrophobicContact CG2-CG2 3.91Å
206V92.5Very high93.7Very high13 Ų1323.1 Ų23.18%0.07913%0.128CC..Hα-helixtrans-60.2-42.6175.9173.60000110.8F163 S202 L203 K209 G210 A277 L281F163-V206 HydrophobicContact CE1-CG1 4.5Å; F163-V206 HydrophobicContact CE2-CG1 4.16Å; F163-V206 HydrophobicContact CE2-CG2 4.32Å; F163-V206 HydrophobicContact CZ-CB 4.33Å; F163-V206 HydrophobicContact CZ-CG1 3.66Å; F163-V206 HydrophobicContact CZ-CG2 4.37Å; S202-V206 PolarHBondContact O-N 3.48Å; S202-V206 VanDerWaalsContact O-N 3.13Å; L203-V206 PolarHBondContact O-N 2.83Å; V206-K209 WeakPolarHBondContact O-CB 3.35Å; V206-K209 PolarHBondContact O-N 2.68Å; V206-G210 PolarHBondContact O-N 3.12Å; V206-A277 HydrophobicContact CG2-CB 3.66Å; V206-L281 HydrophobicContact CG1-CD2 3.61Å
207T94Very high93.2Very high7 Ų725.1 Ų25.14%0.04314%0.139CC..Hα-helixtrans-64.8-44.3177.4-54.50000112.2L203 S204 V205 K209 G210 I211 L235 W238 L239L203-T207 PolarHBondContact O-N 2.96Å; L203-T207 PolarHBondContact O-OG1 3.31Å; S204-T207 PolarHBondContact O-N 3.13Å; V205-T207 VanDerWaalsContact C-N 3.28Å; V205-T207 PolarHBondContact O-N 3.3Å; T207-K209 VanDerWaalsContact C-N 3.26Å; T207-K209 PolarHBondContact O-N 3.06Å; T207-G210 PolarHBondContact O-N 2.71Å; T207-G210 VanDerWaalsContact O-N 3.12Å; T207-I211 HydrophobicContact CG2-CD1 4.14Å; T207-I211 WeakPolarHBondContact O-CG1 3.26Å; T207-I211 PolarHBondContact O-N 3.01Å; T207-L235 HydrophobicContact CG2-CB 3.75Å; T207-L235 HydrophobicContact CG2-CD2 3.79Å; T207-L235 HydrophobicContact CG2-CG 4.35Å; T207-L235 WeakPolarHBondContact CG2-O 3.26Å; T207-W238 HydrophobicContact CG2-CB 4.41Å; T207-L239 HydrophobicContact CG2-CB 3.76Å
208C92.6Very high93Very high61 Ų6125.1 Ų25.141%0.41214%0.139SC..Hα-helixtrans-55.7-42.8171.5-82.50000111.4S204 V205 G210 I211 G212 L239S204-C208 WeakPolarHBondContact O-CB 3.42Å; S204-C208 PolarHBondContact O-N 3.23Å; S204-C208 PolarHBondContact O-SG 3.4Å; V205-C208 WeakPolarHBondContact O-CB 3.42Å; V205-C208 PolarHBondContact O-N 2.71Å; C208-G210 VanDerWaalsContact C-N 3.34Å; C208-G210 PolarHBondContact O-N 2.92Å; C208-I211 PolarHBondContact O-N 3.43Å; C208-G212 PolarHBondContact O-N 2.68Å; C208-L239 WeakPolarHBondContact SG-CD1 3.2Å
209K89.6Confident92.7Very high52 Ų5232.2 Ų32.223%0.22617%0.17CC..Hα-helixtrans-62.1-42.6176.5-167.5173.8-177.3-175.60111.4E145 M154 V205 V206 T207 G212 V213 F282E145-K209 IonicContact OE1-NZ 3.16Å; E145-K209 IonicContact OE2-NZ 2.76Å; E145-K209 PolarHBondContact OE2-NZ 3.36Å; M154-K209 HydrophobicContact CE-CB 4.26Å; M154-K209 HydrophobicContact CE-CG 4.18Å; V205-K209 PolarHBondContact O-N 3.09Å; V206-K209 WeakPolarHBondContact O-CB 3.35Å; V206-K209 PolarHBondContact O-N 2.68Å; T207-K209 VanDerWaalsContact C-N 3.26Å; T207-K209 PolarHBondContact O-N 3.06Å; K209-G212 PolarHBondContact O-N 2.91Å; K209-V213 WeakPolarHBondContact O-CG2 3.48Å; K209-V213 PolarHBondContact O-N 3.38Å; K209-F282 HydrophobicContact CD-CE2 4.21Å; K209-F282 HydrophobicContact CD-CZ 3.91Å
210G92.1Very high92.3Very high1 Ų137.3 Ų37.31%0.0120%0.201CC..Hα-helixtrans-61.6-45.317600000112.9L151 M154 V206 T207 C208 G212 V213 G214L151-G210 VanDerWaalsContact CD2-O 3.3Å; L151-G210 WeakPolarHBondContact CD2-O 3.41Å; M154-G210 VanDerWaalsContact CE-N 3.34Å; V206-G210 PolarHBondContact O-N 3.12Å; T207-G210 PolarHBondContact O-N 2.71Å; T207-G210 VanDerWaalsContact O-N 3.12Å; C208-G210 VanDerWaalsContact C-N 3.34Å; C208-G210 PolarHBondContact O-N 2.92Å; G210-G212 VanDerWaalsContact C-N 3.33Å; G210-G212 PolarHBondContact O-N 3.26Å; G210-V213 PolarHBondContact O-N 3.1Å; G210-G214 PolarHBondContact O-N 3.34Å
211I93.4Very high91.8Very high29 Ų2941.1 Ų41.115%0.14923%0.225CC..Hα-helixtrans-61.7-43.6174.3-68.5159.4000110.5T207 C208 V213 G214 L215 F232 L235 I236 L239T207-I211 HydrophobicContact CG2-CD1 4.14Å; T207-I211 WeakPolarHBondContact O-CG1 3.26Å; T207-I211 PolarHBondContact O-N 3.01Å; C208-I211 PolarHBondContact O-N 3.43Å; I211-V213 PolarHBondContact O-N 2.89Å; I211-G214 PolarHBondContact O-N 3.25Å; I211-G214 VanDerWaalsContact O-N 3.16Å; I211-L215 WeakPolarHBondContact O-CB 3.31Å; I211-L215 PolarHBondContact O-N 2.85Å; I211-F232 HydrophobicContact CG2-CE2 4.11Å; I211-L235 HydrophobicContact CD1-CB 4.15Å; I211-L235 HydrophobicContact CG1-CB 3.83Å; I211-L235 HydrophobicContact CG1-CD1 4.35Å; I211-I236 HydrophobicContact CD1-CD1 3.68Å; I211-I236 HydrophobicContact CD1-CG1 4.33Å; I211-I236 HydrophobicContact CG1-CD1 4.13Å; I211-I236 HydrophobicContact CG2-CD1 4.38Å; I211-L239 HydrophobicContact CD1-CB 4.22Å; I211-L239 HydrophobicContact CD1-CD2 3.59Å
212G90Very high91.6Very high24 Ų2442.7 Ų42.725%0.24724%0.241CC..Hα-helixtrans-60.4-41.6177.400000113C208 K209 G210 L215 K216C208-G212 PolarHBondContact O-N 2.68Å; K209-G212 PolarHBondContact O-N 2.91Å; G210-G212 VanDerWaalsContact C-N 3.33Å; G210-G212 PolarHBondContact O-N 3.26Å; G212-L215 PolarHBondContact O-N 3.1Å; G212-K216 WeakPolarHBondContact O-CB 3.44Å; G212-K216 PolarHBondContact O-N 3.02Å
213V89.3Confident91.4Very high14 Ų1447 Ų479%0.08526%0.26CS..Hα-helixtrans-62.9-43.5173.3170.90000110.8L148 K209 G210 I211 K216 N217L148-V213 HydrophobicContact CB-CG1 4.15Å; L148-V213 HydrophobicContact CB-CG2 4.03Å; K209-V213 WeakPolarHBondContact O-CG2 3.48Å; K209-V213 PolarHBondContact O-N 3.38Å; G210-V213 PolarHBondContact O-N 3.1Å; I211-V213 PolarHBondContact O-N 2.89Å; V213-K216 PolarHBondContact O-N 3.06Å; V213-N217 WeakPolarHBondContact O-CB 3.33Å; V213-N217 PolarHBondContact O-N 3.46Å
214G91.5Very high91.2Very high0 Ų051 Ų510%029%0.288CS..Hα-helixtrans-61.4-43.9175.700000113.2L151 G210 I211 N217 A218L151-G214 VanDerWaalsContact CG-CA 3.48Å; G210-G214 PolarHBondContact O-N 3.34Å; I211-G214 PolarHBondContact O-N 3.25Å; I211-G214 VanDerWaalsContact O-N 3.16Å; G214-N217 PolarHBondContact O-N 3.38Å; G214-A218 WeakPolarHBondContact O-CB 3.42Å; G214-A218 PolarHBondContact O-N 3.29Å
215L91.8Very high90.7Very high75 Ų7554 Ų5439%0.39331%0.308SS..Hα-helixtrans-65.6-42.5177.4-174.663.5000111.6I211 G212 N217 A218 F219 F223 M226I211-L215 WeakPolarHBondContact O-CB 3.31Å; I211-L215 PolarHBondContact O-N 2.85Å; G212-L215 PolarHBondContact O-N 3.1Å; L215-N217 PolarHBondContact O-N 2.95Å; L215-A218 WeakPolarHBondContact O-CB 3.44Å; L215-A218 PolarHBondContact O-N 2.88Å; L215-A218 VanDerWaalsContact O-N 3.17Å; L215-F219 HydrophobicContact CD1-CD2 4.43Å; L215-F219 HydrophobicContact CD1-CE2 3.86Å; L215-F219 HydrophobicContact CD1-CZ 4.36Å; L215-F219 HydrophobicContact CD2-CE2 4.16Å; L215-F219 HydrophobicContact CG-CD2 4.13Å; L215-F219 HydrophobicContact CG-CE2 3.66Å; L215-F219 WeakPolarHBondContact O-CD2 3.21Å; L215-F219 PolarHBondContact O-N 2.95Å; L215-F223 HydrophobicContact CD1-CE1 3.93Å; L215-M226 HydrophobicContact CD1-SD 4.48Å
216K88.4Confident90.6Very high123 Ų12352.2 Ų52.254%0.53530%0.296SS..Hα-helixtrans-59.5-46.4174.6-177.4-176.4175.8-172.20111.2G212 V213 A218 F219 T220G212-K216 WeakPolarHBondContact O-CB 3.44Å; G212-K216 PolarHBondContact O-N 3.02Å; V213-K216 PolarHBondContact O-N 3.06Å; K216-A218 VanDerWaalsContact C-N 3.27Å; K216-A218 PolarHBondContact O-N 2.88Å; K216-F219 PolarHBondContact O-N 3.15Å; K216-T220 PolarHBondContact O-N 3.04Å; K216-T220 PolarHBondContact O-OG1 3.13Å
217N88.7Confident90.6Very high43 Ų4356.3 Ų56.323%0.2331%0.314CS..Hα-helixtrans-64.8-33.2176.7-171.744.3000112.1V213 G214 L215 T220 V221V213-N217 WeakPolarHBondContact O-CB 3.33Å; V213-N217 PolarHBondContact O-N 3.46Å; G214-N217 PolarHBondContact O-N 3.38Å; L215-N217 PolarHBondContact O-N 2.95Å; N217-T220 WeakPolarHBondContact CA-OG1 2.93Å; N217-T220 PolarHBondContact O-N 2.73Å; N217-T220 PolarHBondContact O-OG1 2.84Å; N217-V221 PolarHBondContact O-N 3.39Å; N217-V221 WeakPolarHBondContact OD1-CG2 3.37Å
218A91.8Very high90.5Very high3 Ų361.7 Ų61.73%0.02535%0.346CS..Hα-helixtrans-66.3-36.6175.500000112.6G214 L215 K216 T220 G222 F223 M226G214-A218 WeakPolarHBondContact O-CB 3.42Å; G214-A218 PolarHBondContact O-N 3.29Å; L215-A218 WeakPolarHBondContact O-CB 3.44Å; L215-A218 PolarHBondContact O-N 2.88Å; L215-A218 VanDerWaalsContact O-N 3.17Å; K216-A218 VanDerWaalsContact C-N 3.27Å; K216-A218 PolarHBondContact O-N 2.88Å; A218-T220 PolarHBondContact O-N 3.42Å; A218-G222 WeakPolarHBondContact CA-O 3.4Å; A218-G222 CarbonylContact O-C 3.46Å; A218-G222 WeakPolarHBondContact O-CA 3.21Å; A218-G222 PolarHBondContact O-N 3.43Å; A218-F223 HydrophobicContact CB-CD1 3.8Å; A218-F223 HydrophobicContact CB-CE1 4.03Å; A218-F223 HydrophobicContact CB-CG 4.2Å; A218-M226 HydrophobicContact CB-CB 4.07Å; A218-M226 HydrophobicContact CB-CG 4.47Å; A218-M226 HydrophobicContact CB-SD 3.74Å
219F90.5Very high90.4Very high149 Ų14960.3 Ų60.365%0.65434%0.337SS*.Hα-helixtrans-66.9-24.9174.2-77-63.2000113.3L215 K216 F223L215-F219 HydrophobicContact CD1-CD2 4.43Å; L215-F219 HydrophobicContact CD1-CE2 3.86Å; L215-F219 HydrophobicContact CD1-CZ 4.36Å; L215-F219 HydrophobicContact CD2-CE2 4.16Å; L215-F219 HydrophobicContact CG-CD2 4.13Å; L215-F219 HydrophobicContact CG-CE2 3.66Å; L215-F219 WeakPolarHBondContact O-CD2 3.21Å; L215-F219 PolarHBondContact O-N 2.95Å; K216-F219 PolarHBondContact O-N 3.15Å; F219-F223 HydrophobicContact CD1-CE2 4.44Å; F219-F223 HydrophobicContact CD1-CZ 4.09Å; F219-F223 HydrophobicContact CE1-CE2 4.44Å; F219-F223 AromaticContact CE1-CZ 3.82Å; F219-F223 HydrophobicContact CE1-CZ 3.82Å; F219-F223 HydrophobicContact CZ-CZ 4.23Å
220T89.4Confident90.6Very high107 Ų10765.5 Ų65.566%0.65636%0.356SS*.Hα-helixtrans-93.5-38.9-179.450.30000113.6K216 N217 A218K216-T220 PolarHBondContact O-N 3.04Å; K216-T220 PolarHBondContact O-OG1 3.13Å; N217-T220 WeakPolarHBondContact CA-OG1 2.93Å; N217-T220 PolarHBondContact O-N 2.73Å; N217-T220 PolarHBondContact O-OG1 2.84Å; A218-T220 PolarHBondContact O-N 3.42Å
221V88.5Confident90.7Very high98 Ų9865.9 Ų65.959%0.59436%0.357SS*.Hα-helixtrans-109.5-12.2-173.3-171.80000112.4N217N217-V221 PolarHBondContact O-N 3.39Å; N217-V221 WeakPolarHBondContact OD1-CG2 3.37Å
222G90Very high90.7Very high32 Ų3265.2 Ų65.233%0.3335%0.353SS..  trans104.8160.8-174.200000112.9A218 P225A218-G222 WeakPolarHBondContact CA-O 3.4Å; A218-G222 CarbonylContact O-C 3.46Å; A218-G222 WeakPolarHBondContact O-CA 3.21Å; A218-G222 PolarHBondContact O-N 3.43Å; G222-P225 WeakPolarHBondContact O-CD 3.36Å
223F91.8Very high91Very high91 Ų9170.2 Ų70.240%0.39937%0.365SS..SBendtrans-79.2-23.7-173-73.7-90000114.7L215 A218 F219 M226 F227L215-F223 HydrophobicContact CD1-CE1 3.93Å; A218-F223 HydrophobicContact CB-CD1 3.8Å; A218-F223 HydrophobicContact CB-CE1 4.03Å; A218-F223 HydrophobicContact CB-CG 4.2Å; F219-F223 HydrophobicContact CD1-CE2 4.44Å; F219-F223 HydrophobicContact CD1-CZ 4.09Å; F219-F223 HydrophobicContact CE1-CE2 4.44Å; F219-F223 AromaticContact CE1-CZ 3.82Å; F219-F223 HydrophobicContact CE1-CZ 3.82Å; F219-F223 HydrophobicContact CZ-CZ 4.23Å; F223-M226 HydrophobicContact CD1-CE 4.04Å; F223-M226 WeakPolarHBondContact O-CB 3.47Å; F223-M226 PolarHBondContact O-N 2.52Å; F223-M226 VanDerWaalsContact O-N 3.16Å; F223-F227 HydrophobicContact CB-CD2 4.16Å; F223-F227 HydrophobicContact CB-CE2 3.88Å; F223-F227 HydrophobicContact CD1-CE2 4.15Å; F223-F227 HydrophobicContact CD1-CZ 4.35Å; F223-F227 HydrophobicContact CG-CE2 4.42Å; F223-F227 WeakPolarHBondContact O-CD2 3.48Å; F223-F227 PolarHBondContact O-N 3.17Å
224S90.3Very high91.3Very high92 Ų9273.8 Ų73.864%0.64338%0.379SS*.Hα-helixtrans-57.5-48.1-175.8-64.30000113.7M226 F227 T228S224-M226 VanDerWaalsContact C-N 3.25Å; S224-M226 PolarHBondContact O-N 2.65Å; S224-F227 PolarHBondContact O-N 3.27Å; S224-T228 PolarHBondContact O-N 3.07Å; S224-T228 PolarHBondContact O-OG1 2.51Å
225P86.9Confident91.5Very high71 Ų7174.3 Ų74.346%0.46138%0.382SS..Hα-helixtrans-61.4-31.8178.3-23.334.7000113.8G222 S229G222-P225 WeakPolarHBondContact O-CD 3.36Å; P225-S229 PolarHBondContact O-N 3.16Å
226M90.4Very high91.7Very high11 Ų1173 Ų735%0.05438%0.375CS..Hα-helixtrans-66.9-49178.2-174.1-172.679.400111L151 L215 A218 F223 S224 S229 F232L151-M226 HydrophobicContact CD1-CG 4.17Å; L215-M226 HydrophobicContact CD1-SD 4.48Å; A218-M226 HydrophobicContact CB-CB 4.07Å; A218-M226 HydrophobicContact CB-CG 4.47Å; A218-M226 HydrophobicContact CB-SD 3.74Å; F223-M226 HydrophobicContact CD1-CE 4.04Å; F223-M226 WeakPolarHBondContact O-CB 3.47Å; F223-M226 PolarHBondContact O-N 2.52Å; F223-M226 VanDerWaalsContact O-N 3.16Å; S224-M226 VanDerWaalsContact C-N 3.25Å; S224-M226 PolarHBondContact O-N 2.65Å; M226-S229 WeakPolarHBondContact O-CB 3.25Å; M226-S229 PolarHBondContact O-N 3.39Å; M226-F232 HydrophobicContact CE-CE1 4.13Å; M226-F232 HydrophobicContact CE-CE2 4.04Å; M226-F232 HydrophobicContact CE-CZ 3.7Å; M226-F232 HydrophobicContact CG-CD1 4.46Å; M226-F232 HydrophobicContact CG-CD2 3.75Å; M226-F232 HydrophobicContact CG-CE2 3.88Å; M226-F232 HydrophobicContact CG-CG 4.06Å; M226-F232 HydrophobicContact CG-CZ 4.32Å; M226-F232 WeakPolarHBondContact O-CB 3.49Å; M226-F232 HydrophobicContact SD-CD2 4.21Å; M226-F232 HydrophobicContact SD-CE2 3.72Å; M226-F232 HydrophobicContact SD-CZ 4.04Å
227F91.6Very high92.1Very high100 Ų10073 Ų7344%0.43938%0.38SS..Hα-helixtrans-73.4-25.5-178.2-66.2-49000113.8F223 S224 S229 F232 W233F223-F227 HydrophobicContact CB-CD2 4.16Å; F223-F227 HydrophobicContact CB-CE2 3.88Å; F223-F227 HydrophobicContact CD1-CE2 4.15Å; F223-F227 HydrophobicContact CD1-CZ 4.35Å; F223-F227 HydrophobicContact CG-CE2 4.42Å; F223-F227 WeakPolarHBondContact O-CD2 3.48Å; F223-F227 PolarHBondContact O-N 3.17Å; S224-F227 PolarHBondContact O-N 3.27Å; F227-S229 VanDerWaalsContact C-N 3.3Å; F227-F232 HydrophobicContact CD1-CD1 4.45Å; F227-F232 HydrophobicContact CD1-CE1 4.02Å; F227-F232 HydrophobicContact CE1-CE1 4.09Å; F227-W233 HydrophobicContact CD1-CZ2 4.14Å; F227-W233 PolarHBondContact O-NE1 3.49Å
228T91.5Very high92.5Very high119 Ų11975.3 Ų75.373%0.7339%0.385SS*.Hα-helixtrans-73.7-22.6173.7-57.30000112.3S224 W230S224-T228 PolarHBondContact O-N 3.07Å; S224-T228 PolarHBondContact O-OG1 2.51Å; T228-W230 PolarHBondContact O-N 3.33Å
229S90.4Very high92.7Very high32 Ų3276.3 Ų76.322%0.22439%0.39CS..  trans-72.2115.3179.6-176.90000111.5P225 M226 F227 F231 F232P225-S229 PolarHBondContact O-N 3.16Å; M226-S229 WeakPolarHBondContact O-CB 3.25Å; M226-S229 PolarHBondContact O-N 3.39Å; F227-S229 VanDerWaalsContact C-N 3.3Å; S229-F231 PolarHBondContact O-N 3.4Å; S229-F232 WeakPolarHBondContact O-CB 3.24Å; S229-F232 PolarHBondContact O-N 3.12Å; S229-F232 VanDerWaalsContact O-N 3.16Å
230W94Very high93.1Very high162 Ų16274.2 Ų74.261%0.61438%0.384SS*.Hα-helixtrans-59.3-32.6174.979.9-86.7000112.3W155 T228 F232 W233 F234W155-W230 AromaticContact CH2-CH2 3.68Å; W155-W230 HydrophobicContact CH2-CH2 3.68Å; W155-W230 AromaticContact CH2-CZ2 3.59Å; W155-W230 HydrophobicContact CH2-CZ2 3.59Å; W155-W230 HydrophobicContact CZ2-CH2 4.48Å; W155-W230 AromaticContact CZ2-CZ2 3.97Å; W155-W230 HydrophobicContact CZ2-CZ2 3.97Å; W155-W230 AromaticContact CZ3-CH2 3.91Å; W155-W230 HydrophobicContact CZ3-CH2 3.91Å; W155-W230 AromaticContact CZ3-CZ2 3.93Å; W155-W230 HydrophobicContact CZ3-CZ2 3.93Å; T228-W230 PolarHBondContact O-N 3.33Å; W230-F232 VanDerWaalsContact C-N 3.3Å; W230-F232 PolarHBondContact O-N 3.43Å; W230-W233 PolarHBondContact O-N 3Å; W230-F234 HydrophobicContact CE3-CB 4.3Å; W230-F234 HydrophobicContact CZ3-CB 4.16Å; W230-F234 HydrophobicContact CZ3-CG 4.42Å; W230-F234 PolarHBondContact O-N 3.26Å
231F94.2Very high93.4Very high8 Ų870.5 Ų70.54%0.03537%0.368CS..Hα-helixtrans-64.5-34179.3-179.6-126000112.1M154 W155 A158 S229 W233 F234 L235M154-F231 HydrophobicContact CB-CE1 4.3Å; M154-F231 HydrophobicContact CG-CE1 4.04Å; M154-F231 HydrophobicContact CG-CZ 4.42Å; W155-F231 HydrophobicContact CB-CD1 3.92Å; W155-F231 HydrophobicContact CB-CE1 3.93Å; W155-F231 HydrophobicContact CB-CG 4.4Å; W155-F231 HydrophobicContact CB-CZ 4.43Å; W155-F231 HydrophobicContact CD2-CD2 4.36Å; W155-F231 HydrophobicContact CD2-CG 4.49Å; W155-F231 HydrophobicContact CE3-CB 4.48Å; W155-F231 HydrophobicContact CE3-CD1 4.31Å; W155-F231 AromaticContact CE3-CD2 3.29Å; W155-F231 HydrophobicContact CE3-CD2 3.29Å; W155-F231 HydrophobicContact CE3-CE1 4.37Å; W155-F231 AromaticContact CE3-CE2 3.39Å; W155-F231 HydrophobicContact CE3-CE2 3.39Å; W155-F231 AromaticContact CE3-CG 3.79Å; W155-F231 HydrophobicContact CE3-CG 3.79Å; W155-F231 AromaticContact CE3-CZ 3.94Å; W155-F231 HydrophobicContact CE3-CZ 3.94Å; W155-F231 AromaticContact CZ3-CD2 3.66Å; W155-F231 HydrophobicContact CZ3-CD2 3.66Å; W155-F231 AromaticContact CZ3-CE2 3.82Å; W155-F231 HydrophobicContact CZ3-CE2 3.82Å; W155-F231 HydrophobicContact CZ3-CG 4.48Å; A158-F231 HydrophobicContact CB-CZ 4.26Å; S229-F231 PolarHBondContact O-N 3.4Å; F231-W233 PolarHBondContact O-N 2.95Å; F231-F234 AromaticContact CD2-CD1 3.85Å; F231-F234 HydrophobicContact CD2-CD1 3.85Å; F231-F234 AromaticContact CE2-CD1 3.86Å; F231-F234 HydrophobicContact CE2-CD1 3.86Å; F231-F234 HydrophobicContact CE2-CE1 4.27Å; F231-F234 WeakPolarHBondContact O-CB 3.48Å; F231-F234 PolarHBondContact O-N 2.84Å; F231-L235 HydrophobicContact CD1-CD1 4.2Å; F231-L235 HydrophobicContact CD2-CG 4.34Å; F231-L235 HydrophobicContact CE1-CD1 3.8Å; F231-L235 HydrophobicContact CE1-CD2 4.44Å; F231-L235 HydrophobicContact CE1-CG 4.23Å; F231-L235 HydrophobicContact CE2-CD1 4.44Å; F231-L235 HydrophobicContact CE2-CD2 3.82Å; F231-L235 HydrophobicContact CE2-CG 3.98Å; F231-L235 HydrophobicContact CZ-CD1 3.94Å; F231-L235 HydrophobicContact CZ-CD2 3.73Å; F231-L235 HydrophobicContact CZ-CG 3.94Å; F231-L235 WeakPolarHBondContact O-CG 3.41Å; F231-L235 PolarHBondContact O-N 2.92Å
232F94.4Very high93.9Very high16 Ų1666.2 Ų66.27%0.0734%0.342CS..Hα-helixtrans-60.6-46.6174.9175.6-100000111.6L151 I211 M226 F227 S229 W230 L235 I236L151-F232 HydrophobicContact CD1-CB 4.08Å; L151-F232 HydrophobicContact CD1-CD2 4.32Å; I211-F232 HydrophobicContact CG2-CE2 4.11Å; M226-F232 HydrophobicContact CE-CE1 4.13Å; M226-F232 HydrophobicContact CE-CE2 4.04Å; M226-F232 HydrophobicContact CE-CZ 3.7Å; M226-F232 HydrophobicContact CG-CD1 4.46Å; M226-F232 HydrophobicContact CG-CD2 3.75Å; M226-F232 HydrophobicContact CG-CE2 3.88Å; M226-F232 HydrophobicContact CG-CG 4.06Å; M226-F232 HydrophobicContact CG-CZ 4.32Å; M226-F232 WeakPolarHBondContact O-CB 3.49Å; M226-F232 HydrophobicContact SD-CD2 4.21Å; M226-F232 HydrophobicContact SD-CE2 3.72Å; M226-F232 HydrophobicContact SD-CZ 4.04Å; F227-F232 HydrophobicContact CD1-CD1 4.45Å; F227-F232 HydrophobicContact CD1-CE1 4.02Å; F227-F232 HydrophobicContact CE1-CE1 4.09Å; S229-F232 WeakPolarHBondContact O-CB 3.24Å; S229-F232 PolarHBondContact O-N 3.12Å; S229-F232 VanDerWaalsContact O-N 3.16Å; W230-F232 VanDerWaalsContact C-N 3.3Å; W230-F232 PolarHBondContact O-N 3.43Å; F232-L235 PolarHBondContact O-N 2.69Å; F232-I236 HydrophobicContact CE1-CG1 4.16Å; F232-I236 HydrophobicContact CZ-CD1 4.3Å; F232-I236 HydrophobicContact CZ-CG1 4.21Å; F232-I236 WeakPolarHBondContact O-CG1 3.4Å; F232-I236 PolarHBondContact O-N 3.3Å; F232-I236 VanDerWaalsContact O-N 3.09Å
233W95Very high94.2Very high129 Ų12967.2 Ų67.249%0.48934%0.339SS..Hα-helixtrans-66.3-38177.3-67.5106.8000112.6F227 W230 F231 L235 I236 I237F227-W233 HydrophobicContact CD1-CZ2 4.14Å; F227-W233 PolarHBondContact O-NE1 3.49Å; W230-W233 PolarHBondContact O-N 3Å; F231-W233 PolarHBondContact O-N 2.95Å; W233-L235 VanDerWaalsContact C-N 3.34Å; W233-L235 PolarHBondContact O-N 3.02Å; W233-I236 PolarHBondContact O-N 3.32Å; W233-I237 WeakPolarHBondContact O-CG1 3.4Å; W233-I237 PolarHBondContact O-N 3.37Å
234F95.6Very high94.4Very high88 Ų8867 Ų6739%0.38635%0.346SS..Hα-helixtrans-57.1-46.8171.7169.9-98.4000111.5W230 F231 I236 I237 W238W230-F234 HydrophobicContact CE3-CB 4.3Å; W230-F234 HydrophobicContact CZ3-CB 4.16Å; W230-F234 HydrophobicContact CZ3-CG 4.42Å; W230-F234 PolarHBondContact O-N 3.26Å; F231-F234 AromaticContact CD2-CD1 3.85Å; F231-F234 HydrophobicContact CD2-CD1 3.85Å; F231-F234 AromaticContact CE2-CD1 3.86Å; F231-F234 HydrophobicContact CE2-CD1 3.86Å; F231-F234 HydrophobicContact CE2-CE1 4.27Å; F231-F234 WeakPolarHBondContact O-CB 3.48Å; F231-F234 PolarHBondContact O-N 2.84Å; F234-I236 VanDerWaalsContact C-N 3.33Å; F234-I236 PolarHBondContact O-N 3.49Å; F234-I237 PolarHBondContact O-N 3.47Å; F234-W238 HydrophobicContact CZ-CE3 4.3Å; F234-W238 WeakPolarHBondContact O-CB 3.29Å; F234-W238 PolarHBondContact O-N 3.45Å
235L95.9Very high94.7Very high12 Ų1266.1 Ų66.16%0.06333%0.333CS..Hα-helixtrans-60.8-40.1176.8-68176.5000112L151 T207 I211 F231 F232 W233 W238 L239L151-L235 HydrophobicContact CD2-CD1 4.37Å; T207-L235 HydrophobicContact CG2-CB 3.75Å; T207-L235 HydrophobicContact CG2-CD2 3.79Å; T207-L235 HydrophobicContact CG2-CG 4.35Å; T207-L235 WeakPolarHBondContact CG2-O 3.26Å; I211-L235 HydrophobicContact CD1-CB 4.15Å; I211-L235 HydrophobicContact CG1-CB 3.83Å; I211-L235 HydrophobicContact CG1-CD1 4.35Å; F231-L235 HydrophobicContact CD1-CD1 4.2Å; F231-L235 HydrophobicContact CD2-CG 4.34Å; F231-L235 HydrophobicContact CE1-CD1 3.8Å; F231-L235 HydrophobicContact CE1-CD2 4.44Å; F231-L235 HydrophobicContact CE1-CG 4.23Å; F231-L235 HydrophobicContact CE2-CD1 4.44Å; F231-L235 HydrophobicContact CE2-CD2 3.82Å; F231-L235 HydrophobicContact CE2-CG 3.98Å; F231-L235 HydrophobicContact CZ-CD1 3.94Å; F231-L235 HydrophobicContact CZ-CD2 3.73Å; F231-L235 HydrophobicContact CZ-CG 3.94Å; F231-L235 WeakPolarHBondContact O-CG 3.41Å; F231-L235 PolarHBondContact O-N 2.92Å; F232-L235 PolarHBondContact O-N 2.69Å; W233-L235 VanDerWaalsContact C-N 3.34Å; W233-L235 PolarHBondContact O-N 3.02Å; L235-W238 PolarHBondContact O-N 3.19Å; L235-L239 VanDerWaalsContact O-CB 3.25Å; L235-L239 WeakPolarHBondContact O-CB 3.5Å; L235-L239 PolarHBondContact O-N 3.31Å
236I96.4Very high95.2Very high47 Ų4763.9 Ų63.924%0.24132%0.316CS..Hα-helixtrans-63.1-47.9177.7-67-71.3000111.6I211 F232 W233 F234 W238 L239 I240I211-I236 HydrophobicContact CD1-CD1 3.68Å; I211-I236 HydrophobicContact CD1-CG1 4.33Å; I211-I236 HydrophobicContact CG1-CD1 4.13Å; I211-I236 HydrophobicContact CG2-CD1 4.38Å; F232-I236 HydrophobicContact CE1-CG1 4.16Å; F232-I236 HydrophobicContact CZ-CD1 4.3Å; F232-I236 HydrophobicContact CZ-CG1 4.21Å; F232-I236 WeakPolarHBondContact O-CG1 3.4Å; F232-I236 PolarHBondContact O-N 3.3Å; F232-I236 VanDerWaalsContact O-N 3.09Å; W233-I236 PolarHBondContact O-N 3.32Å; F234-I236 VanDerWaalsContact C-N 3.33Å; F234-I236 PolarHBondContact O-N 3.49Å; I236-W238 VanDerWaalsContact C-N 3.32Å; I236-W238 PolarHBondContact O-N 3Å; I236-L239 PolarHBondContact O-N 2.9Å; I236-I240 HydrophobicContact CG2-CD1 3.95Å; I236-I240 WeakPolarHBondContact O-CG1 3.15Å; I236-I240 PolarHBondContact O-N 3.35Å
237I97.2Very high95.5Very high124 Ų12463.9 Ų63.964%0.63632%0.316SS*.Hα-helixtrans-62.1-44.9179-67168.1000110.2W233 F234 L239 I240 G241W233-I237 WeakPolarHBondContact O-CG1 3.4Å; W233-I237 PolarHBondContact O-N 3.37Å; F234-I237 PolarHBondContact O-N 3.47Å; I237-L239 VanDerWaalsContact C-N 3.35Å; I237-L239 PolarHBondContact O-N 2.6Å; I237-I240 PolarHBondContact O-N 3.39Å; I237-G241 PolarHBondContact O-N 2.99Å
238W96.3Very high95.8Very high90 Ų9061.9 Ų61.934%0.34131%0.306SS..Hα-helixtrans-60.6-44.5177.1-174.3-89.6000111.9I171 L203 T207 F234 L235 I236 I240 G241 A242I171-W238 HydrophobicContact CD1-CH2 3.79Å; I171-W238 HydrophobicContact CD1-CZ2 4.36Å; I171-W238 HydrophobicContact CG1-CH2 4.38Å; L203-W238 HydrophobicContact CD1-CZ2 4.01Å; T207-W238 HydrophobicContact CG2-CB 4.41Å; F234-W238 HydrophobicContact CZ-CE3 4.3Å; F234-W238 WeakPolarHBondContact O-CB 3.29Å; F234-W238 PolarHBondContact O-N 3.45Å; L235-W238 PolarHBondContact O-N 3.19Å; I236-W238 VanDerWaalsContact C-N 3.32Å; I236-W238 PolarHBondContact O-N 3Å; W238-I240 PolarHBondContact O-N 2.83Å; W238-G241 PolarHBondContact O-N 3.4Å; W238-A242 WeakPolarHBondContact O-CB 3.31Å; W238-A242 PolarHBondContact O-N 3.3Å
239L97.1Very high96.1Very high25 Ų2557.2 Ų57.213%0.13128%0.276CS..Hα-helixtrans-60.6-46.4179.2-179.359.9000111.6T207 C208 I211 L235 I236 I237 G241 A242 I243T207-L239 HydrophobicContact CG2-CB 3.76Å; C208-L239 WeakPolarHBondContact SG-CD1 3.2Å; I211-L239 HydrophobicContact CD1-CB 4.22Å; I211-L239 HydrophobicContact CD1-CD2 3.59Å; L235-L239 VanDerWaalsContact O-CB 3.25Å; L235-L239 WeakPolarHBondContact O-CB 3.5Å; L235-L239 PolarHBondContact O-N 3.31Å; I236-L239 PolarHBondContact O-N 2.9Å; I237-L239 VanDerWaalsContact C-N 3.35Å; I237-L239 PolarHBondContact O-N 2.6Å; L239-G241 VanDerWaalsContact C-N 3.34Å; L239-G241 PolarHBondContact O-N 2.63Å; L239-A242 PolarHBondContact O-N 3.43Å; L239-I243 HydrophobicContact CD1-CD1 3.71Å; L239-I243 HydrophobicContact CD1-CG1 3.99Å; L239-I243 HydrophobicContact CD2-CD1 4.46Å; L239-I243 HydrophobicContact CG-CD1 3.81Å; L239-I243 HydrophobicContact CG-CG1 4.41Å; L239-I243 WeakPolarHBondContact O-CB 3.33Å; L239-I243 WeakPolarHBondContact O-CG1 3.39Å; L239-I243 PolarHBondContact O-N 3.47Å
240I97.4Very high96.4Very high104 Ų10456 Ų5653%0.53327%0.267SS..Hα-helixtrans-61.7-44.8178.5-66.9166.7000110.3I236 I237 W238 T244I236-I240 HydrophobicContact CG2-CD1 3.95Å; I236-I240 WeakPolarHBondContact O-CG1 3.15Å; I236-I240 PolarHBondContact O-N 3.35Å; I237-I240 PolarHBondContact O-N 3.39Å; W238-I240 PolarHBondContact O-N 2.83Å; I240-T244 WeakPolarHBondContact O-CB 3.36Å; I240-T244 PolarHBondContact O-N 3.47Å; I240-T244 PolarHBondContact O-OG1 3.42Å
241G97.5Very high96.6Very high30 Ų3048.4 Ų48.431%0.30924%0.238SC..Hα-helixtrans-60-48.717600000112.3I237 W238 L239 T244 I245I237-G241 PolarHBondContact O-N 2.99Å; W238-G241 PolarHBondContact O-N 3.4Å; L239-G241 VanDerWaalsContact C-N 3.34Å; L239-G241 PolarHBondContact O-N 2.63Å; G241-T244 PolarHBondContact O-N 3Å; G241-I245 VanDerWaalsContact O-CG1 3.29Å; G241-I245 WeakPolarHBondContact O-CG1 3.44Å; G241-I245 PolarHBondContact O-N 3.27Å
242A97.4Very high96.7Very high7 Ų749.7 Ų49.76%0.05824%0.242CC..Hα-helixtrans-62.3-47.8179.800000112.1I200 W238 L239 T244 I245 Q246I200-A242 HydrophobicContact CG2-CB 3.93Å; W238-A242 WeakPolarHBondContact O-CB 3.31Å; W238-A242 PolarHBondContact O-N 3.3Å; L239-A242 PolarHBondContact O-N 3.43Å; A242-T244 VanDerWaalsContact C-N 3.3Å; A242-T244 PolarHBondContact O-N 3.41Å; A242-I245 PolarHBondContact O-N 2.95Å; A242-Q246 WeakPolarHBondContact O-CB 3.22Å; A242-Q246 WeakPolarHBondContact O-CG 3.2Å; A242-Q246 PolarHBondContact O-N 2.93Å; A242-Q246 PolarHBondContact O-OE1 3.35Å
243I96.5Very high96.8Very high53 Ų5348.9 Ų48.927%0.27224%0.239SC..Hα-helixtrans-60-41.7176.1-69.7174.1000110.6F75 L239 Q246 M247F75-I243 HydrophobicContact CE2-CG2 4.34Å; F75-I243 HydrophobicContact CZ-CG2 4.22Å; L239-I243 HydrophobicContact CD1-CD1 3.71Å; L239-I243 HydrophobicContact CD1-CG1 3.99Å; L239-I243 HydrophobicContact CD2-CD1 4.46Å; L239-I243 HydrophobicContact CG-CD1 3.81Å; L239-I243 HydrophobicContact CG-CG1 4.41Å; L239-I243 WeakPolarHBondContact O-CB 3.33Å; L239-I243 WeakPolarHBondContact O-CG1 3.39Å; L239-I243 PolarHBondContact O-N 3.47Å; I243-Q246 WeakPolarHBondContact O-CG 3.37Å; I243-M247 WeakPolarHBondContact O-CB 3.44Å; I243-M247 PolarHBondContact O-N 2.91Å
244T97Very high96.9Very high88 Ų8842.8 Ų42.854%0.5422%0.216SC..Hα-helixtrans-63.7-49.2179.6-57.10000111.1I240 G241 A242 M247 Y248I240-T244 WeakPolarHBondContact O-CB 3.36Å; I240-T244 PolarHBondContact O-N 3.47Å; I240-T244 PolarHBondContact O-OG1 3.42Å; G241-T244 PolarHBondContact O-N 3Å; A242-T244 VanDerWaalsContact C-N 3.3Å; A242-T244 PolarHBondContact O-N 3.41Å; T244-M247 PolarHBondContact O-N 3.26Å; T244-Y248 WeakPolarHBondContact O-CB 3.23Å; T244-Y248 PolarHBondContact O-N 3.07Å
245I96.9Very high97Very high73 Ų7339.5 Ų39.537%0.37420%0.203SC..Hα-helixtrans-67.3-48.3-178.2-60.9163.4000110.7I200 G241 A242 M247 Y248 Y249I200-I245 HydrophobicContact CD1-CB 4.17Å; I200-I245 HydrophobicContact CD1-CG2 3.35Å; I200-I245 HydrophobicContact CG2-CB 4.48Å; G241-I245 VanDerWaalsContact O-CG1 3.29Å; G241-I245 WeakPolarHBondContact O-CG1 3.44Å; G241-I245 PolarHBondContact O-N 3.27Å; A242-I245 PolarHBondContact O-N 2.95Å; I245-M247 VanDerWaalsContact C-N 3.28Å; I245-M247 PolarHBondContact O-N 2.78Å; I245-Y248 WeakPolarHBondContact O-CB 3.49Å; I245-Y248 PolarHBondContact O-N 3.15Å; I245-Y249 HydrophobicContact CG2-CD2 3.82Å; I245-Y249 HydrophobicContact CG2-CE2 3.86Å; I245-Y249 VanDerWaalsContact O-CD2 3.31Å; I245-Y249 WeakPolarHBondContact O-CD2 3.27Å; I245-Y249 PolarHBondContact O-N 2.8Å; I245-Y249 VanDerWaalsContact O-N 3.1Å
246Q97.1Very high96.9Very high23 Ų2341.5 Ų41.511%0.10721%0.213CC..Hα-helixtrans-61.5-40.7-179.782-167.141.200110.7S197 I200 G201 S204 A242 I243 Y249 L250S197-Q246 PolarHBondContact OG-O 3.37Å; S197-Q246 VanDerWaalsContact OG-O 3.12Å; I200-Q246 HydrophobicContact CB-CB 4.39Å; I200-Q246 HydrophobicContact CG2-CB 4.2Å; G201-Q246 VanDerWaalsContact CA-OE1 3.3Å; S204-Q246 PolarHBondContact OG-OE1 3.45Å; A242-Q246 WeakPolarHBondContact O-CB 3.22Å; A242-Q246 WeakPolarHBondContact O-CG 3.2Å; A242-Q246 PolarHBondContact O-N 2.93Å; A242-Q246 PolarHBondContact O-OE1 3.35Å; I243-Q246 WeakPolarHBondContact O-CG 3.37Å; Q246-Y249 PolarHBondContact O-N 3.42Å; Q246-L250 VanDerWaalsContact O-CB 3.27Å; Q246-L250 WeakPolarHBondContact O-CB 3.27Å; Q246-L250 PolarHBondContact O-N 3.4Å
247M96.2Very high96.7Very high11 Ų1140.4 Ų40.45%0.05421%0.206CC..Hα-helixtrans-69-38.3-179.1-168.463.9-156.100111.4K44 W71 F75 I243 T244 I245 L250 N251K44-M247 HydrophobicContact CD-CE 3.25Å; K44-M247 HydrophobicContact CG-CE 4.32Å; W71-M247 HydrophobicContact CZ2-CE 3.83Å; W71-M247 HydrophobicContact CZ2-CG 3.96Å; F75-M247 HydrophobicContact CD2-CE 4.24Å; F75-M247 HydrophobicContact CD2-CG 4.24Å; F75-M247 HydrophobicContact CD2-SD 4.08Å; F75-M247 HydrophobicContact CE2-CG 4.15Å; F75-M247 HydrophobicContact CE2-SD 4.25Å; I243-M247 WeakPolarHBondContact O-CB 3.44Å; I243-M247 PolarHBondContact O-N 2.91Å; T244-M247 PolarHBondContact O-N 3.26Å; I245-M247 VanDerWaalsContact C-N 3.28Å; I245-M247 PolarHBondContact O-N 2.78Å; M247-L250 PolarHBondContact O-N 3.35Å; M247-L250 HydrophobicContact SD-CD2 4.17Å; M247-N251 WeakPolarHBondContact CE-OD1 3.37Å; M247-N251 WeakPolarHBondContact O-CB 3.22Å; M247-N251 PolarHBondContact O-N 2.94Å; M247-N251 PolarHBondContact O-ND2 2.74Å
248Y97.4Very high96.5Very high58 Ų5836 Ų3623%0.22719%0.187CC..Hα-helixtrans-57.4-54.2173.1174.5-104.2000111.2G61 L63 T244 I245 L250 N251 R252G61-Y248 WeakPolarHBondContact CA-OH 3.13Å; L63-Y248 HydrophobicContact CD2-CD2 3.63Å; L63-Y248 HydrophobicContact CD2-CE2 3.66Å; T244-Y248 WeakPolarHBondContact O-CB 3.23Å; T244-Y248 PolarHBondContact O-N 3.07Å; I245-Y248 WeakPolarHBondContact O-CB 3.49Å; I245-Y248 PolarHBondContact O-N 3.15Å; Y248-L250 PolarHBondContact O-N 3.32Å; Y248-N251 PolarHBondContact O-N 2.82Å; Y248-R252 HydrophobicContact CE1-CG 4.4Å; Y248-R252 WeakPolarHBondContact O-CG 3.34Å; Y248-R252 PolarHBondContact O-N 3.19Å
249Y97.7Very high96.3Very high22 Ų2231.8 Ų31.89%0.08617%0.171CC..Hα-helixtrans-69.9-31.6-179-75.7-74000113.6I178 F193 V196 I245 Q246 N251 R252 A253I178-Y249 HydrophobicContact CD1-CD2 4.39Å; I178-Y249 HydrophobicContact CD1-CE2 3.54Å; I178-Y249 HydrophobicContact CG1-CE1 4.09Å; I178-Y249 HydrophobicContact CG1-CE2 3.76Å; I178-Y249 VanDerWaalsContact CG1-CZ 3.48Å; I178-Y249 WeakPolarHBondContact CG1-OH 3.41Å; I178-Y249 WeakPolarHBondContact CG2-OH 3.34Å; F193-Y249 HydrophobicContact CB-CD1 4.39Å; F193-Y249 AromaticContact CD1-CD1 3.48Å; F193-Y249 HydrophobicContact CD1-CD1 3.48Å; F193-Y249 VanDerWaalsContact CD1-CD1 3.48Å; F193-Y249 AromaticContact CD1-CE1 3.87Å; F193-Y249 HydrophobicContact CD1-CE1 3.87Å; F193-Y249 HydrophobicContact CE1-CD1 4.04Å; F193-Y249 AromaticContact CE1-CE1 3.98Å; F193-Y249 HydrophobicContact CE1-CE1 3.98Å; F193-Y249 HydrophobicContact CG-CD1 4.15Å; V196-Y249 HydrophobicContact CB-CD2 4.38Å; V196-Y249 HydrophobicContact CB-CG 4.15Å; V196-Y249 HydrophobicContact CG1-CD1 4.34Å; V196-Y249 HydrophobicContact CG1-CD2 3.41Å; V196-Y249 VanDerWaalsContact CG1-CD2 3.41Å; V196-Y249 HydrophobicContact CG1-CE2 3.94Å; V196-Y249 HydrophobicContact CG1-CG 3.66Å; I245-Y249 HydrophobicContact CG2-CD2 3.82Å; I245-Y249 HydrophobicContact CG2-CE2 3.86Å; I245-Y249 VanDerWaalsContact O-CD2 3.31Å; I245-Y249 WeakPolarHBondContact O-CD2 3.27Å; I245-Y249 PolarHBondContact O-N 2.8Å; I245-Y249 VanDerWaalsContact O-N 3.1Å; Q246-Y249 PolarHBondContact O-N 3.42Å; Y249-N251 VanDerWaalsContact C-N 3.34Å; Y249-R252 PolarHBondContact O-N 3.25Å; Y249-A253 PolarHBondContact O-N 2.95Å
250L97.4Very high95.8Very high7 Ų730.7 Ų30.74%0.03717%0.166CC..Hα-helixtrans-59.7-46.9170177.655.9000111.1F41 Q246 M247 Y248 R252 A253 L254 I262 L266F41-L250 HydrophobicContact CE1-CD1 4.13Å; F41-L250 HydrophobicContact CE1-CD2 3.94Å; Q246-L250 VanDerWaalsContact O-CB 3.27Å; Q246-L250 WeakPolarHBondContact O-CB 3.27Å; Q246-L250 PolarHBondContact O-N 3.4Å; M247-L250 PolarHBondContact O-N 3.35Å; M247-L250 HydrophobicContact SD-CD2 4.17Å; Y248-L250 PolarHBondContact O-N 3.32Å; L250-R252 VanDerWaalsContact C-N 3.3Å; L250-R252 PolarHBondContact O-N 3.27Å; L250-A253 PolarHBondContact O-N 3.36Å; L250-L254 HydrophobicContact CD1-CD1 4.04Å; L250-L254 HydrophobicContact CD1-CG 4.01Å; L250-L254 HydrophobicContact CG-CD1 3.93Å; L250-L254 HydrophobicContact CG-CG 4.35Å; L250-L254 WeakPolarHBondContact O-CB 3.24Å; L250-L254 WeakPolarHBondContact O-CG 3.32Å; L250-L254 PolarHBondContact O-N 3.04Å; L250-I262 HydrophobicContact CD1-CG2 4.08Å; L250-L266 HydrophobicContact CD1-CD1 4.38Å; L250-L266 HydrophobicContact CD1-CD2 3.64Å; L250-L266 HydrophobicContact CD2-CD2 4.1Å
251N97.7Very high95.4Very high1 Ų126.7 Ų26.71%0.00515%0.145CC..Hα-helixtrans-63.6-37.1178.5-71.1-27.5000111.8L48 Y65 W71 M247 Y248 Y249 L254 D255L48-N251 HydrophobicContact CD1-CB 4.26Å; L48-N251 HydrophobicContact CD2-CB 4.07Å; Y65-N251 HydrophobicContact CE1-CB 4.39Å; Y65-N251 HydrophobicContact CE2-CB 4.41Å; Y65-N251 WeakPolarHBondContact CE2-ND2 3.45Å; Y65-N251 PolarHBondContact OH-ND2 3.23Å; W71-N251 WeakPolarHBondContact CZ2-ND2 3.24Å; W71-N251 PolarHBondContact NE1-ND2 3.14Å; W71-N251 PolarHBondContact NE1-OD1 3.47Å; M247-N251 WeakPolarHBondContact CE-OD1 3.37Å; M247-N251 WeakPolarHBondContact O-CB 3.22Å; M247-N251 PolarHBondContact O-N 2.94Å; M247-N251 PolarHBondContact O-ND2 2.74Å; Y248-N251 PolarHBondContact O-N 2.82Å; Y249-N251 VanDerWaalsContact C-N 3.34Å; N251-L254 PolarHBondContact O-N 3.24Å; N251-D255 WeakPolarHBondContact O-CB 3.46Å; N251-D255 PolarHBondContact O-N 2.76Å
252R97.2Very high95.2Very high35 Ų3525.2 Ų25.213%0.13213%0.13CC..Hα-helixtrans-62-48.1173.3-61-16766.5-174.50.8111.7A58 G59 F193 Y248 Y249 L250 D255 L256A58-R252 WeakPolarHBondContact O-CG 3.31Å; G59-R252 PolarHBondContact O-NE 3.41Å; G59-R252 PolarHBondContact O-NH2 2.9Å; F193-R252 HydrophobicContact CD2-CB 3.95Å; F193-R252 HydrophobicContact CE2-CB 4.26Å; F193-R252 HydrophobicContact CG-CB 4.35Å; F193-R252 VanDerWaalsContact CZ-CZ 3.46Å; Y248-R252 HydrophobicContact CE1-CG 4.4Å; Y248-R252 WeakPolarHBondContact O-CG 3.34Å; Y248-R252 PolarHBondContact O-N 3.19Å; Y249-R252 PolarHBondContact O-N 3.25Å; L250-R252 VanDerWaalsContact C-N 3.3Å; L250-R252 PolarHBondContact O-N 3.27Å; R252-D255 PolarHBondContact O-N 3.35Å; R252-L256 WeakPolarHBondContact O-CB 3.48Å; R252-L256 WeakPolarHBondContact O-CD1 3.37Å; R252-L256 VanDerWaalsContact O-CG 3.31Å; R252-L256 WeakPolarHBondContact O-CG 3.39Å; R252-L256 PolarHBondContact O-N 3.4Å; R252-L256 VanDerWaalsContact O-N 3.12Å
253A96.8Very high95Very high0 Ų025 Ų250%013%0.128CC..Hα-helixtrans-61.1-46.4177.800000111.2F193 Y249 L250 D255 L256 F257 I262F193-A253 HydrophobicContact CB-CB 3.93Å; Y249-A253 PolarHBondContact O-N 2.95Å; L250-A253 PolarHBondContact O-N 3.36Å; A253-D255 VanDerWaalsContact C-N 3.32Å; A253-D255 PolarHBondContact O-N 2.89Å; A253-L256 PolarHBondContact O-N 3.21Å; A253-F257 WeakPolarHBondContact O-CD2 3.23Å; A253-F257 PolarHBondContact O-N 3.48Å; A253-I262 HydrophobicContact CB-CD1 3.95Å; A253-I262 HydrophobicContact CB-CG1 4.36Å; A253-I262 HydrophobicContact CB-CG2 4.18Å
254L96.7Very high94.6Very high0 Ų022.6 Ų22.60%012%0.116CC..Hα-helixtrans-63-35.7176.3-77173.5000111.8F41 K45 L48 L250 N251 T259 I262F41-L254 HydrophobicContact CD1-CD1 3.91Å; F41-L254 HydrophobicContact CD1-CD2 4.15Å; F41-L254 HydrophobicContact CE1-CD1 4.4Å; K45-L254 HydrophobicContact CD-CB 4.37Å; K45-L254 WeakPolarHBondContact CD-O 3.36Å; K45-L254 WeakPolarHBondContact CE-O 3.3Å; K45-L254 PolarHBondContact NZ-O 2.92Å; L48-L254 HydrophobicContact CD1-CB 3.72Å; L250-L254 HydrophobicContact CD1-CD1 4.04Å; L250-L254 HydrophobicContact CD1-CG 4.01Å; L250-L254 HydrophobicContact CG-CD1 3.93Å; L250-L254 HydrophobicContact CG-CG 4.35Å; L250-L254 WeakPolarHBondContact O-CB 3.24Å; L250-L254 WeakPolarHBondContact O-CG 3.32Å; L250-L254 PolarHBondContact O-N 3.04Å; N251-L254 PolarHBondContact O-N 3.24Å; L254-T259 HydrophobicContact CD2-CG2 4.26Å; L254-I262 HydrophobicContact CD2-CB 4.09Å; L254-I262 HydrophobicContact CD2-CG2 3.8Å; L254-I262 HydrophobicContact CG-CG2 4.12Å
255D96.6Very high94.4Very high20 Ų2018.4 Ų18.411%0.1079%0.09CC..Hα-helixtrans-69.3-44.3179.1-166.638.1000111.2K45 L48 S57 A58 G59 N251 R252 A253K45-D255 PolarHBondContact NZ-O 3.04Å; L48-D255 HydrophobicContact CB-CB 4.45Å; L48-D255 HydrophobicContact CD1-CB 4.48Å; S57-D255 WeakPolarHBondContact CB-OD2 3.39Å; S57-D255 PolarHBondContact OG-OD2 3.49Å; A58-D255 HydrophobicContact CB-CB 3.98Å; A58-D255 PolarHBondContact N-OD2 2.95Å; G59-D255 PolarHBondContact N-OD2 2.88Å; N251-D255 WeakPolarHBondContact O-CB 3.46Å; N251-D255 PolarHBondContact O-N 2.76Å; R252-D255 PolarHBondContact O-N 3.35Å; A253-D255 VanDerWaalsContact C-N 3.32Å; A253-D255 PolarHBondContact O-N 2.89Å
256L94.3Very high94.2Very high54 Ų5415.8 Ų15.828%0.2838%0.077SC..Hα-helixtrans-76-32.7-173.7-68.3164.8000114.6K187 F193 R252 A253K187-L256 HydrophobicContact CB-CD2 4.49Å; K187-L256 HydrophobicContact CG-CD1 4.32Å; K187-L256 HydrophobicContact CG-CD2 4.33Å; F193-L256 HydrophobicContact CD2-CD1 3.86Å; F193-L256 HydrophobicContact CE2-CD1 3.54Å; R252-L256 WeakPolarHBondContact O-CB 3.48Å; R252-L256 WeakPolarHBondContact O-CD1 3.37Å; R252-L256 VanDerWaalsContact O-CG 3.31Å; R252-L256 WeakPolarHBondContact O-CG 3.39Å; R252-L256 PolarHBondContact O-N 3.4Å; R252-L256 VanDerWaalsContact O-N 3.12Å; A253-L256 PolarHBondContact O-N 3.21Å
257F93Very high94Very high23 Ų2316.2 Ų16.210%0.1018%0.078CC..SBendtrans-124.5164.8-170.8-55.5-76.1000112K45 K187 P190 A253 I262K45-F257 PolarHBondContact NZ-O 3.48Å; K187-F257 WeakPolarHBondContact O-CZ 3.49Å; P190-F257 VanDerWaalsContact CA-CE2 3.46Å; P190-F257 HydrophobicContact CB-CB 4.41Å; P190-F257 HydrophobicContact CB-CD1 3.99Å; P190-F257 HydrophobicContact CB-CD2 3.81Å; P190-F257 HydrophobicContact CB-CE1 4.19Å; P190-F257 HydrophobicContact CB-CE2 4.04Å; P190-F257 HydrophobicContact CB-CG 3.79Å; P190-F257 HydrophobicContact CB-CZ 4.22Å; P190-F257 HydrophobicContact CG-CD1 4.45Å; P190-F257 HydrophobicContact CG-CE1 4.5Å; A253-F257 WeakPolarHBondContact O-CD2 3.23Å; A253-F257 PolarHBondContact O-N 3.48Å; F257-I262 HydrophobicContact CB-CD1 3.7Å; F257-I262 HydrophobicContact CB-CG1 3.74Å; F257-I262 HydrophobicContact CD2-CD1 3.96Å; F257-I262 HydrophobicContact CG-CD1 4.14Å
258S91.7Very high93.7Very high33 Ų3316.4 Ų16.423%0.2318%0.079CC..  trans-67.7142.9176.559.70000111G260 I261 I262S258-G260 PolarHBondContact O-N 3.31Å; S258-I261 PolarHBondContact O-N 2.91Å; S258-I261 WeakPolarHBondContact OG-CD1 3.44Å; S258-I261 WeakPolarHBondContact OG-CG1 3.45Å; S258-I262 PolarHBondContact O-N 2.75Å; S258-I262 VanDerWaalsContact O-N 3.1Å
259T92.9Very high93.4Very high0 Ų015.3 Ų15.30%08%0.076CC..Hα-helixtrans-58.2-39179.3-43.90000110.6F41 E118 L254 I261 I262 T263F41-T259 HydrophobicContact CB-CG2 4.18Å; E118-T259 WeakPolarHBondContact OE2-CA 3.45Å; E118-T259 WeakPolarHBondContact OE2-CB 3.45Å; E118-T259 PolarHBondContact OE2-N 2.9Å; E118-T259 PolarHBondContact OE2-OG1 3.05Å; L254-T259 HydrophobicContact CD2-CG2 4.26Å; T259-I261 PolarHBondContact O-N 3.44Å; T259-I262 PolarHBondContact O-N 3.26Å; T259-T263 HydrophobicContact CG2-CG2 3.73Å; T259-T263 WeakPolarHBondContact O-CG2 3.25Å; T259-T263 PolarHBondContact O-N 2.91Å; T259-T263 PolarHBondContact O-OG1 3.49Å; T259-T263 VanDerWaalsContact O-OG1 3.11Å
260G87.4Confident93.2Very high2 Ų217 Ų172%0.0218%0.084CC..Hα-helixtrans-62.8-17.9177.900000115.5S258 P264S258-G260 PolarHBondContact O-N 3.31Å; G260-P264 VanDerWaalsContact O-CD 3.27Å; G260-P264 WeakPolarHBondContact O-CD 3.27Å; G260-P264 VanDerWaalsContact O-CG 3.31Å; G260-P264 WeakPolarHBondContact O-CG 3.42Å
261I88.8Confident92.8Very high20 Ų2017.4 Ų17.410%0.1039%0.087CC..Hα-helixtrans-96.5-41173.5-67.6174.8000110.4P190 S258 T259 P264 L265 I310 K314P190-I261 HydrophobicContact CB-CG2 4.16Å; P190-I261 HydrophobicContact CG-CG2 4.1Å; S258-I261 PolarHBondContact O-N 2.91Å; S258-I261 WeakPolarHBondContact OG-CD1 3.44Å; S258-I261 WeakPolarHBondContact OG-CG1 3.45Å; T259-I261 PolarHBondContact O-N 3.44Å; I261-P264 WeakPolarHBondContact O-CD 3.19Å; I261-L265 HydrophobicContact CG2-CD1 3.75Å; I261-L265 WeakPolarHBondContact O-CB 3.49Å; I261-L265 VanDerWaalsContact O-CG 3.25Å; I261-L265 WeakPolarHBondContact O-CG 3.43Å; I261-L265 PolarHBondContact O-N 2.74Å; I261-I310 HydrophobicContact CB-CG2 4.21Å; I261-I310 HydrophobicContact CG1-CG2 4.12Å; I261-I310 HydrophobicContact CG2-CG2 3.89Å; I261-K314 HydrophobicContact CD1-CB 4.24Å; I261-K314 HydrophobicContact CD1-CD 3.77Å
262I92.9Very high92.4Very high0 Ų018.5 Ų18.50%010%0.099CC..Hα-helixtrans-71-41.5-175.5-63.9-52.7000112.2P190 L250 A253 L254 F257 S258 T259 L265 L266P190-I262 HydrophobicContact CB-CD1 3.73Å; L250-I262 HydrophobicContact CD1-CG2 4.08Å; A253-I262 HydrophobicContact CB-CD1 3.95Å; A253-I262 HydrophobicContact CB-CG1 4.36Å; A253-I262 HydrophobicContact CB-CG2 4.18Å; L254-I262 HydrophobicContact CD2-CB 4.09Å; L254-I262 HydrophobicContact CD2-CG2 3.8Å; L254-I262 HydrophobicContact CG-CG2 4.12Å; F257-I262 HydrophobicContact CB-CD1 3.7Å; F257-I262 HydrophobicContact CB-CG1 3.74Å; F257-I262 HydrophobicContact CD2-CD1 3.96Å; F257-I262 HydrophobicContact CG-CD1 4.14Å; S258-I262 PolarHBondContact O-N 2.75Å; S258-I262 VanDerWaalsContact O-N 3.1Å; T259-I262 PolarHBondContact O-N 3.26Å; I262-L265 PolarHBondContact O-N 3.33Å; I262-L266 WeakPolarHBondContact O-CB 3.31Å; I262-L266 PolarHBondContact O-N 3.11Å
263T92.1Very high92.3Very high3 Ų318.1 Ų18.12%0.01810%0.098CC..Hα-helixtrans-67.4-41.2-175.359.60000113.4F41 S108 T259 Y267F41-T263 HydrophobicContact CB-CG2 4.2Å; F41-T263 HydrophobicContact CD1-CG2 3.63Å; F41-T263 HydrophobicContact CD2-CG2 4.12Å; F41-T263 HydrophobicContact CE1-CG2 3.97Å; F41-T263 HydrophobicContact CE2-CG2 4.44Å; F41-T263 HydrophobicContact CG-CG2 3.71Å; F41-T263 HydrophobicContact CZ-CG2 4.38Å; S108-T263 VanDerWaalsContact OG-CB 3.25Å; S108-T263 WeakPolarHBondContact OG-CB 3.34Å; S108-T263 WeakPolarHBondContact OG-CG2 3.19Å; S108-T263 PolarHBondContact OG-OG1 3.29Å; T259-T263 HydrophobicContact CG2-CG2 3.73Å; T259-T263 WeakPolarHBondContact O-CG2 3.25Å; T259-T263 PolarHBondContact O-N 2.91Å; T259-T263 PolarHBondContact O-OG1 3.49Å; T259-T263 VanDerWaalsContact O-OG1 3.11Å; T263-Y267 WeakPolarHBondContact O-CB 3.3Å; T263-Y267 PolarHBondContact O-N 3.06Å
264P89.7Confident92Very high1 Ų119.3 Ų19.31%0.00611%0.105CC..Hα-helixtrans-68.9-41.5174.4-1832.8000112.6V105 C128 G260 I261 L266 Y267 V268 I310V105-P264 HydrophobicContact CG1-CB 3.92Å; V105-P264 HydrophobicContact CG1-CG 3.63Å; C128-P264 HydrophobicContact CB-CB 4.5Å; C128-P264 HydrophobicContact CB-CG 4.08Å; C128-P264 VanDerWaalsContact SG-CG 3.52Å; G260-P264 VanDerWaalsContact O-CD 3.27Å; G260-P264 WeakPolarHBondContact O-CD 3.27Å; G260-P264 VanDerWaalsContact O-CG 3.31Å; G260-P264 WeakPolarHBondContact O-CG 3.42Å; I261-P264 WeakPolarHBondContact O-CD 3.19Å; P264-L266 PolarHBondContact O-N 2.81Å; P264-Y267 PolarHBondContact O-N 2.98Å; P264-V268 WeakPolarHBondContact O-CG2 3.43Å; P264-V268 PolarHBondContact O-N 2.94Å; P264-I310 HydrophobicContact CB-CD1 3.7Å; P264-I310 HydrophobicContact CG-CD1 4.22Å
265L91.5Very high91.7Very high0 Ų020.5 Ų20.50%011%0.111CC..Hα-helixtrans-61.4-45.2177.1-74.8177.6000111.5P190 T194 I261 I262 Y267 V268 F269 I307 I310 T311P190-L265 HydrophobicContact CB-CD1 4.03Å; P190-L265 HydrophobicContact CG-CD1 4.11Å; T194-L265 HydrophobicContact CG2-CB 3.83Å; I261-L265 HydrophobicContact CG2-CD1 3.75Å; I261-L265 WeakPolarHBondContact O-CB 3.49Å; I261-L265 VanDerWaalsContact O-CG 3.25Å; I261-L265 WeakPolarHBondContact O-CG 3.43Å; I261-L265 PolarHBondContact O-N 2.74Å; I262-L265 PolarHBondContact O-N 3.33Å; L265-Y267 VanDerWaalsContact C-N 3.34Å; L265-V268 PolarHBondContact O-N 3.23Å; L265-F269 HydrophobicContact CB-CE2 4.33Å; L265-F269 HydrophobicContact CD2-CE2 4.19Å; L265-F269 HydrophobicContact CD2-CZ 4.49Å; L265-F269 WeakPolarHBondContact O-CD2 3.19Å; L265-F269 PolarHBondContact O-N 3.17Å; L265-I307 HydrophobicContact CD2-CB 4.4Å; L265-I307 HydrophobicContact CD2-CG1 3.98Å; L265-I307 HydrophobicContact CD2-CG2 3.91Å; L265-I310 HydrophobicContact CG-CG2 4.49Å; L265-T311 HydrophobicContact CD1-CG2 4.06Å; L265-T311 HydrophobicContact CD2-CG2 4.03Å
266L94.3Very high91.4Very high19 Ų1923.7 Ų23.710%0.09913%0.127CC..Hα-helixtrans-60.2-48.1177.4-178.570.8000110F41 T194 S197 L250 I262 P264 V268 F269 F270F41-L266 HydrophobicContact CE1-CD2 3.91Å; F41-L266 HydrophobicContact CZ-CD2 3.78Å; T194-L266 HydrophobicContact CG2-CB 3.8Å; T194-L266 HydrophobicContact CG2-CD1 4.16Å; T194-L266 VanDerWaalsContact CG2-N 3.29Å; S197-L266 WeakPolarHBondContact OG-CD1 3.39Å; L250-L266 HydrophobicContact CD1-CD1 4.38Å; L250-L266 HydrophobicContact CD1-CD2 3.64Å; L250-L266 HydrophobicContact CD2-CD2 4.1Å; I262-L266 WeakPolarHBondContact O-CB 3.31Å; I262-L266 PolarHBondContact O-N 3.11Å; P264-L266 PolarHBondContact O-N 2.81Å; L266-V268 PolarHBondContact O-N 2.67Å; L266-F269 PolarHBondContact O-N 3.1Å; L266-F270 WeakPolarHBondContact O-CB 3.49Å; L266-F270 PolarHBondContact O-N 3.37Å
267Y91.3Very high91.3Very high32 Ų3221.1 Ų21.113%0.12511%0.114CC..Hα-helixtrans-58.8-45.6-179.8-176.3-106.3000112.2A102 V105 S135 T263 P264 L265 T271A102-Y267 VanDerWaalsContact CA-CZ 3.48Å; A102-Y267 WeakPolarHBondContact CA-OH 3.41Å; A102-Y267 HydrophobicContact CB-CE1 3.62Å; A102-Y267 HydrophobicContact CB-CE2 4.32Å; A102-Y267 VanDerWaalsContact CB-CZ 3.47Å; A102-Y267 WeakPolarHBondContact CB-OH 3.28Å; V105-Y267 VanDerWaalsContact CG2-CB 3.47Å; V105-Y267 HydrophobicContact CG2-CD1 4.03Å; V105-Y267 HydrophobicContact CG2-CD2 3.89Å; V105-Y267 HydrophobicContact CG2-CG 3.52Å; S135-Y267 WeakPolarHBondContact OG-CE1 3.35Å; T263-Y267 WeakPolarHBondContact O-CB 3.3Å; T263-Y267 PolarHBondContact O-N 3.06Å; P264-Y267 PolarHBondContact O-N 2.98Å; L265-Y267 VanDerWaalsContact C-N 3.34Å; Y267-T271 WeakPolarHBondContact O-CB 3.4Å; Y267-T271 PolarHBondContact O-N 2.92Å; Y267-T271 PolarHBondContact O-OG1 3.34Å
268V90Very high91.1Very high14 Ų1420.5 Ų20.59%0.08511%0.113CC..Hα-helixtrans-66.5-49.4-179.9174.70000111.6C131 P264 L265 L266 G272 T303 I307C131-V268 HydrophobicContact CB-CG2 3.79Å; P264-V268 WeakPolarHBondContact O-CG2 3.43Å; P264-V268 PolarHBondContact O-N 2.94Å; L265-V268 PolarHBondContact O-N 3.23Å; L266-V268 PolarHBondContact O-N 2.67Å; V268-G272 PolarHBondContact O-N 2.68Å; V268-T303 HydrophobicContact CG1-CG2 4Å; V268-T303 HydrophobicContact CG2-CG2 4.29Å; V268-I307 HydrophobicContact CB-CD1 4.45Å; V268-I307 HydrophobicContact CG1-CD1 3.74Å; V268-I307 HydrophobicContact CG1-CG1 4.41Å
269F92Very high90.9Very high35 Ų3519.6 Ų19.615%0.15411%0.105CC..Hα-helixtrans-65.1-47.8179.9-67.4-44.5000111.5I191 T194 L195 L265 L266 T271 G272 F273 I307I191-F269 HydrophobicContact CG1-CE2 4.48Å; I191-F269 HydrophobicContact CG1-CZ 4.48Å; I191-F269 HydrophobicContact CG2-CE2 3.97Å; I191-F269 HydrophobicContact CG2-CZ 3.88Å; T194-F269 HydrophobicContact CG2-CD2 4.06Å; L195-F269 HydrophobicContact CD1-CB 4.18Å; L195-F269 HydrophobicContact CD1-CD1 3.57Å; L195-F269 HydrophobicContact CD1-CD2 4Å; L195-F269 HydrophobicContact CD1-CE1 3.88Å; L195-F269 HydrophobicContact CD1-CE2 4.28Å; L195-F269 HydrophobicContact CD1-CG 3.65Å; L195-F269 HydrophobicContact CD1-CZ 4.23Å; L265-F269 HydrophobicContact CB-CE2 4.33Å; L265-F269 HydrophobicContact CD2-CE2 4.19Å; L265-F269 HydrophobicContact CD2-CZ 4.49Å; L265-F269 WeakPolarHBondContact O-CD2 3.19Å; L265-F269 PolarHBondContact O-N 3.17Å; L266-F269 PolarHBondContact O-N 3.1Å; F269-T271 PolarHBondContact O-N 3.42Å; F269-G272 PolarHBondContact O-N 2.94Å; F269-F273 WeakPolarHBondContact O-CD2 3.26Å; F269-F273 PolarHBondContact O-N 3.39Å; F269-I307 HydrophobicContact CE1-CD1 4.12Å; F269-I307 HydrophobicContact CZ-CD1 4.34Å
270F93Very high90.8Very high57 Ų5721.1 Ų21.125%0.2512%0.115CC..Hα-helixtrans-56.1-52.1177.6179.7-94.4000111.4G201 V205 L266 G272 F273 V274G201-F270 VanDerWaalsContact C-CE2 3.48Å; V205-F270 HydrophobicContact CG2-CE1 4.11Å; V205-F270 HydrophobicContact CG2-CE2 3.94Å; V205-F270 HydrophobicContact CG2-CZ 3.3Å; L266-F270 WeakPolarHBondContact O-CB 3.49Å; L266-F270 PolarHBondContact O-N 3.37Å; F270-G272 PolarHBondContact O-N 3.3Å; F270-F273 PolarHBondContact O-N 2.99Å; F270-V274 HydrophobicContact CD1-CG2 4.09Å; F270-V274 HydrophobicContact CE1-CG2 3.89Å; F270-V274 HydrophobicContact CE2-CG2 4.42Å; F270-V274 HydrophobicContact CG-CG2 4.46Å; F270-V274 HydrophobicContact CZ-CG2 4.09Å; F270-V274 WeakPolarHBondContact O-CB 3.47Å; F270-V274 WeakPolarHBondContact O-CG2 3.3Å; F270-V274 PolarHBondContact O-N 2.68Å
271T89.5Confident90.9Very high16 Ų1621 Ų2110%0.09811%0.114CC..Hα-helixtrans-62.5-44.3-179.5-560000111.5V139 Y267 F269 F273 V274 I275V139-T271 HydrophobicContact CG2-CG2 3.64Å; Y267-T271 WeakPolarHBondContact O-CB 3.4Å; Y267-T271 PolarHBondContact O-N 2.92Å; Y267-T271 PolarHBondContact O-OG1 3.34Å; F269-T271 PolarHBondContact O-N 3.42Å; T271-F273 PolarHBondContact O-N 2.89Å; T271-V274 PolarHBondContact O-N 2.93Å; T271-I275 HydrophobicContact CG2-CD1 3.87Å; T271-I275 HydrophobicContact CG2-CG1 4.43Å; T271-I275 VanDerWaalsContact O-CG1 3.31Å; T271-I275 WeakPolarHBondContact O-CG1 3.38Å; T271-I275 PolarHBondContact O-N 2.86Å
272G89.6Confident90.7Very high25 Ų2520.1 Ų20.126%0.25811%0.109SC..Hα-helixtrans-59.1-48.2177.400000112.2V268 F269 F270 I275 I276V268-G272 PolarHBondContact O-N 2.68Å; F269-G272 PolarHBondContact O-N 2.94Å; F270-G272 PolarHBondContact O-N 3.3Å; G272-I275 PolarHBondContact O-N 2.95Å; G272-I276 VanDerWaalsContact O-CG1 3.3Å; G272-I276 WeakPolarHBondContact O-CG1 3.37Å; G272-I276 PolarHBondContact O-N 2.95Å; G272-I276 VanDerWaalsContact O-N 3.09Å
273F93.9Very high90Very high27 Ų2724.6 Ų24.612%0.11813%0.13CC..Hα-helixtrans-66.4-38.4177.2-82.7-74.2000112.7Y166 F169 V170 L173 L195 S202 F269 F270 T271 I276 A277Y166-F273 HydrophobicContact CE2-CD1 4.44Å; Y166-F273 PolarHBondContact OH-O 2.96Å; F169-F273 HydrophobicContact CE1-CE1 4.35Å; V170-F273 HydrophobicContact CG2-CD1 4.15Å; V170-F273 HydrophobicContact CG2-CE1 4.25Å; L173-F273 HydrophobicContact CD2-CE1 4.13Å; L173-F273 HydrophobicContact CD2-CZ 3.66Å; L195-F273 HydrophobicContact CD1-CE2 3.68Å; L195-F273 HydrophobicContact CD1-CZ 4.35Å; L195-F273 HydrophobicContact CG-CE2 4.45Å; S202-F273 VanDerWaalsContact CB-C 3.42Å; F269-F273 WeakPolarHBondContact O-CD2 3.26Å; F269-F273 PolarHBondContact O-N 3.39Å; F270-F273 PolarHBondContact O-N 2.99Å; T271-F273 PolarHBondContact O-N 2.89Å; F273-I276 PolarHBondContact O-N 2.86Å; F273-A277 WeakPolarHBondContact O-CB 3.4Å; F273-A277 PolarHBondContact O-N 3.15Å
274V92Very high88.9Confident24 Ų2425 Ų2515%0.14513%0.132CC..Hα-helixtrans-59.9-46.5175.2167.40000110.8V205 F270 T271 I276 A277 S278V205-V274 HydrophobicContact CB-CG2 4.09Å; V205-V274 HydrophobicContact CG1-CG1 4.12Å; V205-V274 HydrophobicContact CG1-CG2 4.35Å; V205-V274 HydrophobicContact CG2-CG2 3.91Å; F270-V274 HydrophobicContact CD1-CG2 4.09Å; F270-V274 HydrophobicContact CE1-CG2 3.89Å; F270-V274 HydrophobicContact CE2-CG2 4.42Å; F270-V274 HydrophobicContact CG-CG2 4.46Å; F270-V274 HydrophobicContact CZ-CG2 4.09Å; F270-V274 WeakPolarHBondContact O-CB 3.47Å; F270-V274 WeakPolarHBondContact O-CG2 3.3Å; F270-V274 PolarHBondContact O-N 2.68Å; T271-V274 PolarHBondContact O-N 2.93Å; V274-I276 PolarHBondContact O-N 3.11Å; V274-A277 WeakPolarHBondContact O-CB 3.29Å; V274-A277 PolarHBondContact O-N 3.44Å; V274-S278 PolarHBondContact O-N 3.29Å; V274-S278 PolarHBondContact O-OG 2.92Å
275I88.7Confident87.6Confident26 Ų2629.4 Ų29.413%0.13316%0.155CC..Hα-helixtrans-63.2-43.9179.9-68.9173.1000110.8I138 V139 A142 T271 G272 A277 T279I138-I275 HydrophobicContact CB-CD1 4.26Å; I138-I275 HydrophobicContact CG2-CD1 3.46Å; I138-I275 VanDerWaalsContact CG2-CD1 3.46Å; V139-I275 HydrophobicContact CG2-CD1 3.94Å; A142-I275 HydrophobicContact CB-CD1 4.39Å; A142-I275 HydrophobicContact CB-CG2 4.2Å; T271-I275 HydrophobicContact CG2-CD1 3.87Å; T271-I275 HydrophobicContact CG2-CG1 4.43Å; T271-I275 VanDerWaalsContact O-CG1 3.31Å; T271-I275 WeakPolarHBondContact O-CG1 3.38Å; T271-I275 PolarHBondContact O-N 2.86Å; G272-I275 PolarHBondContact O-N 2.95Å; I275-A277 VanDerWaalsContact C-N 3.34Å; I275-A277 PolarHBondContact O-N 3.14Å; I275-T279 WeakPolarHBondContact O-CB 3.49Å; I275-T279 PolarHBondContact O-N 3.26Å; I275-T279 PolarHBondContact O-OG1 2.87Å
276I90.7Very high86.2Confident86 Ų8637.1 Ų37.144%0.44120%0.196SC..Hα-helixtrans-61.4-45.2175.1-62.7165.8000110.1Y166 G272 F273 V274 T279 V280Y166-I276 HydrophobicContact CD2-CG2 3.68Å; Y166-I276 HydrophobicContact CE2-CB 4.02Å; Y166-I276 HydrophobicContact CE2-CG2 3.44Å; Y166-I276 VanDerWaalsContact CE2-CG2 3.44Å; G272-I276 VanDerWaalsContact O-CG1 3.3Å; G272-I276 WeakPolarHBondContact O-CG1 3.37Å; G272-I276 PolarHBondContact O-N 2.95Å; G272-I276 VanDerWaalsContact O-N 3.09Å; F273-I276 PolarHBondContact O-N 2.86Å; V274-I276 PolarHBondContact O-N 3.11Å; I276-T279 PolarHBondContact O-N 2.84Å; I276-V280 HydrophobicContact CG2-CG2 4.25Å; I276-V280 WeakPolarHBondContact O-CB 3.48Å; I276-V280 VanDerWaalsContact O-CG2 3.24Å; I276-V280 WeakPolarHBondContact O-CG2 3.28Å; I276-V280 PolarHBondContact O-N 3.13Å
277A92.3Very high85Confident0 Ų040.2 Ų40.20%022%0.224CC..Hα-helixtrans-59-51.4179.300000111.8Y166 V206 F273 V274 I275 V280 L281Y166-A277 HydrophobicContact CD1-CB 4.37Å; Y166-A277 HydrophobicContact CE1-CB 3.46Å; Y166-A277 VanDerWaalsContact CE1-CB 3.46Å; Y166-A277 WeakPolarHBondContact OH-CB 3.36Å; V206-A277 HydrophobicContact CG2-CB 3.66Å; F273-A277 WeakPolarHBondContact O-CB 3.4Å; F273-A277 PolarHBondContact O-N 3.15Å; V274-A277 WeakPolarHBondContact O-CB 3.29Å; V274-A277 PolarHBondContact O-N 3.44Å; I275-A277 VanDerWaalsContact C-N 3.34Å; I275-A277 PolarHBondContact O-N 3.14Å; A277-V280 PolarHBondContact O-N 2.87Å; A277-L281 VanDerWaalsContact O-CB 3.24Å; A277-L281 WeakPolarHBondContact O-CB 3.32Å; A277-L281 PolarHBondContact O-N 3.23Å
278S89.1Confident84.3Confident11 Ų1139.7 Ų39.78%0.07722%0.223CC..Hα-helixtrans-60.8-46.5178.3-72.60000111.2E145 V274 V280 L281 F282E145-S278 VanDerWaalsContact OE1-CB 3.22Å; E145-S278 WeakPolarHBondContact OE1-CB 3.44Å; E145-S278 PolarHBondContact OE1-OG 2.89Å; V274-S278 PolarHBondContact O-N 3.29Å; V274-S278 PolarHBondContact O-OG 2.92Å; S278-V280 VanDerWaalsContact C-N 3.34Å; S278-V280 PolarHBondContact O-N 3.45Å; S278-L281 PolarHBondContact O-N 3.25Å; S278-F282 WeakPolarHBondContact O-CD2 3.46Å; S278-F282 PolarHBondContact O-N 2.93Å
279T87.3Confident84Confident13 Ų1344.4 Ų44.48%0.0825%0.248CC..Hα-helixtrans-61.4-43.1-178.4-60.80000112P143 I275 I276 H283 E284 L285P143-T279 HydrophobicContact CG-CG2 4.14Å; P143-T279 WeakPolarHBondContact CG-OG1 3.46Å; I275-T279 WeakPolarHBondContact O-CB 3.49Å; I275-T279 PolarHBondContact O-N 3.26Å; I275-T279 PolarHBondContact O-OG1 2.87Å; I276-T279 PolarHBondContact O-N 2.84Å; T279-H283 PolarHBondContact O-N 3.02Å; T279-E284 PolarHBondContact O-N 3.38Å; T279-L285 HydrophobicContact CG2-CD1 4.23Å; T279-L285 HydrophobicContact CG2-CD2 3.32Å; T279-L285 HydrophobicContact CG2-CG 3.43Å; T279-L285 VanDerWaalsContact CG2-CG 3.43Å
280V90.4Very high83.8Confident33 Ų3351 Ų5120%0.227%0.273CS..Hα-helixtrans-68.3-42.4177.2172.10000111S162 F163 I276 A277 S278 F282 H283S162-V280 VanDerWaalsContact O-CG1 3.32Å; S162-V280 WeakPolarHBondContact O-CG1 3.46Å; F163-V280 HydrophobicContact CB-CG1 4.18Å; F163-V280 HydrophobicContact CD2-CG1 4.31Å; I276-V280 HydrophobicContact CG2-CG2 4.25Å; I276-V280 WeakPolarHBondContact O-CB 3.48Å; I276-V280 VanDerWaalsContact O-CG2 3.24Å; I276-V280 WeakPolarHBondContact O-CG2 3.28Å; I276-V280 PolarHBondContact O-N 3.13Å; A277-V280 PolarHBondContact O-N 2.87Å; S278-V280 VanDerWaalsContact C-N 3.34Å; S278-V280 PolarHBondContact O-N 3.45Å; V280-F282 PolarHBondContact O-N 3.42Å; V280-H283 PolarHBondContact O-ND1 3.21Å
281L89.9Confident83.6Confident0 Ų054.4 Ų54.40%029%0.291CS..Hα-helixtrans-64-41.2-179.6-174.767.6000112.4M154 R157 F163 V206 A277 S278M154-L281 HydrophobicContact CE-CD2 4.39Å; M154-L281 HydrophobicContact SD-CD2 4.09Å; R157-L281 HydrophobicContact CB-CD1 3.84Å; R157-L281 HydrophobicContact CB-CG 4.34Å; F163-L281 HydrophobicContact CB-CD1 4.38Å; F163-L281 HydrophobicContact CD1-CD1 4.05Å; F163-L281 HydrophobicContact CD2-CB 3.73Å; F163-L281 HydrophobicContact CD2-CD1 3.7Å; F163-L281 HydrophobicContact CD2-CG 4.29Å; F163-L281 HydrophobicContact CE1-CD1 4.28Å; F163-L281 HydrophobicContact CE2-CB 3.99Å; F163-L281 HydrophobicContact CE2-CD1 3.97Å; F163-L281 HydrophobicContact CE2-CG 4.41Å; F163-L281 HydrophobicContact CG-CD1 3.75Å; F163-L281 HydrophobicContact CZ-CD1 4.26Å; V206-L281 HydrophobicContact CG1-CD2 3.61Å; A277-L281 VanDerWaalsContact O-CB 3.24Å; A277-L281 WeakPolarHBondContact O-CB 3.32Å; A277-L281 PolarHBondContact O-N 3.23Å; S278-L281 PolarHBondContact O-N 3.25Å
282F84.7Confident83.5Confident1 Ų155.9 Ų55.90%0.00430%0.298CS..Hα-helixtrans-93.3-6.5-176.5-60.9-62.9000114.3E145 Q146 L148 K209 S278 V280 E284E145-F282 HydrophobicContact CB-CD2 4.15Å; E145-F282 HydrophobicContact CB-CE2 4.24Å; E145-F282 HydrophobicContact CG-CD2 4.23Å; E145-F282 HydrophobicContact CG-CE2 4.31Å; Q146-F282 HydrophobicContact CB-CD1 4.22Å; L148-F282 HydrophobicContact CD1-CE1 3.64Å; L148-F282 HydrophobicContact CD1-CZ 4.26Å; L148-F282 HydrophobicContact CD2-CE1 4.11Å; L148-F282 HydrophobicContact CG-CE1 3.69Å; K209-F282 HydrophobicContact CD-CE2 4.21Å; K209-F282 HydrophobicContact CD-CZ 3.91Å; S278-F282 WeakPolarHBondContact O-CD2 3.46Å; S278-F282 PolarHBondContact O-N 2.93Å; V280-F282 PolarHBondContact O-N 3.42Å; F282-E284 VanDerWaalsContact C-N 3.31Å; F282-E284 HydrophobicContact CB-CG 3.8Å; F282-E284 WeakPolarHBondContact CB-OE1 3.46Å; F282-E284 PolarHBondContact O-N 3.41Å
283H77.2Confident83.4Confident93 Ų9359.3 Ų59.343%0.43130%0.304SS..THydrogen-bonded Turntrans57.335.9-179-65.978.3000114.4D160 S162 T279 V280D160-H283 IonicContact OD2-CE1 2.6Å; D160-H283 PolarHBondContact OD2-CE1 2.94Å; D160-H283 IonicContact OD2-ND1 3.63Å; S162-H283 PolarHBondContact OG-CE1 3.38Å; S162-H283 PolarHBondContact OG-NE2 3.42Å; T279-H283 PolarHBondContact O-N 3.02Å; V280-H283 PolarHBondContact O-ND1 3.21Å
284E70.6Confident83.3Confident12 Ų1259.9 Ų59.96%0.05631%0.31CS..G310 helixtrans-94.57.1-167.8-70.8175.4-17700115.7P143 K144 E145 Q146 T279 F282 N286 A287P143-E284 HydrophobicContact CB-CB 3.61Å; P143-E284 HydrophobicContact CG-CB 4.22Å; K144-E284 VanDerWaalsContact O-CD 3.22Å; K144-E284 VanDerWaalsContact O-OE1 3.12Å; E145-E284 WeakPolarHBondContact CA-OE1 3.45Å; E145-E284 WeakPolarHBondContact CA-OE2 3.34Å; E145-E284 PolarHBondContact N-OE2 3.4Å; Q146-E284 VanDerWaalsContact CG-OE1 3.29Å; Q146-E284 WeakPolarHBondContact CG-OE1 2.96Å; Q146-E284 PolarHBondContact N-OE1 2.88Å; T279-E284 PolarHBondContact O-N 3.38Å; F282-E284 VanDerWaalsContact C-N 3.31Å; F282-E284 HydrophobicContact CB-CG 3.8Å; F282-E284 WeakPolarHBondContact CB-OE1 3.46Å; F282-E284 PolarHBondContact O-N 3.41Å; E284-N286 PolarHBondContact O-N 3.27Å; E284-N286 VanDerWaalsContact O-N 3.12Å; E284-A287 PolarHBondContact O-N 3.44Å
285L61.8Low83.3Confident94 Ų9459 Ų5949%0.49231%0.306SS..G310 helixtrans-56.9-33.5-179.9-73174000113T279 A287 L288 Y293T279-L285 HydrophobicContact CG2-CD1 4.23Å; T279-L285 HydrophobicContact CG2-CD2 3.32Å; T279-L285 HydrophobicContact CG2-CG 3.43Å; T279-L285 VanDerWaalsContact CG2-CG 3.43Å; L285-A287 PolarHBondContact O-N 3.36Å; L285-L288 HydrophobicContact CD2-CD1 4.44Å; L285-Y293 PolarHBondContact O-OH 3.43Å
286N61.9Low83.3Confident161 Ų16159.6 Ų59.686%0.86131%0.309SS*.G310 helixtrans-76.4-6.6-176.6-62.6-15.8000113.7E284E284-N286 PolarHBondContact O-N 3.27Å; E284-N286 VanDerWaalsContact O-N 3.12Å
287A68.6Low83.3Confident84 Ų8460.4 Ų60.469%0.69431%0.313SS*.G310 helixtrans-98-0.4-177.900000113.8E284 L285E284-A287 PolarHBondContact O-N 3.44Å; L285-A287 PolarHBondContact O-N 3.36Å
288L77.1Confident83.4Confident21 Ų2165.6 Ų65.611%0.1134%0.336CS..  trans-79.3135.5-176.9-68.4175.9000111.7P143 L285 D292 Y293 L296P143-L288 HydrophobicContact CB-CD2 3.82Å; P143-L288 HydrophobicContact CB-CG 4.36Å; P143-L288 HydrophobicContact CG-CD2 4.41Å; L285-L288 HydrophobicContact CD2-CD1 4.44Å; L288-D292 HydrophobicContact CB-CB 4.19Å; L288-D292 HydrophobicContact CD2-CB 3.88Å; L288-Y293 HydrophobicContact CB-CD2 4.09Å; L288-Y293 HydrophobicContact CB-CE1 4.48Å; L288-Y293 HydrophobicContact CB-CE2 3.54Å; L288-Y293 HydrophobicContact CD1-CE1 4.13Å; L288-Y293 WeakPolarHBondContact O-CE2 3.49Å; L288-L296 HydrophobicContact CD1-CD1 3.87Å
289D84.7Confident83.5Confident113 Ų11365.1 Ų65.160%0.60433%0.333SS*.  trans-79.4162.2175-141.9-16.5000110.3M291 D292 Y293D289-M291 PolarHBondContact O-N 3.44Å; D289-M291 VanDerWaalsContact O-N 3.15Å; D289-D292 PolarHBondContact N-OD2 2.91Å; D289-D292 VanDerWaalsContact N-OD2 3.07Å; D289-D292 WeakPolarHBondContact O-CB 3.42Å; D289-D292 PolarHBondContact O-N 3.13Å; D289-Y293 WeakPolarHBondContact O-CD2 3.47Å; D289-Y293 PolarHBondContact O-N 3.05Å
290Y87.2Confident83.7Confident175 Ų17569.5 Ų69.569%0.68636%0.355SS*.Hα-helixtrans-55.7-37.7-178.9174.7-99.7000112.4D292 Y293 V294Y290-D292 VanDerWaalsContact C-N 3.29Å; Y290-D292 PolarHBondContact O-N 3.4Å; Y290-Y293 PolarHBondContact O-N 3.3Å; Y290-V294 HydrophobicContact CD1-CG2 4.28Å; Y290-V294 HydrophobicContact CE1-CG2 3.77Å; Y290-V294 HydrophobicContact CE2-CG2 4.35Å; Y290-V294 WeakPolarHBondContact O-CG2 3.37Å; Y290-V294 PolarHBondContact O-N 2.86Å
291M87.9Confident83.9Confident128 Ų12871.8 Ų71.863%0.63137%0.365SS*.Hα-helixtrans-65.8-31.8178.1-64.3-59-7100112.5D289 V294 G295D289-M291 PolarHBondContact O-N 3.44Å; D289-M291 VanDerWaalsContact O-N 3.15Å; M291-V294 PolarHBondContact O-N 3.46Å; M291-G295 PolarHBondContact O-N 2.93Å
292D88.3Confident84.1Confident46 Ų4675 Ų7525%0.24638%0.379CS..Hα-helixtrans-68.9-42.3178.4-62-37.9000111H141 L288 D289 Y290 V294 G295 L296H141-D292 HydrophobicContact CB-CB 4.19Å; H141-D292 WeakPolarHBondContact CB-O 3.35Å; H141-D292 IonicContact CD2-OD1 3.7Å; L288-D292 HydrophobicContact CB-CB 4.19Å; L288-D292 HydrophobicContact CD2-CB 3.88Å; D289-D292 PolarHBondContact N-OD2 2.91Å; D289-D292 VanDerWaalsContact N-OD2 3.07Å; D289-D292 WeakPolarHBondContact O-CB 3.42Å; D289-D292 PolarHBondContact O-N 3.13Å; Y290-D292 VanDerWaalsContact C-N 3.29Å; Y290-D292 PolarHBondContact O-N 3.4Å; D292-V294 VanDerWaalsContact C-N 3.34Å; D292-V294 PolarHBondContact O-N 3.32Å; D292-G295 PolarHBondContact O-N 3.33Å; D292-L296 WeakPolarHBondContact O-CB 3.36Å; D292-L296 VanDerWaalsContact O-CG 3.27Å; D292-L296 WeakPolarHBondContact O-CG 3.25Å; D292-L296 PolarHBondContact O-N 3.4Å
293Y86.9Confident84.4Confident97 Ų9775.1 Ų75.138%0.3838%0.381SS..Hα-helixtrans-59.1-45173.7-74.3-73.9000112.4L285 L288 D289 Y290 L296 I297L285-Y293 PolarHBondContact O-OH 3.43Å; L288-Y293 HydrophobicContact CB-CD2 4.09Å; L288-Y293 HydrophobicContact CB-CE1 4.48Å; L288-Y293 HydrophobicContact CB-CE2 3.54Å; L288-Y293 HydrophobicContact CD1-CE1 4.13Å; L288-Y293 WeakPolarHBondContact O-CE2 3.49Å; D289-Y293 WeakPolarHBondContact O-CD2 3.47Å; D289-Y293 PolarHBondContact O-N 3.05Å; Y290-Y293 PolarHBondContact O-N 3.3Å; Y293-L296 PolarHBondContact O-N 2.89Å; Y293-I297 VanDerWaalsContact O-CG1 3.32Å; Y293-I297 WeakPolarHBondContact O-CG1 3.34Å; Y293-I297 PolarHBondContact O-N 2.83Å
294V91.7Very high84.9Confident39 Ų3974.1 Ų74.124%0.23638%0.381CS..Hα-helixtrans-61.8-46.1177.2174.10000110.4Y290 M291 D292 L296 I297 F298Y290-V294 HydrophobicContact CD1-CG2 4.28Å; Y290-V294 HydrophobicContact CE1-CG2 3.77Å; Y290-V294 HydrophobicContact CE2-CG2 4.35Å; Y290-V294 WeakPolarHBondContact O-CG2 3.37Å; Y290-V294 PolarHBondContact O-N 2.86Å; M291-V294 PolarHBondContact O-N 3.46Å; D292-V294 VanDerWaalsContact C-N 3.34Å; D292-V294 PolarHBondContact O-N 3.32Å; V294-L296 PolarHBondContact O-N 3.43Å; V294-I297 PolarHBondContact O-N 3.07Å; V294-F298 HydrophobicContact CG1-CD2 3.65Å; V294-F298 HydrophobicContact CG1-CE2 3.63Å; V294-F298 VanDerWaalsContact O-CD2 3.31Å; V294-F298 WeakPolarHBondContact O-CD2 3.49Å; V294-F298 PolarHBondContact O-N 2.93Å
295G92.2Very high85.9Confident7 Ų777.8 Ų77.87%0.07240%0.4CS..Hα-helixtrans-60.2-41.6177.400000113.4M291 D292 G299M291-G295 PolarHBondContact O-N 2.93Å; D292-G295 PolarHBondContact O-N 3.33Å; G295-G299 PolarHBondContact O-N 2.88Å
296L89.2Confident87.3Confident37 Ų3773.3 Ų73.319%0.19438%0.377CS..Hα-helixtrans-63.3-43.3175-71.9169.7000112I138 H141 L288 D292 Y293 V294 G299 L300I138-L296 HydrophobicContact CB-CD2 4.38Å; I138-L296 HydrophobicContact CG2-CD2 3.65Å; I138-L296 WeakPolarHBondContact O-CD2 3.32Å; H141-L296 HydrophobicContact CB-CD2 4.43Å; H141-L296 HydrophobicContact CB-CG 4.11Å; L288-L296 HydrophobicContact CD1-CD1 3.87Å; D292-L296 WeakPolarHBondContact O-CB 3.36Å; D292-L296 VanDerWaalsContact O-CG 3.27Å; D292-L296 WeakPolarHBondContact O-CG 3.25Å; D292-L296 PolarHBondContact O-N 3.4Å; Y293-L296 PolarHBondContact O-N 2.89Å; V294-L296 PolarHBondContact O-N 3.43Å; L296-G299 PolarHBondContact O-N 2.99Å; L296-L300 WeakPolarHBondContact O-CB 3.41Å; L296-L300 PolarHBondContact O-N 3.29Å
297I90.8Very high88.5Confident103 Ų10366.8 Ų66.853%0.52834%0.342SS..Hα-helixtrans-63.6-48.7177.9-69.4166.3000110.8Y293 V294 G299 L300 I301Y293-I297 VanDerWaalsContact O-CG1 3.32Å; Y293-I297 WeakPolarHBondContact O-CG1 3.34Å; Y293-I297 PolarHBondContact O-N 2.83Å; V294-I297 PolarHBondContact O-N 3.07Å; I297-G299 VanDerWaalsContact C-N 3.34Å; I297-G299 PolarHBondContact O-N 3.33Å; I297-L300 WeakPolarHBondContact O-CB 3.39Å; I297-L300 PolarHBondContact O-N 2.94Å; I297-I301 HydrophobicContact CG2-CD1 3.98Å; I297-I301 WeakPolarHBondContact O-CG1 3.47Å; I297-I301 PolarHBondContact O-N 3.28Å
298F94Very high89.4Confident110 Ų11066.5 Ų66.548%0.48233%0.328SS..Hα-helixtrans-60.4-46.5175.8-84.7-72.1000110.8V294 L300 I301 F302V294-F298 HydrophobicContact CG1-CD2 3.65Å; V294-F298 HydrophobicContact CG1-CE2 3.63Å; V294-F298 VanDerWaalsContact O-CD2 3.31Å; V294-F298 WeakPolarHBondContact O-CD2 3.49Å; V294-F298 PolarHBondContact O-N 2.93Å; F298-L300 VanDerWaalsContact C-N 3.26Å; F298-L300 PolarHBondContact O-N 3.47Å; F298-I301 PolarHBondContact O-N 3.25Å; F298-F302 HydrophobicContact CD1-CE2 4.27Å; F298-F302 VanDerWaalsContact O-CD2 3.24Å; F298-F302 WeakPolarHBondContact O-CD2 3.25Å; F298-F302 PolarHBondContact O-N 3.41Å
299G92.1Very high90Very high0 Ų067.5 Ų67.50%033%0.332CS..Hα-helixtrans-54.9-41.5176.200000112.9G134 I138 G295 L296 I297 T303G134-G299 CarbonylContact C-O 3.37Å; G134-G299 WeakPolarHBondContact CA-O 3.48Å; G134-G299 VanDerWaalsContact O-CA 3.28Å; G134-G299 WeakPolarHBondContact O-CA 3.45Å; I138-G299 VanDerWaalsContact CG1-C 3.48Å; G295-G299 PolarHBondContact O-N 2.88Å; L296-G299 PolarHBondContact O-N 2.99Å; I297-G299 VanDerWaalsContact C-N 3.34Å; I297-G299 PolarHBondContact O-N 3.33Å; G299-T303 WeakPolarHBondContact O-CG2 3.24Å; G299-T303 PolarHBondContact O-N 2.99Å; G299-T303 PolarHBondContact O-OG1 2.92Å
300L90.7Very high90Very high105 Ų10562.2 Ų62.255%0.5530%0.304SS..Hα-helixtrans-64.3-43.8174.4-172.967.6000112.2L296 I297 F298 T303 V304L296-L300 WeakPolarHBondContact O-CB 3.41Å; L296-L300 PolarHBondContact O-N 3.29Å; I297-L300 WeakPolarHBondContact O-CB 3.39Å; I297-L300 PolarHBondContact O-N 2.94Å; F298-L300 VanDerWaalsContact C-N 3.26Å; F298-L300 PolarHBondContact O-N 3.47Å; L300-T303 VanDerWaalsContact CA-OG1 3.3Å; L300-T303 WeakPolarHBondContact CA-OG1 3.33Å; L300-T303 PolarHBondContact O-N 3.36Å; L300-T303 PolarHBondContact O-OG1 3.44Å; L300-V304 HydrophobicContact CD1-CG2 4.49Å; L300-V304 WeakPolarHBondContact O-CB 3.29Å; L300-V304 VanDerWaalsContact O-CG2 3.29Å; L300-V304 WeakPolarHBondContact O-CG2 3.49Å; L300-V304 PolarHBondContact O-N 3.37Å
301I93.4Very high89.7Confident81 Ų8155.4 Ų55.442%0.41528%0.281SS..Hα-helixtrans-61-49.3177.3-68.1166.3000110.6I297 F298 T303 V304 L305I297-I301 HydrophobicContact CG2-CD1 3.98Å; I297-I301 WeakPolarHBondContact O-CG1 3.47Å; I297-I301 PolarHBondContact O-N 3.28Å; F298-I301 PolarHBondContact O-N 3.25Å; I301-T303 VanDerWaalsContact C-N 3.35Å; I301-T303 PolarHBondContact O-N 3.48Å; I301-V304 PolarHBondContact O-N 3.5Å; I301-L305 HydrophobicContact CG2-CD1 3.82Å; I301-L305 HydrophobicContact CG2-CG 4.35Å; I301-L305 WeakPolarHBondContact O-CB 3.29Å; I301-L305 VanDerWaalsContact O-CG 3.29Å; I301-L305 WeakPolarHBondContact O-CG 3.46Å; I301-L305 PolarHBondContact O-N 2.9Å
302F94.8Very high89.3Confident67 Ų6754 Ų5429%0.29428%0.279SS..Hα-helixtrans-62-41.3178.8-83.4-84.6000111.7V130 L133 G134 L137 F298 L305 G306V130-F302 HydrophobicContact CG1-CB 4.34Å; V130-F302 HydrophobicContact CG1-CD1 3.8Å; V130-F302 VanDerWaalsContact CG1-O 3.25Å; V130-F302 WeakPolarHBondContact CG1-O 3.4Å; L133-F302 HydrophobicContact CD2-CD1 3.72Å; L133-F302 HydrophobicContact CD2-CE1 3.7Å; L133-F302 HydrophobicContact CD2-CG 4.26Å; L133-F302 HydrophobicContact CD2-CZ 4.23Å; G134-F302 VanDerWaalsContact CA-CB 3.42Å; L137-F302 HydrophobicContact CD1-CD2 4.25Å; F298-F302 HydrophobicContact CD1-CE2 4.27Å; F298-F302 VanDerWaalsContact O-CD2 3.24Å; F298-F302 WeakPolarHBondContact O-CD2 3.25Å; F298-F302 PolarHBondContact O-N 3.41Å; F302-L305 PolarHBondContact O-N 3.28Å; F302-G306 PolarHBondContact O-N 3.48Å
303T90.7Very high88.7Confident5 Ų554.8 Ų54.83%0.03128%0.283CS..Hα-helixtrans-64.6-44.2176.646.60000112.6I138 V268 G299 L300 I301 G306 I307I138-T303 HydrophobicContact CD1-CG2 3.93Å; V268-T303 HydrophobicContact CG1-CG2 4Å; V268-T303 HydrophobicContact CG2-CG2 4.29Å; G299-T303 WeakPolarHBondContact O-CG2 3.24Å; G299-T303 PolarHBondContact O-N 2.99Å; G299-T303 PolarHBondContact O-OG1 2.92Å; L300-T303 VanDerWaalsContact CA-OG1 3.3Å; L300-T303 WeakPolarHBondContact CA-OG1 3.33Å; L300-T303 PolarHBondContact O-N 3.36Å; L300-T303 PolarHBondContact O-OG1 3.44Å; I301-T303 VanDerWaalsContact C-N 3.35Å; I301-T303 PolarHBondContact O-N 3.48Å; T303-G306 PolarHBondContact O-N 3.38Å; T303-I307 VanDerWaalsContact O-CG1 3.29Å; T303-I307 WeakPolarHBondContact O-CG1 3.31Å; T303-I307 PolarHBondContact O-N 3.35Å
304V89.2Confident87.8Confident71 Ų7153.1 Ų53.143%0.4328%0.278SS..Hα-helixtrans-62.7-45.9177170.90000111.3L300 I301 G306 I307 I308L300-V304 HydrophobicContact CD1-CG2 4.49Å; L300-V304 WeakPolarHBondContact O-CB 3.29Å; L300-V304 VanDerWaalsContact O-CG2 3.29Å; L300-V304 WeakPolarHBondContact O-CG2 3.49Å; L300-V304 PolarHBondContact O-N 3.37Å; I301-V304 PolarHBondContact O-N 3.5Å; V304-G306 PolarHBondContact O-N 3.06Å; V304-I307 PolarHBondContact O-N 2.95Å; V304-I308 HydrophobicContact CG1-CD1 3.88Å; V304-I308 WeakPolarHBondContact O-CG1 3.31Å; V304-I308 PolarHBondContact O-N 2.87Å
305L91.8Very high86.5Confident89 Ų8956.8 Ų56.847%0.46630%0.296SS..Hα-helixtrans-59.3-47.4176.2-72.9173.3000111.2V130 I301 F302 I307 I308 M309V130-L305 HydrophobicContact CG1-CB 4.31Å; I301-L305 HydrophobicContact CG2-CD1 3.82Å; I301-L305 HydrophobicContact CG2-CG 4.35Å; I301-L305 WeakPolarHBondContact O-CB 3.29Å; I301-L305 VanDerWaalsContact O-CG 3.29Å; I301-L305 WeakPolarHBondContact O-CG 3.46Å; I301-L305 PolarHBondContact O-N 2.9Å; F302-L305 PolarHBondContact O-N 3.28Å; L305-I307 VanDerWaalsContact C-N 3.33Å; L305-I307 PolarHBondContact O-N 2.97Å; L305-I308 PolarHBondContact O-N 2.94Å; L305-M309 VanDerWaalsContact O-CG 3.28Å; L305-M309 WeakPolarHBondContact O-CG 3.33Å; L305-M309 PolarHBondContact O-N 2.92Å
306G90.7Very high85Confident0 Ų058.6 Ų58.60%031%0.308CS..Hα-helixtrans-60.9-41178.100000112.5G127 C131 F302 T303 V304 M309 I310G127-G306 WeakPolarHBondContact O-CA 3.46Å; C131-G306 WeakPolarHBondContact SG-CA 3.37Å; F302-G306 PolarHBondContact O-N 3.48Å; T303-G306 PolarHBondContact O-N 3.38Å; V304-G306 PolarHBondContact O-N 3.06Å; G306-M309 PolarHBondContact O-N 3.28Å; G306-I310 WeakPolarHBondContact O-CB 3.37Å; G306-I310 VanDerWaalsContact O-CG1 3.25Å; G306-I310 WeakPolarHBondContact O-CG1 3.38Å; G306-I310 PolarHBondContact O-N 3.33Å
307I87.4Confident83.2Confident24 Ų2463.3 Ų63.312%0.12333%0.333CS..Hα-helixtrans-60.5-49.5175.6-71.2167.8000110C131 L265 V268 F269 T303 V304 L305 M309 I310 T311C131-I307 PolarHBondContact SG-N 2.92Å; L265-I307 HydrophobicContact CD2-CB 4.4Å; L265-I307 HydrophobicContact CD2-CG1 3.98Å; L265-I307 HydrophobicContact CD2-CG2 3.91Å; V268-I307 HydrophobicContact CB-CD1 4.45Å; V268-I307 HydrophobicContact CG1-CD1 3.74Å; V268-I307 HydrophobicContact CG1-CG1 4.41Å; F269-I307 HydrophobicContact CE1-CD1 4.12Å; F269-I307 HydrophobicContact CZ-CD1 4.34Å; T303-I307 VanDerWaalsContact O-CG1 3.29Å; T303-I307 WeakPolarHBondContact O-CG1 3.31Å; T303-I307 PolarHBondContact O-N 3.35Å; V304-I307 PolarHBondContact O-N 2.95Å; L305-I307 VanDerWaalsContact C-N 3.33Å; L305-I307 PolarHBondContact O-N 2.97Å; I307-M309 VanDerWaalsContact C-N 3.28Å; I307-M309 PolarHBondContact O-N 2.98Å; I307-I310 CarbonylContact O-C 3.6Å; I307-I310 PolarHBondContact O-N 3.43Å; I307-I310 VanDerWaalsContact O-N 3.07Å; I307-T311 HydrophobicContact CG2-CG2 4.14Å; I307-T311 WeakPolarHBondContact O-CG2 3.26Å; I307-T311 PolarHBondContact O-N 2.79Å; I307-T311 PolarHBondContact O-OG1 3.11Å
308I87.4Confident81.5Confident79 Ų7963 Ų6341%0.40533%0.328SS..Hα-helixtrans-58.1-43.1179.5-68.3167000110.5V304 L305 I310 T311 V312 L313V304-I308 HydrophobicContact CG1-CD1 3.88Å; V304-I308 WeakPolarHBondContact O-CG1 3.31Å; V304-I308 PolarHBondContact O-N 2.87Å; L305-I308 PolarHBondContact O-N 2.94Å; I308-I310 VanDerWaalsContact C-N 3.34Å; I308-I310 PolarHBondContact O-N 3.33Å; I308-T311 PolarHBondContact O-N 2.93Å; I308-V312 HydrophobicContact CG2-CB 4.29Å; I308-V312 HydrophobicContact CG2-CG2 4.09Å; I308-V312 WeakPolarHBondContact O-CA 3.41Å; I308-V312 VanDerWaalsContact O-CB 3.26Å; I308-V312 WeakPolarHBondContact O-CB 3.48Å; I308-V312 PolarHBondContact O-N 3.44Å; I308-L313 PolarHBondContact O-N 2.8Å
309M88.4Confident79.4Confident41 Ų4160.5 Ų60.520%0.20232%0.324CS..Hα-helixtrans-63.2-40176.7-66.2-175.478.800112.3I123 F126 L305 G306 I307 L313I123-M309 HydrophobicContact CG2-CB 4.31Å; I123-M309 HydrophobicContact CG2-CE 3.74Å; F126-M309 HydrophobicContact CB-CE 4.5Å; F126-M309 HydrophobicContact CD1-CE 3.36Å; F126-M309 HydrophobicContact CD1-SD 3.77Å; F126-M309 HydrophobicContact CE1-CE 3.98Å; F126-M309 HydrophobicContact CE1-SD 4.08Å; F126-M309 HydrophobicContact CG-CE 4.35Å; L305-M309 VanDerWaalsContact O-CG 3.28Å; L305-M309 WeakPolarHBondContact O-CG 3.33Å; L305-M309 PolarHBondContact O-N 2.92Å; G306-M309 PolarHBondContact O-N 3.28Å; I307-M309 VanDerWaalsContact C-N 3.28Å; I307-M309 PolarHBondContact O-N 2.98Å; M309-L313 HydrophobicContact CB-CD1 4.46Å; M309-L313 HydrophobicContact CG-CD1 4.11Å; M309-L313 CarbonylContact O-C 3.51Å; M309-L313 WeakPolarHBondContact O-CB 3.28Å; M309-L313 PolarHBondContact O-N 3.41Å
310I85Confident77.6Confident2 Ų267.4 Ų67.41%0.0135%0.35CS..Hα-helixtrans-74-32.8179.9-69.1165.8000112.3C128 C131 I261 P264 L265 G306 I307 I308 K314C128-I310 HydrophobicContact CB-CD1 4.31Å; C131-I310 HydrophobicContact CB-CD1 4.43Å; I261-I310 HydrophobicContact CB-CG2 4.21Å; I261-I310 HydrophobicContact CG1-CG2 4.12Å; I261-I310 HydrophobicContact CG2-CG2 3.89Å; P264-I310 HydrophobicContact CB-CD1 3.7Å; P264-I310 HydrophobicContact CG-CD1 4.22Å; L265-I310 HydrophobicContact CG-CG2 4.49Å; G306-I310 WeakPolarHBondContact O-CB 3.37Å; G306-I310 VanDerWaalsContact O-CG1 3.25Å; G306-I310 WeakPolarHBondContact O-CG1 3.38Å; G306-I310 PolarHBondContact O-N 3.33Å; I307-I310 CarbonylContact O-C 3.6Å; I307-I310 PolarHBondContact O-N 3.43Å; I307-I310 VanDerWaalsContact O-N 3.07Å; I308-I310 VanDerWaalsContact C-N 3.34Å; I308-I310 PolarHBondContact O-N 3.33Å; I310-K314 VanDerWaalsContact O-CB 3.31Å; I310-K314 WeakPolarHBondContact O-CB 3.43Å
311T80.7Confident75.9Confident33 Ų3370.2 Ų70.220%0.20236%0.358CS..Hα-helixtrans-97.7-42.8-173.859.90000113.4I191 L265 I307 I308I191-T311 HydrophobicContact CD1-CG2 4.26Å; I191-T311 HydrophobicContact CG1-CG2 4.32Å; L265-T311 HydrophobicContact CD1-CG2 4.06Å; L265-T311 HydrophobicContact CD2-CG2 4.03Å; I307-T311 HydrophobicContact CG2-CG2 4.14Å; I307-T311 WeakPolarHBondContact O-CG2 3.26Å; I307-T311 PolarHBondContact O-N 2.79Å; I307-T311 PolarHBondContact O-OG1 3.11Å; I308-T311 PolarHBondContact O-N 2.93Å
312V80.7Confident74.2Confident97 Ų9768.8 Ų68.859%0.58836%0.356SS*.THydrogen-bonded Turntrans-89.9-40.8-175.1-175.80000110.9I308 K314I308-V312 HydrophobicContact CG2-CB 4.29Å; I308-V312 HydrophobicContact CG2-CG2 4.09Å; I308-V312 WeakPolarHBondContact O-CA 3.41Å; I308-V312 VanDerWaalsContact O-CB 3.26Å; I308-V312 WeakPolarHBondContact O-CB 3.48Å; I308-V312 PolarHBondContact O-N 3.44Å; V312-K314 VanDerWaalsContact C-N 3.33Å
313L74.7Confident72.3Confident64 Ų6468.5 Ų68.534%0.33536%0.357SS..SBendtrans-96.517.7-175.3-50.3178.8000113.1I123 I308 M309 D315 S316I123-L313 HydrophobicContact CG2-CB 3.52Å; I123-L313 HydrophobicContact CG2-CD1 3.87Å; I123-L313 HydrophobicContact CG2-CG 4.36Å; I308-L313 PolarHBondContact O-N 2.8Å; M309-L313 HydrophobicContact CB-CD1 4.46Å; M309-L313 HydrophobicContact CG-CD1 4.11Å; M309-L313 CarbonylContact O-C 3.51Å; M309-L313 WeakPolarHBondContact O-CB 3.28Å; M309-L313 PolarHBondContact O-N 3.41Å; L313-D315 VanDerWaalsContact C-N 3.29Å; L313-D315 PolarHBondContact O-N 3.47Å; L313-S316 WeakPolarHBondContact CA-OG 3.47Å; L313-S316 PolarHBondContact O-OG 2.84Å
314K68.7Low70.8Confident61 Ų6175.7 Ų75.727%0.26538%0.383SS..SBendtrans-67.1-32.8-179.482.4-175-178.1-176.40112.2N121 I261 I310 V312N121-K314 PolarHBondContact ND2-O 2.96Å; I261-K314 HydrophobicContact CD1-CB 4.24Å; I261-K314 HydrophobicContact CD1-CD 3.77Å; I310-K314 VanDerWaalsContact O-CB 3.31Å; I310-K314 WeakPolarHBondContact O-CB 3.43Å; V312-K314 VanDerWaalsContact C-N 3.33Å
315D63.4Low69.5Low117 Ų11776.2 Ų76.263%0.62639%0.387SS*.SBendtrans-95.8-6.5-173.6-60.4-43.9000112.9L313 N317L313-D315 VanDerWaalsContact C-N 3.29Å; L313-D315 PolarHBondContact O-N 3.47Å; D315-N317 PolarHBondContact O-N 3.05Å
316S60.5Low67.5Low45 Ų4577 Ų7732%0.31539%0.391SS..  trans-72.3103.6173.216.50000109.3L313 F318L313-S316 WeakPolarHBondContact CA-OG 3.47Å; L313-S316 PolarHBondContact O-OG 2.84Å; S316-F318 PolarHBondContact O-N 3.47Å
317N53.1Low65.9Low135 Ų13583.7 Ų83.772%0.72242%0.42SS*.  trans-6852176.2-70.6-26.8000112.7N121 D315 S319N121-N317 PolarHBondContact ND2-OD1 2.73Å; D315-N317 PolarHBondContact O-N 3.05Å; N317-S319 PolarHBondContact O-N 2.95Å
318F53.4Low64.5Low96 Ų9689 Ų8942%0.42144%0.444SS..  trans-76.783172.5-150.8-94.3000108.5I123 S316 L323 L326I123-F318 HydrophobicContact CD1-CB 3.64Å; I123-F318 HydrophobicContact CG1-CB 4.13Å; S316-F318 PolarHBondContact O-N 3.47Å; F318-L323 HydrophobicContact CE1-CB 3.96Å; F318-L323 HydrophobicContact CE1-CD1 4.06Å; F318-L323 HydrophobicContact CE1-CG 4.48Å; F318-L323 HydrophobicContact CZ-CD1 4.39Å; F318-L326 HydrophobicContact CZ-CD1 4.4Å
319S51.6Low62.8Low58 Ų5887.4 Ų87.441%0.40644%0.443SS..  trans-67.7135.4174-1780000109.4N317 K321 S322N317-S319 PolarHBondContact O-N 2.95Å; S319-K321 PolarHBondContact O-N 2.9Å; S319-S322 WeakPolarHBondContact O-CB 3.39Å; S319-S322 PolarHBondContact O-N 3.07Å
320W52.9Low60.6Low145 Ų14592.7 Ų92.755%0.54947%0.465SS..Hα-helixtrans-53.5-21.7176.2-123.885.5000113.3C122 S322 L323 R324C122-W320 VanDerWaalsContact SG-CD1 3.57Å; W320-S322 VanDerWaalsContact C-N 3.35Å; W320-L323 PolarHBondContact O-N 3.41Å; W320-R324 HydrophobicContact CE3-CG 3.87Å; W320-R324 HydrophobicContact CZ3-CG 4Å; W320-R324 PolarHBondContact O-N 2.83Å
321K54.9Low58.7Low164 Ų164100 Ų10071%0.71350%0.499SS*.Hα-helixtrans-61.4-40.6171.5-68.9-176.4178-178.80112S319 L323 R324 T325S319-K321 PolarHBondContact O-N 2.9Å; K321-L323 VanDerWaalsContact C-N 3.35Å; K321-L323 PolarHBondContact O-N 3.31Å; K321-R324 PolarHBondContact O-N 2.98Å; K321-T325 WeakPolarHBondContact O-CG2 3.47Å; K321-T325 PolarHBondContact O-N 3.32Å; K321-T325 PolarHBondContact O-OG1 3.49Å
322S58.1Low56.8Low52 Ų52101.3 Ų101.336%0.36451%0.509SS..Hα-helixtrans-69.5-30.4178.7-49.80000112.9S319 W320 T325 L326S319-S322 WeakPolarHBondContact O-CB 3.39Å; S319-S322 PolarHBondContact O-N 3.07Å; W320-S322 VanDerWaalsContact C-N 3.35Å; S322-T325 WeakPolarHBondContact CA-OG1 3.21Å; S322-T325 PolarHBondContact O-OG1 3.16Å; S322-L326 WeakPolarHBondContact O-CG 3.26Å; S322-L326 PolarHBondContact O-N 2.83Å; S322-L326 VanDerWaalsContact O-N 3.16Å
323L55.3Low54.9Low61 Ų61102.4 Ų102.432%0.31951%0.51SS..Hα-helixtrans-74.9-38173.6-168.465.8000111.6F318 W320 K321 L326 F327F318-L323 HydrophobicContact CE1-CB 3.96Å; F318-L323 HydrophobicContact CE1-CD1 4.06Å; F318-L323 HydrophobicContact CE1-CG 4.48Å; F318-L323 HydrophobicContact CZ-CD1 4.39Å; W320-L323 PolarHBondContact O-N 3.41Å; K321-L323 VanDerWaalsContact C-N 3.35Å; K321-L323 PolarHBondContact O-N 3.31Å; L323-L326 PolarHBondContact O-N 3.38Å; L323-F327 HydrophobicContact CD1-CD2 4.28Å; L323-F327 HydrophobicContact CD1-CE2 4.41Å; L323-F327 HydrophobicContact CG-CD2 4.2Å; L323-F327 PolarHBondContact O-N 2.9Å
324R59Low53Low155 Ų155109.8 Ų109.859%0.58554%0.535SS*.Hα-helixtrans-63.8-40.2173.7-78.3-174.2-175.9-162.41.1111.8W320 K321 F327 Q328W320-R324 HydrophobicContact CE3-CG 3.87Å; W320-R324 HydrophobicContact CZ3-CG 4Å; W320-R324 PolarHBondContact O-N 2.83Å; K321-R324 PolarHBondContact O-N 2.98Å; R324-F327 PolarHBondContact O-N 3.35Å; R324-Q328 VanDerWaalsContact O-CB 3.27Å; R324-Q328 WeakPolarHBondContact O-CB 3.27Å; R324-Q328 VanDerWaalsContact O-CG 3.26Å; R324-Q328 WeakPolarHBondContact O-CG 3.34Å; R324-Q328 PolarHBondContact O-N 2.9Å
325T62.2Low51.5Low82 Ų82111.1 Ų111.150%0.50355%0.552SS.*Hα-helixtrans-66.2-38.7175.352.30000111.7K321 S322 Q328 A329K321-T325 WeakPolarHBondContact O-CG2 3.47Å; K321-T325 PolarHBondContact O-N 3.32Å; K321-T325 PolarHBondContact O-OG1 3.49Å; S322-T325 WeakPolarHBondContact CA-OG1 3.21Å; S322-T325 PolarHBondContact O-OG1 3.16Å; T325-Q328 PolarHBondContact O-N 3.45Å; T325-A329 WeakPolarHBondContact O-CB 3.42Å; T325-A329 PolarHBondContact O-N 3.01Å
326L50.1Low50.2Low106 Ų106107.8 Ų107.856%0.55554%0.538SS*.Hα-helixtrans-64.3-41.6172.9-80166.3000113.1F318 S322 L323 K330F318-L326 HydrophobicContact CZ-CD1 4.4Å; S322-L326 WeakPolarHBondContact O-CG 3.26Å; S322-L326 PolarHBondContact O-N 2.83Å; S322-L326 VanDerWaalsContact O-N 3.16Å; L323-L326 PolarHBondContact O-N 3.38Å; L326-K330 WeakPolarHBondContact O-CB 3.47Å; L326-K330 PolarHBondContact O-N 3.14Å
327F56.2Low48.9Very low141 Ų141110.8 Ų110.862%0.61856%0.559SS**Hα-helixtrans-70.6-36.8176.5-102-84.6000112.6L323 R324 K330 H331L323-F327 HydrophobicContact CD1-CD2 4.28Å; L323-F327 HydrophobicContact CD1-CE2 4.41Å; L323-F327 HydrophobicContact CG-CD2 4.2Å; L323-F327 PolarHBondContact O-N 2.9Å; R324-F327 PolarHBondContact O-N 3.35Å; F327-K330 PolarHBondContact O-N 3.3Å; F327-H331 PolarHBondContact O-N 2.84Å; F327-H331 VanDerWaalsContact O-N 3.14Å
328Q57.9Low48Very low135 Ų135111.7 Ų111.763%0.63156%0.564SS**Hα-helixtrans-68.4-39.8174.4-76176-17.400111.6R324 T325 K330 H331 S332R324-Q328 VanDerWaalsContact O-CB 3.27Å; R324-Q328 WeakPolarHBondContact O-CB 3.27Å; R324-Q328 VanDerWaalsContact O-CG 3.26Å; R324-Q328 WeakPolarHBondContact O-CG 3.34Å; R324-Q328 PolarHBondContact O-N 2.9Å; T325-Q328 PolarHBondContact O-N 3.45Å; Q328-K330 VanDerWaalsContact C-N 3.31Å; Q328-K330 PolarHBondContact O-N 2.84Å; Q328-H331 PolarHBondContact O-N 3.39Å; Q328-H331 VanDerWaalsContact O-N 3.15Å; Q328-S332 PolarHBondContact O-N 3.3Å
329A52.4Low47.2Very low45 Ų45110 Ų11037%0.37256%0.564SS.*Hα-helixtrans-63.7-35.5173.300000112.2T325 H331 S332 I333T325-A329 WeakPolarHBondContact O-CB 3.42Å; T325-A329 PolarHBondContact O-N 3.01Å; A329-H331 VanDerWaalsContact C-N 3.31Å; A329-H331 PolarHBondContact O-N 3.4Å; A329-S332 WeakPolarHBondContact CA-OG 3.47Å; A329-S332 PolarHBondContact O-N 3.06Å; A329-S332 PolarHBondContact O-OG 2.88Å; A329-I333 WeakPolarHBondContact O-CD1 3.33Å; A329-I333 VanDerWaalsContact O-CG1 3.29Å; A329-I333 WeakPolarHBondContact O-CG1 3.46Å; A329-I333 PolarHBondContact O-N 2.98Å
330K41.1Very low46.4Very low153 Ų153111.6 Ų111.667%0.66558%0.575SS**Hα-helixtrans-69.3-29174.7-162.8174-176.9-177.30112.5L326 F327 Q328L326-K330 WeakPolarHBondContact O-CB 3.47Å; L326-K330 PolarHBondContact O-N 3.14Å; F327-K330 PolarHBondContact O-N 3.3Å; Q328-K330 VanDerWaalsContact C-N 3.31Å; Q328-K330 PolarHBondContact O-N 2.84Å
331H45.6Very low45.6Very low156 Ų156112.2 Ų112.272%0.72258%0.582SS**Hα-helixtrans-80.3-26.3176.6-142.1-68.4000112.9F327 Q328 A329F327-H331 PolarHBondContact O-N 2.84Å; F327-H331 VanDerWaalsContact O-N 3.14Å; Q328-H331 PolarHBondContact O-N 3.39Å; Q328-H331 VanDerWaalsContact O-N 3.15Å; A329-H331 VanDerWaalsContact C-N 3.31Å; A329-H331 PolarHBondContact O-N 3.4Å
332S41.8Very low44.9Very low59 Ų59108.9 Ų108.941%0.41357%0.572SS.*Hα-helixtrans-75.5-28.917457.20000113.3Q328 A329 Y334 S335 S336Q328-S332 PolarHBondContact O-N 3.3Å; A329-S332 WeakPolarHBondContact CA-OG 3.47Å; A329-S332 PolarHBondContact O-N 3.06Å; A329-S332 PolarHBondContact O-OG 2.88Å; S332-Y334 VanDerWaalsContact C-N 3.29Å; S332-Y334 PolarHBondContact O-N 3.47Å; S332-S335 PolarHBondContact O-N 3.35Å; S332-S335 PolarHBondContact O-OG 3.39Å; S332-S335 VanDerWaalsContact O-OG 3.08Å; S332-S336 VanDerWaalsContact O-CB 3.28Å; S332-S336 WeakPolarHBondContact O-CB 3.22Å; S332-S336 PolarHBondContact O-N 3.4Å; S332-S336 VanDerWaalsContact O-N 3.11Å; S332-S336 PolarHBondContact O-OG 3.37Å
333I40.6Very low43.9Very low121 Ų121112.6 Ų112.662%0.62159%0.585SS**Hα-helixtrans-69-25.5179.8-69.4165.5000112.4A329 S336A329-I333 WeakPolarHBondContact O-CD1 3.33Å; A329-I333 VanDerWaalsContact O-CG1 3.29Å; A329-I333 WeakPolarHBondContact O-CG1 3.46Å; A329-I333 PolarHBondContact O-N 2.98Å; I333-S336 PolarHBondContact O-OG 3.4Å
334Y34.3Very low43.1Very low219 Ų219116.5 Ų116.586%0.85960%0.601SS**THydrogen-bonded Turntrans-83-16.5174.8-116.3-90.3000113.8S332S332-Y334 VanDerWaalsContact C-N 3.29Å; S332-Y334 PolarHBondContact O-N 3.47Å
335S36.3Very low42.1Very low89 Ų89111.8 Ų111.862%0.62259%0.588SS**THydrogen-bonded Turntrans-100.4-8.5175.357.80000114.1S332 S337S332-S335 PolarHBondContact O-N 3.35Å; S332-S335 PolarHBondContact O-OG 3.39Å; S332-S335 VanDerWaalsContact O-OG 3.08Å; S335-S337 PolarHBondContact O-N 3.45Å
336S36.9Very low41.3Very low46 Ų46114.3 Ų114.332%0.32259%0.592SS.*THydrogen-bonded Turntrans-97.123.5-170.5670000115.2S332 I333 N338 S339S332-S336 VanDerWaalsContact O-CB 3.28Å; S332-S336 WeakPolarHBondContact O-CB 3.22Å; S332-S336 PolarHBondContact O-N 3.4Å; S332-S336 VanDerWaalsContact O-N 3.11Å; S332-S336 PolarHBondContact O-OG 3.37Å; I333-S336 PolarHBondContact O-OG 3.4Å; S336-N338 PolarHBondContact O-N 2.9Å; S336-S339 WeakPolarHBondContact CA-OG 3.33Å; S336-S339 WeakPolarHBondContact CB-OG 3.35Å
337S34.1Very low40.8Very low109 Ų109114.3 Ų114.376%0.76259%0.592SS**THydrogen-bonded Turntrans-69.4-14.3168.8-174.60000112.8S335S335-S337 PolarHBondContact O-N 3.45Å
338N34.1Very low39.9Very low154 Ų154114.4 Ų114.482%0.82459%0.589SS**THydrogen-bonded Turntrans-121.8-1.2-178.2-82.4-12.2000115.1S336S336-N338 PolarHBondContact O-N 2.9Å
339S36.4Very low39.1Very low59 Ų59117.1 Ų117.141%0.41359%0.593SS.*THydrogen-bonded Turntrans-108.2-6.4-170.564.50000115.5S336 F341 D342 M343S336-S339 WeakPolarHBondContact CA-OG 3.33Å; S336-S339 WeakPolarHBondContact CB-OG 3.35Å; S339-F341 VanDerWaalsContact C-N 3.28Å; S339-F341 PolarHBondContact O-N 2.96Å; S339-D342 PolarHBondContact O-N 2.79Å; S339-M343 PolarHBondContact O-N 3.01Å
340S34.4Very low38.6Very low92 Ų92124.6 Ų124.664%0.64361%0.612SS**Hα-helixtrans-66.8-28.3179.157.30000112.9
341F36.6Very low38.5Very low159 Ų159122.8 Ų122.870%0.69761%0.608SS**Hα-helixtrans-74.8-29.9175.9-166.8-104.8000113.1S339 N345S339-F341 VanDerWaalsContact C-N 3.28Å; S339-F341 PolarHBondContact O-N 2.96Å; F341-N345 WeakPolarHBondContact CE1-ND2 3.38Å; F341-N345 PolarHBondContact O-N 3.27Å; F341-N345 PolarHBondContact O-ND2 3.23Å
342D38.4Very low38.2Very low93 Ų93120 Ų12050%0.49760%0.598SS.*Hα-helixtrans-86.1-30.1-171.8-147.735000112.5S339 K346S339-D342 PolarHBondContact O-N 2.79Å; D342-K346 PolarHBondContact O-N 3.06Å; D342-K346 VanDerWaalsContact O-N 3.11Å
343M38Very low38.1Very low131 Ų131121.2 Ų121.265%0.64561%0.611SS**Hα-helixtrans-73.7-38.2175.4-165.4158.8176.500112.2S339 N345 K346 L347S339-M343 PolarHBondContact O-N 3.01Å; M343-N345 VanDerWaalsContact C-N 3.35Å; M343-K346 PolarHBondContact O-N 3.42Å; M343-L347 PolarHBondContact O-N 3.15Å; M343-L347 VanDerWaalsContact O-N 3.11Å
344H38.7Very low37.9Very low143 Ų143124.3 Ų124.366%0.66262%0.62SS**Hα-helixtrans-64.8-39.7174.6-147.680.9000111.3L347 Y348H344-L347 PolarHBondContact O-N 3.44Å; H344-Y348 VanDerWaalsContact O-CB 3.24Å; H344-Y348 WeakPolarHBondContact O-CB 3.2Å; H344-Y348 PolarHBondContact O-N 2.87Å
345N38.4Very low37.8Very low55 Ų55122.3 Ų122.329%0.29462%0.616SS.*Hα-helixtrans-67.3-34175.2-86.6-36.7000113.8F341 M343 R349F341-N345 WeakPolarHBondContact CE1-ND2 3.38Å; F341-N345 PolarHBondContact O-N 3.27Å; F341-N345 PolarHBondContact O-ND2 3.23Å; M343-N345 VanDerWaalsContact C-N 3.35Å; N345-R349 WeakPolarHBondContact O-CB 3.48Å; N345-R349 WeakPolarHBondContact O-CG 3.46Å; N345-R349 PolarHBondContact O-N 3.21Å
346K44.2Very low37.7Very low136 Ų136122.2 Ų122.259%0.59161%0.614SS**Hα-helixtrans-70.2-40.5175.3-80.7177.1-177.7169.90112.6D342 M343 R350D342-K346 PolarHBondContact O-N 3.06Å; D342-K346 VanDerWaalsContact O-N 3.11Å; M343-K346 PolarHBondContact O-N 3.42Å; K346-R350 WeakPolarHBondContact O-CG 3.29Å; K346-R350 PolarHBondContact O-N 3.39Å; K346-R350 VanDerWaalsContact O-N 3.13Å
347L40.2Very low37.4Very low105 Ų105126.6 Ų126.655%0.5564%0.639SS.*Hα-helixtrans-66.6-44.4173.7-110.9108.1000111.3M343 H344 R349 R350 I351M343-L347 PolarHBondContact O-N 3.15Å; M343-L347 VanDerWaalsContact O-N 3.11Å; H344-L347 PolarHBondContact O-N 3.44Å; L347-R349 PolarHBondContact O-N 3.43Å; L347-R350 PolarHBondContact O-N 3.44Å; L347-I351 HydrophobicContact CD2-CD1 4.45Å; L347-I351 VanDerWaalsContact O-CG1 3.31Å; L347-I351 WeakPolarHBondContact O-CG1 3.42Å; L347-I351 PolarHBondContact O-N 3.47Å
348Y38.6Very low37.2Very low144 Ų144126.9 Ų126.957%0.56564%0.64SS**Hα-helixtrans-62.4-41.6178.7-159.2-101.6000112.1H344 I351 I352H344-Y348 VanDerWaalsContact O-CB 3.24Å; H344-Y348 WeakPolarHBondContact O-CB 3.2Å; H344-Y348 PolarHBondContact O-N 2.87Å; Y348-I351 PolarHBondContact O-N 3.01Å; Y348-I352 HydrophobicContact CD1-CD1 3.44Å; Y348-I352 VanDerWaalsContact CD1-CD1 3.44Å; Y348-I352 HydrophobicContact CD1-CG1 4.44Å; Y348-I352 HydrophobicContact CE1-CD1 3.22Å; Y348-I352 HydrophobicContact CE1-CG1 4.38Å; Y348-I352 HydrophobicContact CG-CD1 4.33Å; Y348-I352 VanDerWaalsContact O-CG1 3.31Å; Y348-I352 WeakPolarHBondContact O-CG1 3.37Å; Y348-I352 PolarHBondContact O-N 3.46Å
349R40.2Very low36.9Very low191 Ų191127 Ų12772%0.72164%0.641SS**Hα-helixtrans-65.6-36.7174.1-77-169.5-154.8-160.98.4113.3N345 L347 A353N345-R349 WeakPolarHBondContact O-CB 3.48Å; N345-R349 WeakPolarHBondContact O-CG 3.46Å; N345-R349 PolarHBondContact O-N 3.21Å; L347-R349 PolarHBondContact O-N 3.43Å; R349-A353 WeakPolarHBondContact O-CB 3.47Å; R349-A353 PolarHBondContact O-N 3.41Å
350R41.3Very low36.4Very low202 Ų202127.5 Ų127.576%0.76266%0.655SS**Hα-helixtrans-72.5-32.5178.3-79-177.7174.8-177-1.9112.6K346 L347K346-R350 WeakPolarHBondContact O-CG 3.29Å; K346-R350 PolarHBondContact O-N 3.39Å; K346-R350 VanDerWaalsContact O-N 3.13Å; L347-R350 PolarHBondContact O-N 3.44Å
351I40.6Very low36.1Very low115 Ų115129 Ų12959%0.5967%0.666SS**Hα-helixtrans-71.2-38.3173.9-67.4167000111L347 Y348 F354L347-I351 HydrophobicContact CD2-CD1 4.45Å; L347-I351 VanDerWaalsContact O-CG1 3.31Å; L347-I351 WeakPolarHBondContact O-CG1 3.42Å; L347-I351 PolarHBondContact O-N 3.47Å; Y348-I351 PolarHBondContact O-N 3.01Å; I351-F354 WeakPolarHBondContact O-CB 3.45Å; I351-F354 PolarHBondContact O-N 3.29Å
352I37.4Very low35.8Very low99 Ų99131 Ų13151%0.50867%0.674SS.*Hα-helixtrans-73.6-28.6177.7-67.5173.4000112.7Y348 F354 K355Y348-I352 HydrophobicContact CD1-CD1 3.44Å; Y348-I352 VanDerWaalsContact CD1-CD1 3.44Å; Y348-I352 HydrophobicContact CD1-CG1 4.44Å; Y348-I352 HydrophobicContact CE1-CD1 3.22Å; Y348-I352 HydrophobicContact CE1-CG1 4.38Å; Y348-I352 HydrophobicContact CG-CD1 4.33Å; Y348-I352 VanDerWaalsContact O-CG1 3.31Å; Y348-I352 WeakPolarHBondContact O-CG1 3.37Å; Y348-I352 PolarHBondContact O-N 3.46Å; I352-F354 PolarHBondContact O-N 2.89Å; I352-K355 PolarHBondContact O-N 3.47Å
353A39.6Very low35.3Very low83 Ų83133.3 Ų133.369%0.68669%0.692SS**THydrogen-bonded Turntrans-64.1-18.4172.200000112.7R349 K355R349-A353 WeakPolarHBondContact O-CB 3.47Å; R349-A353 PolarHBondContact O-N 3.41Å; A353-K355 PolarHBondContact O-N 3.21Å
354F36.7Very low34.9Very low186 Ų186135.7 Ų135.782%0.81670%0.702SS**  trans-87.850.1172.9-126.7-86.9000111.7I351 I352 P356I351-F354 WeakPolarHBondContact O-CB 3.45Å; I351-F354 PolarHBondContact O-N 3.29Å; I352-F354 PolarHBondContact O-N 2.89Å; F354-P356 WeakPolarHBondContact O-CD 3.28Å
355K31.9Very low34.4Very low177 Ų177137.8 Ų137.877%0.7771%0.711SS**  trans-88.9112.4168-157.1176.5-171-179.70107.1I352 A353 T357I352-K355 PolarHBondContact O-N 3.47Å; A353-K355 PolarHBondContact O-N 3.21Å; K355-T357 PolarHBondContact O-N 3.33Å; K355-T357 VanDerWaalsContact O-N 3.11Å
356P35.5Very low34Very low88 Ų88142.3 Ų142.357%0.57174%0.736SS**  trans-65.5120.8175.327.8-30.4000107F354 S358 M417F354-P356 WeakPolarHBondContact O-CD 3.28Å; P356-S358 VanDerWaalsContact C-N 3.29Å; P356-S358 PolarHBondContact O-N 3.1Å; P356-M417 HydrophobicContact CG-CE 4.17Å
357T30.3Very low33Very low138 Ų138147.3 Ų147.385%0.84775%0.751SS**  trans-63.392.8170.637.40000108.2K355 N359K355-T357 PolarHBondContact O-N 3.33Å; K355-T357 VanDerWaalsContact O-N 3.11Å; T357-N359 PolarHBondContact O-N 3.4Å
358S29.2Very low32.5Very low114 Ų114151.4 Ų151.480%0.79777%0.767SS**  trans-71.684.2165.1163.10000108.2P356P356-S358 VanDerWaalsContact C-N 3.29Å; P356-S358 PolarHBondContact O-N 3.1Å
359N28.1Very low31.9Very low158 Ų158152.2 Ų152.285%0.84578%0.78SS**  trans-129.9112.2160.6-98.3-4.3000109.4T357T357-N359 PolarHBondContact O-N 3.4Å
360G27.3Very low31.4Very low68 Ų68146.1 Ų146.170%0.70177%0.766SS**  trans86.4124.2137.500000118.3
361S27.4Very low31.1Very low125 Ų125144 Ų14487%0.87476%0.763SS**  trans82.7114.2148.660.30000119.9
362K29.4Very low31Very low199 Ų199144.4 Ų144.487%0.86577%0.767SS**  trans-57.6131163.3-59162.5173.1175.70109.9
363T27.9Very low31Very low142 Ų142146.1 Ų146.187%0.87177%0.772SS**  179.5145.412227.50000112.5
364Q31.3Very low30.6Very low182 Ų182148.4 Ų148.485%0.8577%0.77SS**  trans-38.1137176.4-74.7163.5-38.900116.9
365H28.3Very low30.9Very low186 Ų186142.1 Ų142.186%0.86175%0.749SS**  -162.4146.3117.5-12830.8000114.1R367H365-R367 PolarHBondContact O-N 3.46Å
366N27.9Very low31.3Very low151 Ų151135.7 Ų135.781%0.80773%0.725SS**  trans-54.5119.3178.2-80.1-32.1000112.8
367R24.7Very low31.6Very low240 Ų240138 Ų13891%0.90673%0.729SS**  trans17691.6147.9-100.1172.4-166.1177.55.1107.4H365H365-R367 PolarHBondContact O-N 3.46Å
368H28.9Very low32.1Very low191 Ų191138.2 Ų138.288%0.88472%0.718SS**  trans-118.470.8170.2-103.9-71.7000109.7
369L26.6Very low32.6Very low161 Ų161137 Ų13784%0.84370%0.702SS**SBendtrans-111.8127.4149.7-99104.9000107.6
370S30Very low33.4Very low63 Ų63133.1 Ų133.144%0.44168%0.68SS.*  trans58.655.6146.964.30000120.3
371F33.6Very low34.4Very low158 Ų158134 Ų13469%0.69368%0.676SS**Hα-helixtrans-86-33.5163.6-159.2-98.8000112.9S375F371-S375 PolarHBondContact O-N 3.32Å; F371-S375 PolarHBondContact O-OG 3.37Å
372D39.9Very low35.3Very low124 Ų124133.5 Ų133.566%0.66366%0.663SS**Hα-helixtrans-72.4-38.6178.9-75.3-16.9000112.1S375 T376D372-S375 PolarHBondContact O-N 2.76Å; D372-T376 PolarHBondContact O-N 3.23Å; D372-T376 PolarHBondContact O-OG1 3.24Å; D372-T376 VanDerWaalsContact O-OG1 3.08Å
373Q35.7Very low36.1Very low134 Ų134127.6 Ų127.663%0.62664%0.639SS**Hα-helixtrans-67.4-40.7178.2-80.2177.9-47.400112.6S375 T376 E377Q373-S375 VanDerWaalsContact C-N 3.29Å; Q373-S375 PolarHBondContact O-N 3.08Å; Q373-T376 WeakPolarHBondContact CA-OG1 3.49Å; Q373-T376 PolarHBondContact O-N 3.08Å; Q373-T376 PolarHBondContact O-OG1 3.39Å; Q373-E377 PolarHBondContact O-N 3.39Å
374M31.8Very low36.9Very low131 Ų131127.9 Ų127.965%0.64563%0.63SS**Hα-helixtrans-67-32.2179.9-164.3175.2-122.300112K378M374-K378 VanDerWaalsContact O-CB 3.28Å; M374-K378 WeakPolarHBondContact O-CB 3.4Å; M374-K378 PolarHBondContact O-N 3.11Å
375S44.2Very low37.3Very low54 Ų54130.2 Ų130.238%0.37863%0.632SS.*Hα-helixtrans-71.9-39.2176.5-59.60000111.7F371 D372 Q373 L379F371-S375 PolarHBondContact O-N 3.32Å; F371-S375 PolarHBondContact O-OG 3.37Å; D372-S375 PolarHBondContact O-N 2.76Å; Q373-S375 VanDerWaalsContact C-N 3.29Å; Q373-S375 PolarHBondContact O-N 3.08Å; S375-L379 WeakPolarHBondContact O-CB 3.33Å; S375-L379 PolarHBondContact O-N 3.3Å; S375-L379 VanDerWaalsContact O-N 3.1Å
376T40.5Very low38.1Very low43 Ų43125.6 Ų125.626%0.26461%0.614SS.*Hα-helixtrans-68.8-41.6173.741.60000112.9D372 Q373 K378 L379 I380 L396D372-T376 PolarHBondContact O-N 3.23Å; D372-T376 PolarHBondContact O-OG1 3.24Å; D372-T376 VanDerWaalsContact O-OG1 3.08Å; Q373-T376 WeakPolarHBondContact CA-OG1 3.49Å; Q373-T376 PolarHBondContact O-N 3.08Å; Q373-T376 PolarHBondContact O-OG1 3.39Å; T376-K378 VanDerWaalsContact C-N 3.33Å; T376-K378 PolarHBondContact O-N 3.22Å; T376-L379 PolarHBondContact O-N 3.4Å; T376-I380 WeakPolarHBondContact O-CD1 3.5Å; T376-I380 WeakPolarHBondContact O-CG1 3.26Å; T376-I380 PolarHBondContact O-N 3.07Å; T376-L396 HydrophobicContact CG2-CD2 4.29Å
377E39.9Very low38.8Very low137 Ų137122.8 Ų122.864%0.6461%0.606SS**Hα-helixtrans-64.7-37.9176.2-80-174.1158.200111.9Q373 I380 S381Q373-E377 PolarHBondContact O-N 3.39Å; E377-I380 PolarHBondContact O-N 3.2Å; E377-S381 WeakPolarHBondContact O-CB 3.42Å; E377-S381 PolarHBondContact O-N 3.48Å
378K42.6Very low39.7Very low142 Ų142118.8 Ų118.862%0.61760%0.598SS**Hα-helixtrans-67.6-38.3176.4-156.7172.9-172.9-177.30112.2M374 T376 S381 D382M374-K378 VanDerWaalsContact O-CB 3.28Å; M374-K378 WeakPolarHBondContact O-CB 3.4Å; M374-K378 PolarHBondContact O-N 3.11Å; T376-K378 VanDerWaalsContact C-N 3.33Å; T376-K378 PolarHBondContact O-N 3.22Å; K378-S381 PolarHBondContact O-N 3.29Å; K378-D382 WeakPolarHBondContact O-CB 3.28Å; K378-D382 PolarHBondContact O-N 3.44Å
379L38.9Very low40.3Very low89 Ų89113 Ų11347%0.46657%0.573SS.*Hα-helixtrans-65.9-37.5172.9-108.1136.5000113S375 T376 H383S375-L379 WeakPolarHBondContact O-CB 3.33Å; S375-L379 PolarHBondContact O-N 3.3Å; S375-L379 VanDerWaalsContact O-N 3.1Å; T376-L379 PolarHBondContact O-N 3.4Å; L379-H383 PolarHBondContact O-N 3.03Å
380I45.4Very low41.1Very low75 Ų75106.9 Ų106.939%0.38554%0.543SS..Hα-helixtrans-68.4-40.6174.7-66.9163.6000110.7T376 E377 H384 V393T376-I380 WeakPolarHBondContact O-CD1 3.5Å; T376-I380 WeakPolarHBondContact O-CG1 3.26Å; T376-I380 PolarHBondContact O-N 3.07Å; E377-I380 PolarHBondContact O-N 3.2Å; I380-H384 PolarHBondContact O-N 2.92Å; I380-V393 HydrophobicContact CD1-CG1 3.95Å; I380-V393 HydrophobicContact CG1-CG1 3.58Å
381S47.5Very low41.7Very low88 Ų88108.6 Ų108.662%0.61555%0.547SS*.Hα-helixtrans-63.2-45.3177.3173.70000112.3E377 K378 H383E377-S381 WeakPolarHBondContact O-CB 3.42Å; E377-S381 PolarHBondContact O-N 3.48Å; K378-S381 PolarHBondContact O-N 3.29Å; S381-H383 VanDerWaalsContact C-N 3.33Å; S381-H383 PolarHBondContact O-N 3.16Å
382D45.5Very low42.2Very low114 Ų114105.5 Ų105.561%0.6154%0.54SS*.Hα-helixtrans-76.2-19.6-174.3-71.2-15.5000113.1K378K378-D382 WeakPolarHBondContact O-CB 3.28Å; K378-D382 PolarHBondContact O-N 3.44Å
383H47.5Very low42.3Very low75 Ų75100.5 Ų100.535%0.34752%0.515SS..THydrogen-bonded Turntrans-121.426.4-174.7-80.2-74.8000115L379 S381 Y385 D386 L389L379-H383 PolarHBondContact O-N 3.03Å; S381-H383 VanDerWaalsContact C-N 3.33Å; S381-H383 PolarHBondContact O-N 3.16Å; H383-Y385 PolarHBondContact O-N 3.44Å; H383-D386 IonicContact ND1-OD2 3.06Å; H383-D386 PolarHBondContact ND1-OD2 3.37Å; H383-D386 PolarHBondContact O-N 3.07Å; H383-L389 HydrophobicContact CB-CD2 3.74Å
384H43.9Very low42.6Very low148 Ų148100.2 Ų100.269%0.68551%0.513SS*.THydrogen-bonded Turntrans-59.6-8.7-176.9-16028.1000115.4I380I380-H384 PolarHBondContact O-N 2.92Å
385Y39.5Very low43Very low230 Ų23098.8 Ų98.890%0.90251%0.508SS*.THydrogen-bonded Turntrans-97.2-9.5177-77-83.9000115.2H383H383-Y385 PolarHBondContact O-N 3.44Å
386D46.2Very low42.7Very low90 Ų9099.9 Ų99.948%0.48151%0.509SS..  trans-101.998.2180-80.1-38.8000111H383 E388 L389 T390H383-D386 IonicContact ND1-OD2 3.06Å; H383-D386 PolarHBondContact ND1-OD2 3.37Å; H383-D386 PolarHBondContact O-N 3.07Å; D386-E388 VanDerWaalsContact C-N 3.29Å; D386-E388 PolarHBondContact O-N 3.03Å; D386-L389 HydrophobicContact CB-CB 4.01Å; D386-L389 PolarHBondContact O-N 3.35Å; D386-T390 PolarHBondContact O-N 3.34Å; D386-T390 PolarHBondContact O-OG1 3.5Å
387S42.6Very low42.5Very low92 Ų92101.4 Ų101.464%0.64352%0.519SS*.Hα-helixtrans-59.9-36.4-175.164.40000113.2T390 D391S387-T390 PolarHBondContact O-N 3.28Å; S387-D391 PolarHBondContact O-N 3.35Å
388E43Very low42.4Very low155 Ų155101.4 Ų101.472%0.72452%0.519SS*.Hα-helixtrans-72.6-32.6-179.9-68.8-169.4160.600113.4D386 T390 V392D386-E388 VanDerWaalsContact C-N 3.29Å; D386-E388 PolarHBondContact O-N 3.03Å; E388-T390 VanDerWaalsContact C-N 3.32Å; E388-V392 WeakPolarHBondContact O-CG2 3.48Å; E388-V392 PolarHBondContact O-N 3.38Å
389L41.5Very low42.2Very low70 Ų7099.6 Ų99.637%0.36652%0.515SS..Hα-helixtrans-73.5-32.2177.6-150.683.5000110.9H383 D386 V392 V393H383-L389 HydrophobicContact CB-CD2 3.74Å; D386-L389 HydrophobicContact CB-CB 4.01Å; D386-L389 PolarHBondContact O-N 3.35Å; L389-V392 PolarHBondContact O-N 3.02Å; L389-V393 WeakPolarHBondContact O-CB 3.14Å; L389-V393 WeakPolarHBondContact O-CG2 3.41Å; L389-V393 PolarHBondContact O-N 3.37Å
390T43Very low42.1Very low33 Ų3398.8 Ų98.820%0.20251%0.514CS..Hα-helixtrans-65.2-40.6178.4-41.40000111.1D386 S387 E388 V393 Q394D386-T390 PolarHBondContact O-N 3.34Å; D386-T390 PolarHBondContact O-OG1 3.5Å; S387-T390 PolarHBondContact O-N 3.28Å; E388-T390 VanDerWaalsContact C-N 3.32Å; T390-V393 PolarHBondContact O-N 3.38Å; T390-Q394 WeakPolarHBondContact O-CB 3.37Å; T390-Q394 WeakPolarHBondContact O-CG 3.48Å; T390-Q394 PolarHBondContact O-N 3.38Å
391D43Very low41.7Very low98 Ų9899.5 Ų99.552%0.52453%0.526SS..Hα-helixtrans-67.3-41.2177.3-74.6-21.4000112.6S387 Q394 L395S387-D391 PolarHBondContact O-N 3.35Å; D391-Q394 PolarHBondContact O-N 3.07Å; D391-L395 WeakPolarHBondContact O-CD1 3.36Å; D391-L395 WeakPolarHBondContact O-CG 3.45Å; D391-L395 PolarHBondContact O-N 3.19Å
392V43.7Very low41.2Very low93 Ų93105.3 Ų105.356%0.56453%0.534SS*.Hα-helixtrans-67.4-37.3177.1176.20000111.4E388 L389 L395E388-V392 WeakPolarHBondContact O-CG2 3.48Å; E388-V392 PolarHBondContact O-N 3.38Å; L389-V392 PolarHBondContact O-N 3.02Å; V392-L395 PolarHBondContact O-N 3.02Å
393V41.8Very low41.1Very low20 Ų20101.2 Ų101.212%0.12151%0.512CS..Hα-helixtrans-76.3-30.9178.1175.90000111.9I380 L389 T390 L395 L396 P397I380-V393 HydrophobicContact CD1-CG1 3.95Å; I380-V393 HydrophobicContact CG1-CG1 3.58Å; L389-V393 WeakPolarHBondContact O-CB 3.14Å; L389-V393 WeakPolarHBondContact O-CG2 3.41Å; L389-V393 PolarHBondContact O-N 3.37Å; T390-V393 PolarHBondContact O-N 3.38Å; V393-L395 PolarHBondContact O-N 3.13Å; V393-L396 WeakPolarHBondContact O-CB 3.24Å; V393-L396 PolarHBondContact O-N 3.42Å; V393-P397 WeakPolarHBondContact O-CD 3.38Å
394Q41.8Very low41.1Very low127 Ų127100.5 Ų100.559%0.59352%0.516SS*.Hα-helixtrans-68.9-20.2170.9-80.7-172.7-6.500113.6T390 D391 P397T390-Q394 WeakPolarHBondContact O-CB 3.37Å; T390-Q394 WeakPolarHBondContact O-CG 3.48Å; T390-Q394 PolarHBondContact O-N 3.38Å; D391-Q394 PolarHBondContact O-N 3.07Å; Q394-P397 WeakPolarHBondContact O-CD 3.23Å
395L41.9Very low41.4Very low102 Ų10297.8 Ų97.853%0.53451%0.506SS..Hα-helixtrans-82-18.4172.8-75.7159.9000113.4D391 V392 V393 H398 I399D391-L395 WeakPolarHBondContact O-CD1 3.36Å; D391-L395 WeakPolarHBondContact O-CG 3.45Å; D391-L395 PolarHBondContact O-N 3.19Å; V392-L395 PolarHBondContact O-N 3.02Å; V393-L395 PolarHBondContact O-N 3.13Å; L395-H398 WeakPolarHBondContact O-CB 3.5Å; L395-H398 PolarHBondContact O-N 2.95Å; L395-H398 VanDerWaalsContact O-N 3.07Å; L395-I399 WeakPolarHBondContact O-CG1 3.31Å; L395-I399 PolarHBondContact O-N 3.31Å; L395-I399 VanDerWaalsContact O-N 3.16Å
396L37.7Very low41.9Very low76 Ų7696.8 Ų96.840%0.39851%0.507SS..Hα-helixtrans-59.6-38.8-179.8-110.799000114.6T376 V393 H398 I399 T400T376-L396 HydrophobicContact CG2-CD2 4.29Å; V393-L396 WeakPolarHBondContact O-CB 3.24Å; V393-L396 PolarHBondContact O-N 3.42Å; L396-H398 VanDerWaalsContact C-N 3.3Å; L396-H398 PolarHBondContact O-N 3.22Å; L396-I399 PolarHBondContact O-N 3.21Å; L396-T400 PolarHBondContact O-N 3.34Å; L396-T400 PolarHBondContact O-OG1 2.97Å
397P35.7Very low42.1Very low75 Ų7599.2 Ų99.249%0.48752%0.519SS..Hα-helixtrans-61.2-35.2172-23.933.2000113.4V393 Q394 T400 S401V393-P397 WeakPolarHBondContact O-CD 3.38Å; Q394-P397 WeakPolarHBondContact O-CD 3.23Å; P397-T400 VanDerWaalsContact CA-OG1 3.26Å; P397-T400 WeakPolarHBondContact CA-OG1 3.37Å; P397-T400 PolarHBondContact O-N 3.35Å; P397-T400 PolarHBondContact O-OG1 2.92Å; P397-T400 VanDerWaalsContact O-OG1 3.07Å; P397-S401 PolarHBondContact O-N 3.45Å; P397-S401 PolarHBondContact O-OG 3.27Å
398H37.7Very low42.2Very low137 Ų13797.3 Ų97.363%0.63451%0.514SS*.Hα-helixtrans-71.9-30.3177.2-88.7-69.8000112.7L395 L396 S401L395-H398 WeakPolarHBondContact O-CB 3.5Å; L395-H398 PolarHBondContact O-N 2.95Å; L395-H398 VanDerWaalsContact O-N 3.07Å; L396-H398 VanDerWaalsContact C-N 3.3Å; L396-H398 PolarHBondContact O-N 3.22Å; H398-S401 PolarHBondContact O-OG 3.47Å
399I37.9Very low42.2Very low104 Ų10496.5 Ų96.553%0.53351%0.51SS..Hα-helixtrans-74.3-35173.7-62168.1000110.7L395 L396L395-I399 WeakPolarHBondContact O-CG1 3.31Å; L395-I399 PolarHBondContact O-N 3.31Å; L395-I399 VanDerWaalsContact O-N 3.16Å; L396-I399 PolarHBondContact O-N 3.21Å
400T36.6Very low42.5Very low73 Ų7398.5 Ų98.545%0.44853%0.527SS..Hα-helixtrans-79.2-32.1-177.445.80000113.9L396 P397 R402 N403L396-T400 PolarHBondContact O-N 3.34Å; L396-T400 PolarHBondContact O-OG1 2.97Å; P397-T400 VanDerWaalsContact CA-OG1 3.26Å; P397-T400 WeakPolarHBondContact CA-OG1 3.37Å; P397-T400 PolarHBondContact O-N 3.35Å; P397-T400 PolarHBondContact O-OG1 2.92Å; P397-T400 VanDerWaalsContact O-OG1 3.07Å; T400-R402 VanDerWaalsContact C-N 3.28Å; T400-R402 PolarHBondContact O-N 3.13Å; T400-N403 WeakPolarHBondContact CA-ND2 3.46Å; T400-N403 WeakPolarHBondContact O-CB 3.48Å; T400-N403 PolarHBondContact O-N 3.45Å; T400-N403 PolarHBondContact O-ND2 3.33Å
401S37.4Very low42.7Very low89 Ų8999 Ų9962%0.62253%0.528SS*.Hα-helixtrans-69.4-19.9176.968.70000114.3P397 H398 N403P397-S401 PolarHBondContact O-N 3.45Å; P397-S401 PolarHBondContact O-OG 3.27Å; H398-S401 PolarHBondContact O-OG 3.47Å; S401-N403 VanDerWaalsContact C-N 3.26Å; S401-N403 PolarHBondContact O-N 3.11Å
402R38Very low43Very low210 Ų21098.5 Ų98.579%0.79253%0.532SS*.THydrogen-bonded Turntrans-84.711.7177.1-109.1179.9179.9178.41.4114.7T400 S404T400-R402 VanDerWaalsContact C-N 3.28Å; T400-R402 PolarHBondContact O-N 3.13Å; R402-S404 VanDerWaalsContact C-N 3.27Å; R402-S404 PolarHBondContact O-N 2.96Å
403N43.6Very low42.9Very low28 Ų2896.7 Ų96.715%0.1553%0.533CS..  trans-84.511.2-176.2-79.6-49.4000115.7T400 S401 M411 R416T400-N403 WeakPolarHBondContact CA-ND2 3.46Å; T400-N403 WeakPolarHBondContact O-CB 3.48Å; T400-N403 PolarHBondContact O-N 3.45Å; T400-N403 PolarHBondContact O-ND2 3.33Å; S401-N403 VanDerWaalsContact C-N 3.26Å; S401-N403 PolarHBondContact O-N 3.11Å; N403-M411 PolarHBondContact O-N 3.13Å; N403-R416 PolarHBondContact ND2-NE 3.11Å; N403-R416 VanDerWaalsContact ND2-NE 3.13Å; N403-R416 PolarHBondContact ND2-NH2 3.26Å; N403-R416 VanDerWaalsContact ND2-NH2 3.19Å; N403-R416 PolarHBondContact OD1-NE 3.47Å
404S46.7Very low42.8Very low61 Ų61104.4 Ų104.443%0.42756%0.564SS.*BIsolated β-bridgetrans-86.8132.1163.6-109.10000109.5R402 G408 H409R402-S404 VanDerWaalsContact C-N 3.27Å; R402-S404 PolarHBondContact O-N 2.96Å; S404-G408 WeakPolarHBondContact OG-CA 3.33Å; S404-G408 PolarHBondContact OG-O 3.32Å; S404-G408 VanDerWaalsContact OG-O 3.07Å; S404-H409 WeakPolarHBondContact CA-O 3.38Å
405N50.4Low42.8Very low91 Ų91100.4 Ų100.449%0.48755%0.553SS.*  trans-63.4167.8165.7-151.50.4000109.5N407 G408 H409 M411N405-N407 PolarHBondContact O-N 3.37Å; N405-G408 PolarHBondContact O-N 3.22Å; N405-H409 PolarHBondContact N-O 3.33Å; N405-H409 VanDerWaalsContact N-O 3.08Å; N405-M411 HydrophobicContact CB-CE 4.48Å
406K51Low42.6Very low209 Ų209100.3 Ų100.391%0.90955%0.546SS*.THydrogen-bonded Turntrans-51.3-15-178.2-76.6-174.1176.3-177.70115.1
407N48.6Very low42.6Very low140 Ų140102.2 Ų102.275%0.74955%0.554SS**THydrogen-bonded Turntrans-107.816.4179.8-58.1-3.2000114.1N405 H409N405-N407 PolarHBondContact O-N 3.37Å; N407-H409 VanDerWaalsContact C-N 3.33Å; N407-H409 PolarHBondContact O-N 3.49Å
408G45.1Very low42.8Very low52 Ų52103 Ų10354%0.53656%0.558SS.*SBendtrans78.43.4173.700000116.4S404 N405S404-G408 WeakPolarHBondContact OG-CA 3.33Å; S404-G408 PolarHBondContact OG-O 3.32Å; S404-G408 VanDerWaalsContact OG-O 3.07Å; N405-G408 PolarHBondContact O-N 3.22Å
409H43.3Very low42.7Very low138 Ų138103.3 Ų103.364%0.63955%0.553SS**PPolyproline II helixtrans-87.5143.1176.7-74.6-62.6000113.5S404 N405 N407S404-H409 WeakPolarHBondContact CA-O 3.38Å; N405-H409 PolarHBondContact N-O 3.33Å; N405-H409 VanDerWaalsContact N-O 3.08Å; N407-H409 VanDerWaalsContact C-N 3.33Å; N407-H409 PolarHBondContact O-N 3.49Å
410P47.5Very low42.8Very low112 Ų112103.5 Ų103.573%0.72755%0.554SS**BIsolated β-bridgetrans-67.9131.2176.826-31.6000111.5
411M47Very low42.8Very low45 Ų45106.2 Ų106.222%0.22256%0.562CS.*PPolyproline II helixtrans-68.3140.9176.9-72.9-109.6-155.100112.6N403 N405 A415N403-M411 PolarHBondContact O-N 3.13Å; N405-M411 HydrophobicContact CB-CE 4.48Å; M411-A415 HydrophobicContact SD-CB 4.2Å
412S49.7Very low42.8Very low87 Ų87105.1 Ų105.161%0.60855%0.554SS**PPolyproline II helixtrans-59.6143171.3167.90000112K414 A415 R416S412-K414 PolarHBondContact O-N 3.4Å; S412-K414 VanDerWaalsContact O-N 3.09Å; S412-A415 WeakPolarHBondContact O-CB 3.48Å; S412-A415 PolarHBondContact O-N 3.08Å; S412-R416 PolarHBondContact O-N 3.33Å
413G42.5Very low42.8Very low55 Ų55102 Ų10257%0.56755%0.546SS*.Hα-helixtrans-56-29.1-175.800000114.8M417G413-M417 PolarHBondContact O-N 3.23Å
414K39.1Very low42.5Very low182 Ų182104.6 Ų104.679%0.79157%0.571SS**Hα-helixtrans-69.3-38.2175.4-122.1176.2-178.9179.90112.3S412 T418S412-K414 PolarHBondContact O-N 3.4Å; S412-K414 VanDerWaalsContact O-N 3.09Å; K414-T418 PolarHBondContact O-N 2.92Å; K414-T418 PolarHBondContact O-OG1 2.75Å; K414-T418 VanDerWaalsContact O-OG1 3.07Å
415A41.1Very low42Very low43 Ų43108 Ų10836%0.35559%0.585SS.*Hα-helixtrans-72.8-29.5178.600000112.8M411 S412 R419M411-A415 HydrophobicContact SD-CB 4.2Å; S412-A415 WeakPolarHBondContact O-CB 3.48Å; S412-A415 PolarHBondContact O-N 3.08Å; A415-R419 PolarHBondContact O-N 3.28Å
416R38.2Very low41.2Very low100 Ų100106.7 Ų106.738%0.37758%0.583SS.*Hα-helixtrans-62-47172.6-98.2-179.5175.61800.6112.2N403 S412 R419 I420N403-R416 PolarHBondContact ND2-NE 3.11Å; N403-R416 VanDerWaalsContact ND2-NE 3.13Å; N403-R416 PolarHBondContact ND2-NH2 3.26Å; N403-R416 VanDerWaalsContact ND2-NH2 3.19Å; N403-R416 PolarHBondContact OD1-NE 3.47Å; S412-R416 PolarHBondContact O-N 3.33Å; R416-R419 PolarHBondContact O-N 2.87Å; R416-I420 WeakPolarHBondContact O-CG1 3.31Å; R416-I420 PolarHBondContact O-N 3.22Å
417M37.5Very low40.7Very low115 Ų115102.8 Ų102.857%0.56758%0.579SS**Hα-helixtrans-65.9-42.3-179-90.4-169.4177.500112.9P356 G413 R419 I420 Q421P356-M417 HydrophobicContact CG-CE 4.17Å; G413-M417 PolarHBondContact O-N 3.23Å; M417-R419 VanDerWaalsContact C-N 3.28Å; M417-R419 PolarHBondContact O-N 3.11Å; M417-I420 PolarHBondContact O-N 3.04Å; M417-Q421 PolarHBondContact O-N 2.95Å
418T40.6Very low40.2Very low93 Ų9399.7 Ų99.757%0.57156%0.56SS**Hα-helixtrans-63.8-34.1-179.1-43.80000112.3K414 S422K414-T418 PolarHBondContact O-N 2.92Å; K414-T418 PolarHBondContact O-OG1 2.75Å; K414-T418 VanDerWaalsContact O-OG1 3.07Å; T418-S422 PolarHBondContact O-N 2.87Å; T418-S422 VanDerWaalsContact O-N 3.1Å
419R36.1Very low39.6Very low142 Ų142100.9 Ų100.954%0.53656%0.56SS.*Hα-helixtrans-78.1-31.6179.2-171.3179-92.4-178.1-6.6113.3A415 R416 M417 Q421 S422 F423A415-R419 PolarHBondContact O-N 3.28Å; R416-R419 PolarHBondContact O-N 2.87Å; M417-R419 VanDerWaalsContact C-N 3.28Å; M417-R419 PolarHBondContact O-N 3.11Å; R419-Q421 VanDerWaalsContact C-N 3.34Å; R419-S422 WeakPolarHBondContact CA-OG 3.25Å; R419-S422 PolarHBondContact O-N 3.18Å; R419-S422 PolarHBondContact O-OG 3.45Å; R419-F423 PolarHBondContact O-N 3.25Å
420I39Very low39.4Very low109 Ų109101 Ų10156%0.55956%0.556SS**Hα-helixtrans-67.2-39.6171.3-67.1167.8000109.9R416 M417 F423 A424R416-I420 WeakPolarHBondContact O-CG1 3.31Å; R416-I420 PolarHBondContact O-N 3.22Å; M417-I420 PolarHBondContact O-N 3.04Å; I420-F423 PolarHBondContact O-N 3.04Å; I420-A424 PolarHBondContact O-N 3.46Å; I420-A424 VanDerWaalsContact O-N 3.13Å
421Q36.2Very low38.7Very low130 Ų13099.6 Ų99.661%0.60755%0.545SS*.Hα-helixtrans-64.5-37.7174.1-98.3175.7-3400113.6M417 R419 F423 A424 N425M417-Q421 PolarHBondContact O-N 2.95Å; R419-Q421 VanDerWaalsContact C-N 3.34Å; Q421-F423 VanDerWaalsContact C-N 3.31Å; Q421-F423 PolarHBondContact O-N 3.09Å; Q421-A424 PolarHBondContact O-N 3.28Å; Q421-N425 PolarHBondContact O-N 3.43Å
422S38.2Very low38.1Very low65 Ų65102 Ų10246%0.45556%0.562SS.*Hα-helixtrans-67.8-31.217661.10000113.2T418 R419 N425 S426T418-S422 PolarHBondContact O-N 2.87Å; T418-S422 VanDerWaalsContact O-N 3.1Å; R419-S422 WeakPolarHBondContact CA-OG 3.25Å; R419-S422 PolarHBondContact O-N 3.18Å; R419-S422 PolarHBondContact O-OG 3.45Å; S422-N425 PolarHBondContact O-N 3.48Å; S422-S426 PolarHBondContact O-OG 3.05Å
423F36.6Very low37.4Very low145 Ų145102.5 Ų102.564%0.63656%0.562SS**Hα-helixtrans-71.9-37176-121.8-87.2000112.1R419 I420 Q421 N425R419-F423 PolarHBondContact O-N 3.25Å; I420-F423 PolarHBondContact O-N 3.04Å; Q421-F423 VanDerWaalsContact C-N 3.31Å; Q421-F423 PolarHBondContact O-N 3.09Å; F423-N425 VanDerWaalsContact C-N 3.27Å; F423-N425 PolarHBondContact O-N 3.41Å
424A38.4Very low36.9Very low82 Ų82107.6 Ų107.668%0.67858%0.576SS**Hα-helixtrans-67.9-27.2174.800000113I420 Q421I420-A424 PolarHBondContact O-N 3.46Å; I420-A424 VanDerWaalsContact O-N 3.13Å; Q421-A424 PolarHBondContact O-N 3.28Å
425N35.9Very low36.5Very low134 Ų134102.4 Ų102.472%0.71757%0.574SS**THydrogen-bonded Turntrans-91.21-177.3-71.5-9.9000114.4Q421 S422 F423Q421-N425 PolarHBondContact O-N 3.43Å; S422-N425 PolarHBondContact O-N 3.48Å; F423-N425 VanDerWaalsContact C-N 3.27Å; F423-N425 PolarHBondContact O-N 3.41Å
426S34.7Very low35.9Very low63 Ų63106.4 Ų106.444%0.44159%0.588SS.*  trans-129.894.1177.447.60000110.2S422 Q428S422-S426 PolarHBondContact O-OG 3.05Å; S426-Q428 PolarHBondContact O-N 3.34Å
427P38.5Very low35.7Very low126 Ų126106 Ų10682%0.81860%0.596SS**  trans-74.596.3176.830.5-28.9000107.5S429P427-S429 PolarHBondContact O-N 3.22Å
428Q38.5Very low35.5Very low76 Ų76103.4 Ų103.436%0.35559%0.59SS.*  trans-65.1119.5164.1-72.3-161.2-43.800107.8S426 Y430 V439S426-Q428 PolarHBondContact O-N 3.34Å; Q428-Y430 WeakPolarHBondContact O-CD2 3.49Å; Q428-Y430 VanDerWaalsContact O-CE2 3.23Å; Q428-Y430 WeakPolarHBondContact O-CE2 3.46Å; Q428-Y430 PolarHBondContact O-N 3.1Å; Q428-V439 HydrophobicContact CB-CG1 4.4Å
429S33.8Very low35.4Very low77 Ų77102.6 Ų102.654%0.53859%0.585SS.*  trans-68.2112.8173.9420000109.1P427 S440P427-S429 PolarHBondContact O-N 3.22Å; S429-S440 PolarHBondContact OG-OG 3.47Å
430Y38.5Very low35.6Very low141 Ų14198.7 Ų98.755%0.55358%0.579SS**EExtended strand (participates in β ladder)trans-87125.9171.9-60.5-88.1000108.9Q428 V437 V439Q428-Y430 WeakPolarHBondContact O-CD2 3.49Å; Q428-Y430 VanDerWaalsContact O-CE2 3.23Å; Q428-Y430 WeakPolarHBondContact O-CE2 3.46Å; Q428-Y430 PolarHBondContact O-N 3.1Å; Y430-V437 HydrophobicContact CD1-CG1 3.99Å; Y430-V439 HydrophobicContact CD1-CG2 4.03Å; Y430-V439 HydrophobicContact CE1-CG2 3.76Å
431T32.7Very low35.7Very low81 Ų81101.6 Ų101.650%0.49761%0.609SS.*EExtended strand (participates in β ladder)trans-113.5132.2171.710.40000109.1S438T431-S438 PolarHBondContact O-N 2.86Å
432V34.6Very low35.6Very low96 Ų96100.2 Ų100.258%0.58261%0.609SS**EExtended strand (participates in β ladder)trans-109.7115.1176.9-178.50000108.6V437V432-V437 HydrophobicContact CG2-CG2 3.85Å
433T34Very low35.5Very low97 Ų97102.1 Ų102.160%0.59562%0.618SS**EExtended strand (participates in β ladder)trans-128.2125.7173.2-36.10000108.3G435 I436T433-G435 VanDerWaalsContact C-N 3.31Å; T433-G435 PolarHBondContact O-N 3.43Å; T433-I436 PolarHBondContact O-N 3.46Å
434N32.9Very low35.4Very low163 Ų16399.7 Ų99.787%0.87262%0.617SS**THydrogen-bonded Turntrans53.938.1-177.8-63.2-15000115.3I436N434-I436 VanDerWaalsContact C-N 3.27Å; N434-I436 PolarHBondContact O-N 2.97Å
435G31Very low35.3Very low73 Ų73100.7 Ų100.775%0.75361%0.613SS**THydrogen-bonded Turntrans75.58.1173.400000115.4T433T433-G435 VanDerWaalsContact C-N 3.31Å; T433-G435 PolarHBondContact O-N 3.43Å
436I27.2Very low35.2Very low126 Ų12698.6 Ų98.665%0.64661%0.606SS**EExtended strand (participates in β ladder)trans-109.2124.7171.9-57.2177.7000108.2T433 N434T433-I436 PolarHBondContact O-N 3.46Å; N434-I436 VanDerWaalsContact C-N 3.27Å; N434-I436 PolarHBondContact O-N 2.97Å
437V35.4Very low35.2Very low91 Ų91101 Ų10155%0.55262%0.618SS**EExtended strand (participates in β ladder)trans-84.1117.3173.9178.50000107.6Y430 V432Y430-V437 HydrophobicContact CD1-CG1 3.99Å; V432-V437 HydrophobicContact CG2-CG2 3.85Å
438S31.9Very low35Very low62 Ų6299.2 Ų99.243%0.43460%0.603SS.*EExtended strand (participates in β ladder)trans-110.7143.2172.255.70000110.8T431T431-S438 PolarHBondContact O-N 2.86Å
439V39.7Very low34.7Very low76 Ų76101 Ų10146%0.46162%0.622SS.*EExtended strand (participates in β ladder)trans-100.8116.3176.5-179.60000107.1Q428 Y430 S441Q428-V439 HydrophobicContact CB-CG1 4.4Å; Y430-V439 HydrophobicContact CD1-CG2 4.03Å; Y430-V439 HydrophobicContact CE1-CG2 3.76Å; V439-S441 PolarHBondContact O-N 3.07Å
440S40.2Very low34.8Very low60 Ų60103 Ų10342%0.4263%0.629SS.*  trans-73.8115.1168.561.80000108.6S429S429-S440 PolarHBondContact OG-OG 3.47Å
441S40Very low34.5Very low170 Ų17099.5 Ų99.5100%1.18964%0.636SS**  trans-67.10174.357.20000112.4V439V439-S441 PolarHBondContact O-N 3.07Å

Retrieved 441 of 441 residues in 189.2 ms (Link to these results)