A0A087Y6R8_POEFO Loading...

Monocarboxylate transporter 1

AlphaFold DB , UniProt , Accession A0A087Y6R8, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 456 aa.

Structure Viewer
Loading PAE data...
(Predicted Aligned Error values between residue pairs)
Error loading PAE data: please refresh the page.

 

Download Structure   PDB   PAE   Table  
Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M36Very low44.6Very low237 Ų237109.7 Ų109.7100%1.16767%0.671SS**  0134.50-69.8-174.2-129.400107.9
2P31.6Very low46.4Very low132 Ų132108.5 Ų108.586%0.85766%0.663SS**  trans-65.5140.5-179.126.1-30.8000110.8A4P2-A4 PolarHBondContact O-N 2.93Å
3V38.8Very low48.6Very low113 Ų113101.5 Ų101.569%0.68562%0.621SS**  trans-60.6130.9-179.8-1760000109.1I5 T12V3-I5 PolarHBondContact O-N 3.29Å; V3-I5 VanDerWaalsContact O-N 3.08Å; V3-T12 HydrophobicContact CG1-CG2 4.01Å
4A38.4Very low50.4Low54 Ų5499.2 Ų99.245%0.44661%0.609SS.*  trans-62.3112.1179.300000110.4P2 G6 G7P2-A4 PolarHBondContact O-N 2.93Å; A4-G6 PolarHBondContact O-N 3.07Å; A4-G7 PolarHBondContact O-N 3.3Å
5I37.2Very low52.2Low176 Ų17695.7 Ų95.790%0.90358%0.583SS**THydrogen-bonded Turntrans-62.8115.7171.1-57.4172.2000107.3V3V3-I5 PolarHBondContact O-N 3.29Å; V3-I5 VanDerWaalsContact O-N 3.08Å
6G49.2Very low54.1Low62 Ų6290.9 Ų90.964%0.63956%0.558SS**THydrogen-bonded Turntrans97.58.2179.100000116.9A4 F140A4-G6 PolarHBondContact O-N 3.07Å; G6-F140 WeakPolarHBondContact O-CZ 3.41Å
7G45.8Very low56.2Low23 Ų2389.1 Ų89.124%0.23756%0.562CS.*PPolyproline II helixtrans-68.1161170.100000113.1A4 Q9A4-G7 PolarHBondContact O-N 3.3Å; G7-Q9 PolarHBondContact O-N 2.65Å
8P52.6Low58.1Low71 Ų7190.7 Ų90.746%0.46156%0.556SS.*PPolyproline II helixtrans-55.3127.7177.719.1-27.7000111.1G10 Y11P8-G10 PolarHBondContact O-N 2.79Å; P8-G10 VanDerWaalsContact O-N 3.16Å; P8-Y11 PolarHBondContact O-N 2.74Å; P8-Y11 VanDerWaalsContact O-N 3.16Å; P8-Y11 VanDerWaalsContact O-O 3.1Å
9Q43.7Very low59.7Low206 Ų20685.9 Ų85.996%0.96353%0.527SS*.THydrogen-bonded Turntrans-55.2121.3-179.7-78.5179.1-14.300110.2G7G7-Q9 PolarHBondContact O-N 2.65Å
10G54.6Low61.4Low78 Ų7886.3 Ų86.380%0.80452%0.518SS*.THydrogen-bonded Turntrans94.9-0.617800000116.4P8P8-G10 PolarHBondContact O-N 2.79Å; P8-G10 VanDerWaalsContact O-N 3.16Å
11Y62.3Low63Low55 Ų5585.2 Ų85.222%0.21651%0.509CS..  trans-151.4121.1175.1175.5-100.4000112P8 P13 P14 K137 I198P8-Y11 PolarHBondContact O-N 2.74Å; P8-Y11 VanDerWaalsContact O-N 3.16Å; P8-Y11 VanDerWaalsContact O-O 3.1Å; Y11-P13 HydrophobicContact CD1-CG 4.32Å; Y11-P13 HydrophobicContact CE1-CB 4.26Å; Y11-P13 HydrophobicContact CE1-CG 4.07Å; Y11-P13 WeakPolarHBondContact O-CD 3.46Å; Y11-P14 WeakPolarHBondContact OH-CD 3.43Å; Y11-K137 VanDerWaalsContact CE1-O 3.31Å; Y11-K137 WeakPolarHBondContact CE1-O 3.49Å; Y11-I198 HydrophobicContact CE1-CD1 4.36Å; Y11-I198 HydrophobicContact CE2-CB 4.22Å; Y11-I198 WeakPolarHBondContact OH-CD1 3.42Å
12T66.1Low65.7Low95 Ų9573.9 Ų73.958%0.58345%0.453SS*.  trans-92117171.352.20000109.9V3V3-T12 HydrophobicContact CG1-CG2 4.01Å
13P75.2Confident68.6Low18 Ų1867.8 Ų67.812%0.11741%0.414CS..  trans-57.8136.9173.9-25.235.9000111.4Y11 E15 F140Y11-P13 HydrophobicContact CD1-CG 4.32Å; Y11-P13 HydrophobicContact CE1-CB 4.26Å; Y11-P13 HydrophobicContact CE1-CG 4.07Å; Y11-P13 WeakPolarHBondContact O-CD 3.46Å; P13-E15 PolarHBondContact O-N 2.92Å; P13-F140 HydrophobicContact CB-CB 4.35Å; P13-F140 HydrophobicContact CG-CB 3.88Å
14P74.8Confident71.3Confident69 Ų6966.8 Ų66.845%0.44840%0.403SS..  trans-70.5-16.1-175.824.4-34.1000113.9Y11 G16 Y138Y11-P14 WeakPolarHBondContact OH-CD 3.43Å; P14-G16 PolarHBondContact O-N 3.05Å; P14-Y138 HydrophobicContact CG-CD1 3.72Å; P14-Y138 HydrophobicContact CG-CE1 4.15Å
15E77.3Confident74Confident47 Ų4764.2 Ų64.222%0.2238%0.382CS..  trans55.617.6174.3-65.2-69.4156.900115.7P13 Y138 F140 K141 R142P13-E15 PolarHBondContact O-N 2.92Å; E15-Y138 PolarHBondContact N-O 2.99Å; E15-F140 VanDerWaalsContact OE1-CA 3.3Å; E15-F140 WeakPolarHBondContact OE1-CA 3.21Å; E15-F140 WeakPolarHBondContact OE1-CB 3.47Å; E15-F140 PolarHBondContact OE1-N 3.43Å; E15-K141 PolarHBondContact OE1-N 3.45Å; E15-K141 PolarHBondContact OE2-N 2.89Å; E15-R142 PolarHBondContact OE2-N 3.01Å; E15-R142 VanDerWaalsContact OE2-N 3.08Å
16G82.6Confident76.7Confident18 Ų1855.8 Ų55.819%0.18634%0.339CS..SBendtrans174-161.7-177.500000113.9P14 W18 G19P14-G16 PolarHBondContact O-N 3.05Å; G16-W18 PolarHBondContact O-N 2.96Å; G16-G19 PolarHBondContact O-N 3.27Å; G16-G19 VanDerWaalsContact O-N 3.09Å
17G88.8Confident78.9Confident61 Ų6155.2 Ų55.263%0.62932%0.319SS*.THydrogen-bonded Turntrans58.7-121.4-179.800000112.4G19 W20G17-G19 PolarHBondContact O-N 3.13Å; G17-G19 VanDerWaalsContact O-N 3.08Å; G17-W20 PolarHBondContact O-N 3.07Å
18W90.8Very high81.3Confident118 Ų11856.3 Ų56.345%0.44732%0.319SS..Hα-helixtrans-58.8-21178.4-158.4-89.5000113.6G16 W20 L21 V22 Y138 L194G16-W18 PolarHBondContact O-N 2.96Å; W18-W20 PolarHBondContact O-N 3.16Å; W18-L21 HydrophobicContact CD2-CB 4.5Å; W18-L21 HydrophobicContact CD2-CD1 3.69Å; W18-L21 HydrophobicContact CE3-CD1 3.4Å; W18-L21 VanDerWaalsContact CE3-CD1 3.4Å; W18-L21 HydrophobicContact CG-CD1 4.44Å; W18-L21 HydrophobicContact CH2-CD1 3.73Å; W18-L21 HydrophobicContact CZ2-CD1 4.01Å; W18-L21 HydrophobicContact CZ3-CD1 3.42Å; W18-L21 VanDerWaalsContact CZ3-CD1 3.42Å; W18-L21 WeakPolarHBondContact O-CB 3.19Å; W18-L21 PolarHBondContact O-N 3Å; W18-L21 VanDerWaalsContact O-N 3.09Å; W18-V22 PolarHBondContact O-N 3.16Å; W18-Y138 HydrophobicContact CB-CE1 4.29Å; W18-L194 HydrophobicContact CZ2-CD2 4.43Å; W18-L194 PolarHBondContact NE1-O 2.82Å
19G89.2Confident83.3Confident0 Ų053 Ų530%030%0.297CS..Hα-helixtrans-56.2-33.917300000113G16 G17 V22 V23 F139G16-G19 PolarHBondContact O-N 3.27Å; G16-G19 VanDerWaalsContact O-N 3.09Å; G17-G19 PolarHBondContact O-N 3.13Å; G17-G19 VanDerWaalsContact O-N 3.08Å; G19-V22 WeakPolarHBondContact O-CB 3.37Å; G19-V22 PolarHBondContact O-N 2.96Å; G19-V23 WeakPolarHBondContact O-CG2 3.02Å; G19-V23 PolarHBondContact O-N 2.76Å; G19-F139 WeakPolarHBondContact O-CE2 3.41Å
20W93.5Very high85.6Confident92 Ų9243.1 Ų43.135%0.34825%0.251SS..Hα-helixtrans-72.9-32.6177.2-67.2114.1000113G17 W18 V22 V23 I24 F139 I149G17-W20 PolarHBondContact O-N 3.07Å; W18-W20 PolarHBondContact O-N 3.16Å; W20-V22 VanDerWaalsContact C-N 3.31Å; W20-V23 HydrophobicContact CE3-CB 4.38Å; W20-V23 HydrophobicContact CE3-CG2 4.33Å; W20-V23 WeakPolarHBondContact O-CB 3.35Å; W20-V23 PolarHBondContact O-N 3.16Å; W20-I24 WeakPolarHBondContact O-CG1 2.92Å; W20-I24 PolarHBondContact O-N 3.5Å; W20-F139 HydrophobicContact CD2-CZ 4.11Å; W20-F139 HydrophobicContact CE3-CZ 4.4Å; W20-F139 HydrophobicContact CG-CZ 4.45Å; W20-F139 HydrophobicContact CZ2-CE1 4.39Å; W20-I149 HydrophobicContact CH2-CD1 4.49Å; W20-I149 HydrophobicContact CZ3-CD1 3.8Å
21L94.3Very high87.5Confident64 Ų6439.4 Ų39.434%0.33521%0.213SC..Hα-helixtrans-66.7-36.5170.7-66.7170.9000111.3W18 V23 I24 G25W18-L21 HydrophobicContact CD2-CB 4.5Å; W18-L21 HydrophobicContact CD2-CD1 3.69Å; W18-L21 HydrophobicContact CE3-CD1 3.4Å; W18-L21 VanDerWaalsContact CE3-CD1 3.4Å; W18-L21 HydrophobicContact CG-CD1 4.44Å; W18-L21 HydrophobicContact CH2-CD1 3.73Å; W18-L21 HydrophobicContact CZ2-CD1 4.01Å; W18-L21 HydrophobicContact CZ3-CD1 3.42Å; W18-L21 VanDerWaalsContact CZ3-CD1 3.42Å; W18-L21 WeakPolarHBondContact O-CB 3.19Å; W18-L21 PolarHBondContact O-N 3Å; W18-L21 VanDerWaalsContact O-N 3.09Å; L21-V23 VanDerWaalsContact C-N 3.32Å; L21-I24 HydrophobicContact CD2-CD1 4.37Å; L21-I24 PolarHBondContact O-N 3.41Å; L21-G25 PolarHBondContact O-N 3.03Å
22V93Very high89Confident0 Ų037.5 Ų37.50%021%0.206CC..Hα-helixtrans-62.5-39.4171.3164.80000111.4W18 G19 W20 G25 A26 M134 Y138 M195W18-V22 PolarHBondContact O-N 3.16Å; G19-V22 WeakPolarHBondContact O-CB 3.37Å; G19-V22 PolarHBondContact O-N 2.96Å; W20-V22 VanDerWaalsContact C-N 3.31Å; V22-G25 PolarHBondContact O-N 3.37Å; V22-A26 WeakPolarHBondContact O-CB 3.44Å; V22-A26 PolarHBondContact O-N 3.03Å; V22-M134 HydrophobicContact CG1-CB 4.06Å; V22-Y138 HydrophobicContact CB-CD2 4.28Å; V22-Y138 HydrophobicContact CG1-CD2 4.03Å; V22-Y138 HydrophobicContact CG2-CD2 3.94Å; V22-Y138 HydrophobicContact CG2-CE1 4.47Å; V22-Y138 HydrophobicContact CG2-CE2 3.68Å; V22-Y138 HydrophobicContact CG2-CG 4.47Å; V22-M195 HydrophobicContact CB-SD 4.34Å; V22-M195 HydrophobicContact CG1-CE 4.46Å; V22-M195 HydrophobicContact CG1-SD 3.71Å; V22-M195 HydrophobicContact CG2-SD 4.28Å
23V93.5Very high90.3Very high3 Ų333 Ų332%0.01818%0.178CC..Hα-helixtrans-63.8-40174.2171.30000111.4G19 W20 L21 A26 F27 F139 A146 I149G19-V23 WeakPolarHBondContact O-CG2 3.02Å; G19-V23 PolarHBondContact O-N 2.76Å; W20-V23 HydrophobicContact CE3-CB 4.38Å; W20-V23 HydrophobicContact CE3-CG2 4.33Å; W20-V23 WeakPolarHBondContact O-CB 3.35Å; W20-V23 PolarHBondContact O-N 3.16Å; L21-V23 VanDerWaalsContact C-N 3.32Å; V23-A26 PolarHBondContact O-N 2.72Å; V23-F27 WeakPolarHBondContact O-CB 3.41Å; V23-F27 PolarHBondContact O-N 3.3Å; V23-F139 HydrophobicContact CG2-CD2 4.37Å; V23-F139 HydrophobicContact CG2-CE2 3.65Å; V23-F139 HydrophobicContact CG2-CZ 4.36Å; V23-A146 HydrophobicContact CG2-CB 3.76Å; V23-I149 HydrophobicContact CG1-CB 3.98Å; V23-I149 HydrophobicContact CG1-CG2 3.6Å
24I95.1Very high91Very high92 Ų9233.9 Ų33.947%0.47218%0.179SC..Hα-helixtrans-64-45.7174.4-66.4167.2000110.9W20 L21 A26 F27 I28W20-I24 WeakPolarHBondContact O-CG1 2.92Å; W20-I24 PolarHBondContact O-N 3.5Å; L21-I24 HydrophobicContact CD2-CD1 4.37Å; L21-I24 PolarHBondContact O-N 3.41Å; I24-A26 VanDerWaalsContact C-N 3.29Å; I24-A26 PolarHBondContact O-N 3.08Å; I24-F27 WeakPolarHBondContact O-CB 3.26Å; I24-F27 PolarHBondContact O-N 3.32Å; I24-I28 HydrophobicContact CG2-CD1 4.27Å; I24-I28 WeakPolarHBondContact O-CG1 3.33Å; I24-I28 PolarHBondContact O-N 3.19Å; I24-I28 VanDerWaalsContact O-N 3.09Å
25G94.9Very high91.8Very high0 Ų030.6 Ų30.60%016%0.158CC..Hα-helixtrans-60.3-39.817500000112.4L21 V22 S29L21-G25 PolarHBondContact O-N 3.03Å; V22-G25 PolarHBondContact O-N 3.37Å; G25-S29 WeakPolarHBondContact O-CB 3.35Å; G25-S29 PolarHBondContact O-N 3.25Å; G25-S29 PolarHBondContact O-OG 2.89Å
26A93.8Very high92.6Very high0 Ų028.6 Ų28.60%015%0.149CC..Hα-helixtrans-68.8-38.6175.600000112.2V22 V23 I24 I28 S29 I30 A131 I135 A150 M195V22-A26 WeakPolarHBondContact O-CB 3.44Å; V22-A26 PolarHBondContact O-N 3.03Å; V23-A26 PolarHBondContact O-N 2.72Å; I24-A26 VanDerWaalsContact C-N 3.29Å; I24-A26 PolarHBondContact O-N 3.08Å; A26-I28 VanDerWaalsContact C-N 3.33Å; A26-I28 PolarHBondContact O-N 2.85Å; A26-S29 PolarHBondContact O-N 3.34Å; A26-I30 HydrophobicContact CB-CD1 4.49Å; A26-I30 VanDerWaalsContact O-CB 3.22Å; A26-I30 WeakPolarHBondContact O-CB 3.32Å; A26-I30 WeakPolarHBondContact O-CG1 3.31Å; A26-I30 PolarHBondContact O-N 3.32Å; A26-A131 HydrophobicContact CB-CB 3.94Å; A26-I135 HydrophobicContact CB-CD1 3.54Å; A26-I135 HydrophobicContact CB-CG1 4Å; A26-A150 HydrophobicContact CB-CB 3.96Å; A26-M195 HydrophobicContact CB-CE 4.11Å
27F95.1Very high93Very high50 Ų5027.8 Ų27.822%0.21914%0.141CC..Hα-helixtrans-56.2-47.2174.7-177.2-84.2000111.4V23 I24 G31 I149 A152 G153 V156 F157V23-F27 WeakPolarHBondContact O-CB 3.41Å; V23-F27 PolarHBondContact O-N 3.3Å; I24-F27 WeakPolarHBondContact O-CB 3.26Å; I24-F27 PolarHBondContact O-N 3.32Å; F27-G31 WeakPolarHBondContact O-CA 3.34Å; F27-G31 PolarHBondContact O-N 3.29Å; F27-I149 HydrophobicContact CD2-CG2 4.32Å; F27-I149 WeakPolarHBondContact CD2-O 3.1Å; F27-A152 HydrophobicContact CE2-CB 4.47Å; F27-G153 VanDerWaalsContact CE2-N 3.29Å; F27-G153 VanDerWaalsContact CZ-CA 3.45Å; F27-V156 HydrophobicContact CE1-CG1 4.43Å; F27-V156 HydrophobicContact CZ-CB 4Å; F27-V156 HydrophobicContact CZ-CG1 4.14Å; F27-V156 HydrophobicContact CZ-CG2 4.09Å; F27-F157 AromaticContact CD1-CE2 3.87Å; F27-F157 HydrophobicContact CD1-CE2 3.87Å; F27-F157 HydrophobicContact CE1-CD2 4.14Å; F27-F157 AromaticContact CE1-CE2 3.69Å; F27-F157 HydrophobicContact CE1-CE2 3.69Å
28I95.7Very high93Very high46 Ų4625.4 Ų25.424%0.23611%0.113CC..Hα-helixtrans-66-47.2177.7-63.6167.2000110.7I24 A26 G31 F32 F157 A191I24-I28 HydrophobicContact CG2-CD1 4.27Å; I24-I28 WeakPolarHBondContact O-CG1 3.33Å; I24-I28 PolarHBondContact O-N 3.19Å; I24-I28 VanDerWaalsContact O-N 3.09Å; A26-I28 VanDerWaalsContact C-N 3.33Å; A26-I28 PolarHBondContact O-N 2.85Å; I28-G31 PolarHBondContact O-N 3.44Å; I28-F32 HydrophobicContact CG2-CD2 3.74Å; I28-F32 HydrophobicContact CG2-CE2 3.76Å; I28-F32 WeakPolarHBondContact O-CD2 3.37Å; I28-F32 PolarHBondContact O-N 3.47Å; I28-F157 HydrophobicContact CB-CZ 4.3Å; I28-F157 HydrophobicContact CG1-CZ 4.21Å; I28-F157 HydrophobicContact CG2-CZ 4.16Å; I28-A191 HydrophobicContact CB-CB 4.07Å; I28-A191 HydrophobicContact CG2-CB 4Å
29S94.6Very high93Very high0 Ų019.8 Ų19.80%09%0.092CC..Hα-helixtrans-64.4-48.5-176.7-57.30000111.9G25 A26 G31 S33 M89G25-S29 WeakPolarHBondContact O-CB 3.35Å; G25-S29 PolarHBondContact O-N 3.25Å; G25-S29 PolarHBondContact O-OG 2.89Å; A26-S29 PolarHBondContact O-N 3.34Å; S29-G31 VanDerWaalsContact C-N 3.33Å; S29-S33 WeakPolarHBondContact O-CB 3.18Å; S29-S33 PolarHBondContact O-N 2.99Å; S29-S33 PolarHBondContact O-OG 3.46Å; S29-M89 WeakPolarHBondContact OG-CE 3.45Å
30I92.3Very high93.1Very high0 Ų019.9 Ų19.90%09%0.092CC..Hα-helixtrans-66.1-39.5176.8-65177.4000110.4A26 S33 Y34 L128 A131 L132 A150 M151A26-I30 HydrophobicContact CB-CD1 4.49Å; A26-I30 VanDerWaalsContact O-CB 3.22Å; A26-I30 WeakPolarHBondContact O-CB 3.32Å; A26-I30 WeakPolarHBondContact O-CG1 3.31Å; A26-I30 PolarHBondContact O-N 3.32Å; I30-S33 PolarHBondContact O-N 3.03Å; I30-Y34 HydrophobicContact CG2-CD2 3.66Å; I30-Y34 HydrophobicContact CG2-CE2 3.91Å; I30-Y34 PolarHBondContact O-N 3.48Å; I30-Y34 VanDerWaalsContact O-N 3.08Å; I30-L128 HydrophobicContact CG1-CD1 3.95Å; I30-L128 HydrophobicContact CG2-CD1 4.48Å; I30-A131 HydrophobicContact CG1-CB 4.48Å; I30-L132 HydrophobicContact CD1-CD2 3.82Å; I30-L132 HydrophobicContact CD1-CG 4.31Å; I30-A150 HydrophobicContact CD1-CB 3.82Å; I30-M151 HydrophobicContact CD1-SD 4.33Å; I30-M151 HydrophobicContact CG2-SD 3.99Å
31G93.9Very high93Very high0 Ų015.5 Ų15.50%08%0.075CC..Hα-helixtrans-51.6-60.2173.200000111.6F27 I28 S29 A35F27-G31 WeakPolarHBondContact O-CA 3.34Å; F27-G31 PolarHBondContact O-N 3.29Å; I28-G31 PolarHBondContact O-N 3.44Å; S29-G31 VanDerWaalsContact C-N 3.33Å; G31-A35 WeakPolarHBondContact O-CB 3.11Å; G31-A35 PolarHBondContact O-N 3.01Å
32F94.9Very high92.8Very high14 Ų1412.7 Ų12.76%0.0616%0.061CC..Hα-helixtrans-62.2-44.7177.2-79.6-64000112.8I28 Y34 T36 L124 F157 L161 L184 L185 C188I28-F32 HydrophobicContact CG2-CD2 3.74Å; I28-F32 HydrophobicContact CG2-CE2 3.76Å; I28-F32 WeakPolarHBondContact O-CD2 3.37Å; I28-F32 PolarHBondContact O-N 3.47Å; F32-Y34 VanDerWaalsContact C-N 3.34Å; F32-Y34 PolarHBondContact O-N 3.33Å; F32-T36 WeakPolarHBondContact O-CB 3.24Å; F32-T36 PolarHBondContact O-N 3.07Å; F32-T36 PolarHBondContact O-OG1 3.47Å; F32-L124 HydrophobicContact CB-CD2 4.42Å; F32-F157 HydrophobicContact CD1-CD1 4.05Å; F32-F157 HydrophobicContact CD1-CE1 4.2Å; F32-F157 HydrophobicContact CD2-CD1 4.19Å; F32-F157 AromaticContact CD2-CE1 3.65Å; F32-F157 HydrophobicContact CD2-CE1 3.65Å; F32-F157 HydrophobicContact CD2-CZ 4.47Å; F32-F157 HydrophobicContact CE1-CD1 4.06Å; F32-F157 AromaticContact CE1-CE1 3.98Å; F32-F157 HydrophobicContact CE1-CE1 3.98Å; F32-F157 HydrophobicContact CE2-CD1 4.24Å; F32-F157 AromaticContact CE2-CE1 3.44Å; F32-F157 HydrophobicContact CE2-CE1 3.44Å; F32-F157 VanDerWaalsContact CE2-CE1 3.44Å; F32-F157 HydrophobicContact CE2-CZ 4.27Å; F32-F157 HydrophobicContact CG-CD1 4.11Å; F32-F157 HydrophobicContact CG-CE1 4.05Å; F32-F157 HydrophobicContact CZ-CD1 4.17Å; F32-F157 AromaticContact CZ-CE1 3.61Å; F32-F157 HydrophobicContact CZ-CE1 3.61Å; F32-L161 HydrophobicContact CD1-CD1 4.24Å; F32-L161 HydrophobicContact CE1-CD1 4.28Å; F32-L161 HydrophobicContact CE1-CD2 4.46Å; F32-L184 HydrophobicContact CE1-CB 4.18Å; F32-L184 HydrophobicContact CZ-CB 4.08Å; F32-L185 HydrophobicContact CB-CD2 4.02Å; F32-L185 HydrophobicContact CD1-CD2 3.8Å; F32-L185 HydrophobicContact CE1-CD2 4.49Å; F32-L185 HydrophobicContact CG-CD2 4.03Å; F32-C188 VanDerWaalsContact CD2-SG 3.53Å
33S92.6Very high92.7Very high0 Ų012.7 Ų12.70%06%0.061CC..Hα-helixtrans-59.3-39.9-177.2-66.30000113.7S29 I30 L124S29-S33 WeakPolarHBondContact O-CB 3.18Å; S29-S33 PolarHBondContact O-N 2.99Å; S29-S33 PolarHBondContact O-OG 3.46Å; I30-S33 PolarHBondContact O-N 3.03Å; S33-L124 PolarHBondContact OG-O 2.93Å
34Y89.9Confident92.5Very high38 Ų3812.7 Ų12.715%0.1496%0.061CC..Hα-helixtrans-92.1-33.5179.5-75.4-68.8000114.2I30 F32 Y70 L128 M151 S154I30-Y34 HydrophobicContact CG2-CD2 3.66Å; I30-Y34 HydrophobicContact CG2-CE2 3.91Å; I30-Y34 PolarHBondContact O-N 3.48Å; I30-Y34 VanDerWaalsContact O-N 3.08Å; F32-Y34 VanDerWaalsContact C-N 3.34Å; F32-Y34 PolarHBondContact O-N 3.33Å; Y34-Y70 HydrophobicContact CD1-CE1 4.28Å; Y34-Y70 AromaticContact CE1-CE1 3.66Å; Y34-Y70 HydrophobicContact CE1-CE1 3.66Å; Y34-Y70 AromaticContact CE1-CZ 3.86Å; Y34-Y70 WeakPolarHBondContact CE1-OH 3.19Å; Y34-L128 HydrophobicContact CD2-CD1 4.34Å; Y34-L128 HydrophobicContact CE2-CD1 3.6Å; Y34-L128 HydrophobicContact CE2-CD2 4.18Å; Y34-M151 HydrophobicContact CE2-CE 4.47Å; Y34-S154 VanDerWaalsContact CB-OG 3.24Å; Y34-S154 WeakPolarHBondContact CB-OG 3.38Å
35A93.1Very high92.1Very high0 Ų012.1 Ų12.10%06%0.055CC..Hα-helixtrans-79.3-34.8-176.100000112.5G31 A37 K38 S39 F157 L158 L161G31-A35 WeakPolarHBondContact O-CB 3.11Å; G31-A35 PolarHBondContact O-N 3.01Å; A35-A37 PolarHBondContact O-N 3.14Å; A35-K38 PolarHBondContact O-N 2.74Å; A35-K38 VanDerWaalsContact O-N 3.11Å; A35-S39 WeakPolarHBondContact O-CB 3.38Å; A35-S39 PolarHBondContact O-N 2.88Å; A35-S39 PolarHBondContact O-OG 3.25Å; A35-F157 HydrophobicContact CB-CB 3.65Å; A35-L158 HydrophobicContact CB-CB 4Å; A35-L161 HydrophobicContact CB-CD1 4.08Å
36T93.1Very high91.8Very high4 Ų412.8 Ų12.83%0.0256%0.058CC..Hα-helixtrans-56-52-172.5-57.80000110.5F32 K38 S39 I40 M65 F100 L124 L185F32-T36 WeakPolarHBondContact O-CB 3.24Å; F32-T36 PolarHBondContact O-N 3.07Å; F32-T36 PolarHBondContact O-OG1 3.47Å; T36-K38 VanDerWaalsContact C-N 3.25Å; T36-K38 PolarHBondContact O-N 3.37Å; T36-S39 PolarHBondContact O-N 3.48Å; T36-S39 VanDerWaalsContact O-N 3.07Å; T36-S39 PolarHBondContact O-OG 2.8Å; T36-I40 WeakPolarHBondContact O-CG1 3.31Å; T36-I40 PolarHBondContact O-N 2.56Å; T36-M65 HydrophobicContact CG2-CE 3.94Å; T36-F100 HydrophobicContact CG2-CE1 4.3Å; T36-F100 HydrophobicContact CG2-CE2 4.08Å; T36-F100 HydrophobicContact CG2-CZ 3.52Å; T36-L124 HydrophobicContact CG2-CD1 4.46Å; T36-L185 HydrophobicContact CG2-CD1 4.49Å
37A90Very high91.7Very high2 Ų212.8 Ų12.82%0.0176%0.058CC..Hα-helixtrans-58.4-34.1-179.200000114.9A35 I40 T41 M65 L66A35-A37 PolarHBondContact O-N 3.14Å; A37-I40 VanDerWaalsContact O-CG1 3.31Å; A37-I40 WeakPolarHBondContact O-CG1 3.44Å; A37-T41 WeakPolarHBondContact O-CG2 3.37Å; A37-M65 HydrophobicContact CB-CE 3.28Å; A37-L66 HydrophobicContact CB-CD1 4.21Å; A37-L66 HydrophobicContact CB-CD2 3.66Å; A37-L66 HydrophobicContact CB-CG 3.61Å
38K90Very high91.4Very high10 Ų1011.1 Ų11.14%0.0435%0.051CC..Hα-helixtrans-81-34.6179.4-59177.2175.9-176.70111A35 T36 T41 L158 L250A35-K38 PolarHBondContact O-N 2.74Å; A35-K38 VanDerWaalsContact O-N 3.11Å; T36-K38 VanDerWaalsContact C-N 3.25Å; T36-K38 PolarHBondContact O-N 3.37Å; K38-T41 WeakPolarHBondContact O-CG2 3.41Å; K38-T41 PolarHBondContact O-OG1 3.14Å; K38-L158 HydrophobicContact CB-CD1 3.66Å; K38-L158 HydrophobicContact CB-CD2 4.26Å; K38-L158 HydrophobicContact CD-CD2 3.86Å; K38-L250 HydrophobicContact CB-CD2 3.79Å; K38-L250 HydrophobicContact CD-CD1 4.15Å; K38-L250 HydrophobicContact CD-CD2 3.61Å; K38-L250 HydrophobicContact CG-CD2 3.46Å; K38-L250 VanDerWaalsContact CG-CD2 3.46Å
39S91.4Very high91.1Very high0 Ų013.9 Ų13.90%07%0.07CC..Hα-helixtrans-77.8-27.8-177.873.10000113.5A35 T36 T41 V42 N165A35-S39 WeakPolarHBondContact O-CB 3.38Å; A35-S39 PolarHBondContact O-N 2.88Å; A35-S39 PolarHBondContact O-OG 3.25Å; T36-S39 PolarHBondContact O-N 3.48Å; T36-S39 VanDerWaalsContact O-N 3.07Å; T36-S39 PolarHBondContact O-OG 2.8Å; S39-T41 PolarHBondContact O-N 3.21Å; S39-V42 VanDerWaalsContact O-CG2 3.26Å; S39-V42 WeakPolarHBondContact O-CG2 3.33Å; S39-N165 WeakPolarHBondContact CB-ND2 3.29Å; S39-N165 PolarHBondContact O-ND2 3.39Å; S39-N165 PolarHBondContact OG-ND2 2.88Å
40I91.5Very high91Very high2 Ų217.8 Ų17.81%0.019%0.09CC..G310 helixtrans-71.7-13.6176.447.8172.7000113.2T36 A37 V42 F43 F44 I61 M65 F100 V116 F178T36-I40 WeakPolarHBondContact O-CG1 3.31Å; T36-I40 PolarHBondContact O-N 2.56Å; A37-I40 VanDerWaalsContact O-CG1 3.31Å; A37-I40 WeakPolarHBondContact O-CG1 3.44Å; I40-V42 PolarHBondContact O-N 3.09Å; I40-F43 HydrophobicContact CB-CD2 4.33Å; I40-F43 HydrophobicContact CG2-CD2 4.36Å; I40-F43 HydrophobicContact CG2-CE2 4.42Å; I40-F43 WeakPolarHBondContact O-CD2 3.41Å; I40-F43 PolarHBondContact O-N 2.64Å; I40-F43 VanDerWaalsContact O-N 3.13Å; I40-F44 WeakPolarHBondContact O-CD1 3.44Å; I40-I61 HydrophobicContact CD1-CG2 4.34Å; I40-M65 HydrophobicContact CD1-CE 3.53Å; I40-M65 HydrophobicContact CD1-SD 4.3Å; I40-M65 HydrophobicContact CG1-CE 4.33Å; I40-F100 HydrophobicContact CG2-CE1 3.86Å; I40-F100 HydrophobicContact CG2-CZ 4.11Å; I40-V116 HydrophobicContact CD1-CG1 3.77Å; I40-F178 HydrophobicContact CG2-CE1 4.28Å
41T90.1Very high90.9Very high0 Ų019.9 Ų19.90%010%0.099CC..G310 helixtrans-66.6-20.1179.971.40000112.5A37 K38 S39 F43 F44 V251A37-T41 WeakPolarHBondContact O-CG2 3.37Å; K38-T41 WeakPolarHBondContact O-CG2 3.41Å; K38-T41 PolarHBondContact O-OG1 3.14Å; S39-T41 PolarHBondContact O-N 3.21Å; T41-F43 PolarHBondContact O-N 2.92Å; T41-F44 HydrophobicContact CG2-CD2 4.28Å; T41-F44 HydrophobicContact CG2-CE2 3.81Å; T41-F44 HydrophobicContact CG2-CZ 4.03Å; T41-F44 VanDerWaalsContact O-CB 3.29Å; T41-F44 WeakPolarHBondContact O-CB 3.43Å; T41-F44 WeakPolarHBondContact O-CG 3.4Å; T41-F44 PolarHBondContact O-N 3.27Å; T41-V251 WeakPolarHBondContact CB-O 3.25Å; T41-V251 HydrophobicContact CG2-CB 4.27Å; T41-V251 HydrophobicContact CG2-CG1 3.84Å; T41-V251 HydrophobicContact CG2-CG2 4.34Å; T41-V251 PolarHBondContact OG1-O 2.77Å
42V90.4Very high90.8Very high5 Ų527.1 Ų27.13%0.0314%0.138CC..G310 helixtrans-62.7-23.1175-540000113S39 I40 E46 A162 N165 K258 A268 L271S39-V42 VanDerWaalsContact O-CG2 3.26Å; S39-V42 WeakPolarHBondContact O-CG2 3.33Å; I40-V42 PolarHBondContact O-N 3.09Å; V42-E46 VanDerWaalsContact O-OE2 3.05Å; V42-A162 HydrophobicContact CG1-CB 4.47Å; V42-N165 HydrophobicContact CG2-CB 3.59Å; V42-K258 PolarHBondContact O-NZ 3.11Å; V42-A268 HydrophobicContact CG1-CB 4.35Å; V42-L271 HydrophobicContact CG1-CD1 4.04Å
43F91.3Very high90.7Very high1 Ų127.9 Ų27.90%0.00414%0.143CC..G310 helixtrans-87-11.2176.8-57.5-74.8000113.1I40 T41 K45 E46 I47 N165 Y169 W174 F178 L181I40-F43 HydrophobicContact CB-CD2 4.33Å; I40-F43 HydrophobicContact CG2-CD2 4.36Å; I40-F43 HydrophobicContact CG2-CE2 4.42Å; I40-F43 WeakPolarHBondContact O-CD2 3.41Å; I40-F43 PolarHBondContact O-N 2.64Å; I40-F43 VanDerWaalsContact O-N 3.13Å; T41-F43 PolarHBondContact O-N 2.92Å; F43-K45 PolarHBondContact O-N 3.08Å; F43-E46 PolarHBondContact O-N 3.09Å; F43-I47 HydrophobicContact CB-CD1 3.97Å; F43-I47 HydrophobicContact CB-CG1 4.46Å; F43-I47 VanDerWaalsContact O-CG1 3.32Å; F43-I47 WeakPolarHBondContact O-CG1 3.44Å; F43-I47 PolarHBondContact O-N 2.93Å; F43-N165 WeakPolarHBondContact CE1-O 3.28Å; F43-N165 HydrophobicContact CE2-CB 3.8Å; F43-N165 HydrophobicContact CZ-CB 3.63Å; F43-N165 WeakPolarHBondContact CZ-O 3.39Å; F43-Y169 AromaticContact CD1-CD2 3.72Å; F43-Y169 HydrophobicContact CD1-CD2 3.72Å; F43-Y169 HydrophobicContact CD1-CG 4.3Å; F43-Y169 HydrophobicContact CE1-CD2 4.01Å; F43-Y169 HydrophobicContact CE1-CG 4.34Å; F43-W174 HydrophobicContact CD1-CB 4.38Å; F43-F178 AromaticContact CD2-CE1 3.71Å; F43-F178 HydrophobicContact CD2-CE1 3.71Å; F43-F178 HydrophobicContact CD2-CZ 4.45Å; F43-F178 HydrophobicContact CE2-CD1 4.45Å; F43-F178 AromaticContact CE2-CE1 3.91Å; F43-F178 HydrophobicContact CE2-CE1 3.91Å; F43-F178 HydrophobicContact CG-CE1 4.18Å; F43-L181 HydrophobicContact CE2-CD1 4.04Å; F43-L181 HydrophobicContact CZ-CD1 4.31Å
44F89.6Confident90.6Very high3 Ų330.8 Ų30.81%0.01316%0.161CC..Hα-helixtrans-64.6-42.2-167.1-765.7000112.4I40 T41 E46 I47 E48 V58 I61 S62 V251I40-F44 WeakPolarHBondContact O-CD1 3.44Å; T41-F44 HydrophobicContact CG2-CD2 4.28Å; T41-F44 HydrophobicContact CG2-CE2 3.81Å; T41-F44 HydrophobicContact CG2-CZ 4.03Å; T41-F44 VanDerWaalsContact O-CB 3.29Å; T41-F44 WeakPolarHBondContact O-CB 3.43Å; T41-F44 WeakPolarHBondContact O-CG 3.4Å; T41-F44 PolarHBondContact O-N 3.27Å; F44-E46 PolarHBondContact O-N 3.38Å; F44-I47 PolarHBondContact O-N 3.12Å; F44-E48 WeakPolarHBondContact O-CG 3.23Å; F44-E48 PolarHBondContact O-N 3.24Å; F44-V58 HydrophobicContact CB-CG1 3.6Å; F44-V58 HydrophobicContact CD1-CG1 3.58Å; F44-V58 HydrophobicContact CD2-CG1 3.98Å; F44-V58 HydrophobicContact CE1-CG1 4.18Å; F44-V58 HydrophobicContact CG-CG1 3.46Å; F44-V58 VanDerWaalsContact CG-CG1 3.46Å; F44-I61 HydrophobicContact CE1-CB 4.41Å; F44-I61 HydrophobicContact CZ-CB 4.36Å; F44-S62 WeakPolarHBondContact CE2-OG 3.32Å; F44-S62 WeakPolarHBondContact CZ-OG 3.36Å; F44-V251 HydrophobicContact CD2-CG1 4.31Å; F44-V251 HydrophobicContact CE2-CG1 3.86Å
45K86.8Confident90.4Very high79 Ų7929.1 Ų29.134%0.34316%0.155SC..Hα-helixtrans-62.1-35.4-179.8-176.161.2-166.7164.60112.1F43 E48 V49 K258F43-K45 PolarHBondContact O-N 3.08Å; K45-E48 WeakPolarHBondContact CD-OE2 3.49Å; K45-E48 IonicContact NZ-OE2 3.1Å; K45-E48 PolarHBondContact NZ-OE2 3.45Å; K45-E48 VanDerWaalsContact NZ-OE2 3.1Å; K45-E48 WeakPolarHBondContact O-CB 3.3Å; K45-V49 WeakPolarHBondContact O-CG2 3.14Å; K45-V49 PolarHBondContact O-N 3.29Å; K45-K258 HydrophobicContact CB-CD 4.21Å; K45-K258 HydrophobicContact CG-CD 4.48Å
46E88.2Confident90.3Very high14 Ų1430 Ų307%0.06516%0.162CC..Hα-helixtrans-75.9-39.7178.9-6779.4-177.400111.5V42 F43 F44 E48 V49 I50 Y169 K258 K264V42-E46 VanDerWaalsContact O-OE2 3.05Å; F43-E46 PolarHBondContact O-N 3.09Å; F44-E46 PolarHBondContact O-N 3.38Å; E46-E48 VanDerWaalsContact C-N 3.34Å; E46-V49 PolarHBondContact O-N 3.33Å; E46-I50 WeakPolarHBondContact O-CB 3.41Å; E46-I50 VanDerWaalsContact O-CG1 3.27Å; E46-I50 WeakPolarHBondContact O-CG1 3.27Å; E46-I50 PolarHBondContact O-N 3.23Å; E46-Y169 HydrophobicContact CB-CE2 3.89Å; E46-Y169 HydrophobicContact CG-CE1 3.93Å; E46-Y169 HydrophobicContact CG-CE2 4Å; E46-Y169 WeakPolarHBondContact CG-OH 3.43Å; E46-K258 VanDerWaalsContact CD-NZ 3.3Å; E46-K258 IonicContact OE1-NZ 2.98Å; E46-K258 PolarHBondContact OE1-NZ 3.48Å; E46-K258 IonicContact OE2-NZ 3.01Å; E46-K258 PolarHBondContact OE2-NZ 3.33Å; E46-K264 WeakPolarHBondContact OE1-CD 3.24Å; E46-K264 VanDerWaalsContact OE1-CE 3.23Å; E46-K264 WeakPolarHBondContact OE1-CE 3.34Å; E46-K264 IonicContact OE1-NZ 2.83Å; E46-K264 PolarHBondContact OE1-NZ 3.08Å
47I90.6Very high90.2Very high1 Ų133.8 Ų33.81%0.00518%0.179CC..Hα-helixtrans-62.7-40.2172.6-68.9171.6000111F43 F44 V49 I50 F51 V58 F178F43-I47 HydrophobicContact CB-CD1 3.97Å; F43-I47 HydrophobicContact CB-CG1 4.46Å; F43-I47 VanDerWaalsContact O-CG1 3.32Å; F43-I47 WeakPolarHBondContact O-CG1 3.44Å; F43-I47 PolarHBondContact O-N 2.93Å; F44-I47 PolarHBondContact O-N 3.12Å; I47-V49 VanDerWaalsContact C-N 3.28Å; I47-V49 PolarHBondContact O-N 2.84Å; I47-I50 PolarHBondContact O-N 3.08Å; I47-F51 HydrophobicContact CG2-CD2 3.75Å; I47-F51 HydrophobicContact CG2-CE2 4.26Å; I47-F51 PolarHBondContact O-N 3.42Å; I47-V58 HydrophobicContact CB-CG1 4.26Å; I47-V58 HydrophobicContact CG2-CG1 4Å; I47-V58 HydrophobicContact CG2-CG2 3.96Å; I47-F178 HydrophobicContact CD1-CZ 4.24Å
48E89.2Confident90.2Very high14 Ų1433.7 Ų33.77%0.06518%0.178CC..Hα-helixtrans-52.6-48172.9-76.5174.2-165.300110.7F44 K45 E46 N52 V53 S55 V58 K382F44-E48 WeakPolarHBondContact O-CG 3.23Å; F44-E48 PolarHBondContact O-N 3.24Å; K45-E48 WeakPolarHBondContact CD-OE2 3.49Å; K45-E48 IonicContact NZ-OE2 3.1Å; K45-E48 PolarHBondContact NZ-OE2 3.45Å; K45-E48 VanDerWaalsContact NZ-OE2 3.1Å; K45-E48 WeakPolarHBondContact O-CB 3.3Å; E46-E48 VanDerWaalsContact C-N 3.34Å; E48-N52 VanDerWaalsContact O-CA 3.25Å; E48-N52 WeakPolarHBondContact O-CA 3.36Å; E48-N52 PolarHBondContact O-N 3.38Å; E48-V53 PolarHBondContact O-N 2.96Å; E48-V53 VanDerWaalsContact O-N 3.09Å; E48-S55 VanDerWaalsContact OE1-CA 3.32Å; E48-S55 WeakPolarHBondContact OE1-CA 3.41Å; E48-S55 VanDerWaalsContact OE1-CB 3.25Å; E48-S55 WeakPolarHBondContact OE1-CB 3.37Å; E48-S55 PolarHBondContact OE1-OG 2.89Å; E48-V58 HydrophobicContact CB-CG2 4.4Å; E48-V58 HydrophobicContact CG-CB 4.27Å; E48-V58 HydrophobicContact CG-CG2 3.66Å; E48-K382 IonicContact OE1-NZ 3.37Å; E48-K382 PolarHBondContact OE1-NZ 3.48Å; E48-K382 IonicContact OE2-NZ 3.27Å; E48-K382 PolarHBondContact OE2-NZ 3.46Å
49V89.8Confident90.3Very high105 Ų10533.2 Ų33.264%0.63618%0.176SC*.Hα-helixtrans-72-44.7-177.6174.60000111.9K45 E46 I47 N52K45-V49 WeakPolarHBondContact O-CG2 3.14Å; K45-V49 PolarHBondContact O-N 3.29Å; E46-V49 PolarHBondContact O-N 3.33Å; I47-V49 VanDerWaalsContact C-N 3.28Å; I47-V49 PolarHBondContact O-N 2.84Å; V49-N52 PolarHBondContact O-N 3.07Å
50I91.7Very high90.4Very high82 Ų8236.8 Ų36.842%0.42119%0.19SC..Hα-helixtrans-67.4-42.6-175.5-69.9167.9000111.7E46 I47E46-I50 WeakPolarHBondContact O-CB 3.41Å; E46-I50 VanDerWaalsContact O-CG1 3.27Å; E46-I50 WeakPolarHBondContact O-CG1 3.27Å; E46-I50 PolarHBondContact O-N 3.23Å; I47-I50 PolarHBondContact O-N 3.08Å
51F91.6Very high90.6Very high43 Ų4336.9 Ų36.919%0.18919%0.19CC..Hα-helixtrans-94.1-1-178.5-69.1-74.7000113.3I47 V53 N107 V109 L112 W174I47-F51 HydrophobicContact CG2-CD2 3.75Å; I47-F51 HydrophobicContact CG2-CE2 4.26Å; I47-F51 PolarHBondContact O-N 3.42Å; F51-V53 VanDerWaalsContact C-N 3.3Å; F51-V53 HydrophobicContact CB-CG1 4.09Å; F51-V53 HydrophobicContact CB-CG2 3.98Å; F51-V53 PolarHBondContact O-N 3.06Å; F51-N107 WeakPolarHBondContact CE1-O 3.44Å; F51-V109 HydrophobicContact CB-CG2 3.66Å; F51-V109 HydrophobicContact CD1-CG2 4.21Å; F51-V109 HydrophobicContact CD2-CG2 4.06Å; F51-V109 HydrophobicContact CG-CG2 3.71Å; F51-L112 HydrophobicContact CE2-CD1 4.16Å; F51-W174 HydrophobicContact CE2-CH2 4.13Å; F51-W174 AromaticContact CE2-CZ2 3.82Å; F51-W174 HydrophobicContact CE2-CZ2 3.82Å; F51-W174 AromaticContact CZ-CH2 3.91Å; F51-W174 HydrophobicContact CZ-CH2 3.91Å; F51-W174 AromaticContact CZ-CZ2 3.66Å; F51-W174 HydrophobicContact CZ-CZ2 3.66Å
52N91Very high90.7Very high153 Ų15336.9 Ų36.982%0.81819%0.19SC*.THydrogen-bonded Turntrans50.149.4-176.1-166.636.6000112.6E48 V49E48-N52 VanDerWaalsContact O-CA 3.25Å; E48-N52 WeakPolarHBondContact O-CA 3.36Å; E48-N52 PolarHBondContact O-N 3.38Å; V49-N52 PolarHBondContact O-N 3.07Å
53V92Very high90.8Very high29 Ų2936.7 Ų36.718%0.17619%0.189CC..  trans-117.1158.7-176.5-70.60000111.1E48 F51 Q57 V58 V109E48-V53 PolarHBondContact O-N 2.96Å; E48-V53 VanDerWaalsContact O-N 3.09Å; F51-V53 VanDerWaalsContact C-N 3.3Å; F51-V53 HydrophobicContact CB-CG1 4.09Å; F51-V53 HydrophobicContact CB-CG2 3.98Å; F51-V53 PolarHBondContact O-N 3.06Å; V53-Q57 HydrophobicContact CB-CB 4.18Å; V53-Q57 VanDerWaalsContact CB-OE1 3.27Å; V53-V58 HydrophobicContact CG2-CG2 3.41Å; V53-V58 VanDerWaalsContact CG2-CG2 3.41Å; V53-V109 HydrophobicContact CG1-CG2 3.88Å; V53-V109 HydrophobicContact CG2-CG2 4.07Å
54T91.1Very high91Very high61 Ų6137.8 Ų37.837%0.37420%0.195SC..  trans-77.7164-178.987.60000112.4S56 Q57 V58 D383T54-S56 VanDerWaalsContact C-N 3.27Å; T54-S56 PolarHBondContact O-N 3.39Å; T54-S56 PolarHBondContact OG1-N 3.48Å; T54-Q57 WeakPolarHBondContact O-CB 3.4Å; T54-Q57 PolarHBondContact O-N 3.05Å; T54-Q57 VanDerWaalsContact O-N 3.14Å; T54-Q57 PolarHBondContact OG1-N 3.08Å; T54-V58 PolarHBondContact O-N 3.16Å; T54-V58 VanDerWaalsContact O-N 3.11Å; T54-D383 WeakPolarHBondContact CB-OD2 3.39Å; T54-D383 PolarHBondContact OG1-OD2 3.29Å
55S86.6Confident91.3Very high4 Ų437.7 Ų37.73%0.02819%0.194CC..Hα-helixtrans-65.2-35.4-179.9-26.30000111.7E48 S59 K382 D383E48-S55 VanDerWaalsContact OE1-CA 3.32Å; E48-S55 WeakPolarHBondContact OE1-CA 3.41Å; E48-S55 VanDerWaalsContact OE1-CB 3.25Å; E48-S55 WeakPolarHBondContact OE1-CB 3.37Å; E48-S55 PolarHBondContact OE1-OG 2.89Å; S55-S59 VanDerWaalsContact O-CB 3.32Å; S55-S59 WeakPolarHBondContact O-CB 3.42Å; S55-S59 PolarHBondContact O-N 3.16Å; S55-S59 PolarHBondContact O-OG 2.86Å; S55-K382 WeakPolarHBondContact OG-CD 3.29Å; S55-K382 VanDerWaalsContact OG-CE 3.31Å; S55-K382 WeakPolarHBondContact OG-CE 3.32Å; S55-K382 PolarHBondContact OG-NZ 3.41Å; S55-D383 WeakPolarHBondContact CB-OD1 3.49Å; S55-D383 PolarHBondContact N-OD1 2.79Å; S55-D383 PolarHBondContact OG-OD1 2.75Å
56S89.4Confident91.5Very high19 Ų1934.1 Ų34.113%0.13318%0.179CC..Hα-helixtrans-58.3-48.1172.1-174.70000111T54 S59 W60 P376 D383T54-S56 VanDerWaalsContact C-N 3.27Å; T54-S56 PolarHBondContact O-N 3.39Å; T54-S56 PolarHBondContact OG1-N 3.48Å; S56-S59 PolarHBondContact O-N 2.7Å; S56-S59 PolarHBondContact O-OG 3.31Å; S56-W60 PolarHBondContact O-N 3.21Å; S56-P376 WeakPolarHBondContact CB-O 3.46Å; S56-P376 PolarHBondContact OG-O 3.41Å; S56-D383 WeakPolarHBondContact CB-OD2 3.45Å; S56-D383 PolarHBondContact N-OD2 3.36Å
57Q90.9Very high91.8Very high82 Ų8233.9 Ų33.938%0.38318%0.179SC..Hα-helixtrans-58.8-52.1178.3-69.2176.9-52.400111.3V53 T54 S59 W60 Y113V53-Q57 HydrophobicContact CB-CB 4.18Å; V53-Q57 VanDerWaalsContact CB-OE1 3.27Å; T54-Q57 WeakPolarHBondContact O-CB 3.4Å; T54-Q57 PolarHBondContact O-N 3.05Å; T54-Q57 VanDerWaalsContact O-N 3.14Å; T54-Q57 PolarHBondContact OG1-N 3.08Å; Q57-S59 VanDerWaalsContact C-N 3.28Å; Q57-S59 PolarHBondContact O-N 2.78Å; Q57-W60 WeakPolarHBondContact O-CB 3.48Å; Q57-W60 PolarHBondContact O-N 2.94Å; Q57-W60 VanDerWaalsContact O-N 3.13Å; Q57-Y113 WeakPolarHBondContact O-CE1 3.12Å; Q57-Y113 PolarHBondContact O-OH 3.47Å
58V91.3Very high92Very high0 Ų035.3 Ų35.30%019%0.188CC..Hα-helixtrans-63-35.5-179.4-175.80000112.6F44 I47 E48 V53 T54 W60 I61F44-V58 HydrophobicContact CB-CG1 3.6Å; F44-V58 HydrophobicContact CD1-CG1 3.58Å; F44-V58 HydrophobicContact CD2-CG1 3.98Å; F44-V58 HydrophobicContact CE1-CG1 4.18Å; F44-V58 HydrophobicContact CG-CG1 3.46Å; F44-V58 VanDerWaalsContact CG-CG1 3.46Å; I47-V58 HydrophobicContact CB-CG1 4.26Å; I47-V58 HydrophobicContact CG2-CG1 4Å; I47-V58 HydrophobicContact CG2-CG2 3.96Å; E48-V58 HydrophobicContact CB-CG2 4.4Å; E48-V58 HydrophobicContact CG-CB 4.27Å; E48-V58 HydrophobicContact CG-CG2 3.66Å; V53-V58 HydrophobicContact CG2-CG2 3.41Å; V53-V58 VanDerWaalsContact CG2-CG2 3.41Å; T54-V58 PolarHBondContact O-N 3.16Å; T54-V58 VanDerWaalsContact O-N 3.11Å; V58-W60 PolarHBondContact O-N 3.27Å; V58-I61 HydrophobicContact CG1-CD1 4.19Å; V58-I61 WeakPolarHBondContact O-CB 3.41Å; V58-I61 WeakPolarHBondContact O-CG1 3.37Å; V58-I61 PolarHBondContact O-N 2.91Å
59S91.6Very high92.1Very high0 Ų034.7 Ų34.70%019%0.185CC..Hα-helixtrans-65.6-18.2178.976.90000114.5S55 S56 Q57 I61 S62 S63 P376S55-S59 VanDerWaalsContact O-CB 3.32Å; S55-S59 WeakPolarHBondContact O-CB 3.42Å; S55-S59 PolarHBondContact O-N 3.16Å; S55-S59 PolarHBondContact O-OG 2.86Å; S56-S59 PolarHBondContact O-N 2.7Å; S56-S59 PolarHBondContact O-OG 3.31Å; Q57-S59 VanDerWaalsContact C-N 3.28Å; Q57-S59 PolarHBondContact O-N 2.78Å; S59-I61 PolarHBondContact O-N 3.22Å; S59-S62 PolarHBondContact O-OG 2.86Å; S59-S63 WeakPolarHBondContact O-CB 3.15Å; S59-S63 PolarHBondContact O-N 2.9Å; S59-S63 PolarHBondContact O-OG 3.29Å; S59-P376 VanDerWaalsContact OG-CA 3.26Å; S59-P376 WeakPolarHBondContact OG-CA 3.4Å
60W94.3Very high92Very high76 Ų7631.3 Ų31.329%0.28816%0.161SC..Hα-helixtrans-62-29.5171.4-80.199.3000112S56 Q57 V58 S62 S63 I64 Y113 L372 L373 P376S56-W60 PolarHBondContact O-N 3.21Å; Q57-W60 WeakPolarHBondContact O-CB 3.48Å; Q57-W60 PolarHBondContact O-N 2.94Å; Q57-W60 VanDerWaalsContact O-N 3.13Å; V58-W60 PolarHBondContact O-N 3.27Å; W60-S62 PolarHBondContact O-N 3.43Å; W60-S63 PolarHBondContact O-N 3.31Å; W60-I64 HydrophobicContact CB-CD1 4.17Å; W60-I64 HydrophobicContact CE3-CD1 4.16Å; W60-I64 HydrophobicContact CE3-CG1 4Å; W60-I64 VanDerWaalsContact O-CB 3.29Å; W60-I64 WeakPolarHBondContact O-CB 3.48Å; W60-I64 WeakPolarHBondContact O-CD1 3.32Å; W60-I64 WeakPolarHBondContact O-CG1 3.47Å; W60-I64 PolarHBondContact O-N 3.28Å; W60-Y113 HydrophobicContact CB-CD1 4.07Å; W60-Y113 HydrophobicContact CB-CE1 3.5Å; W60-Y113 HydrophobicContact CB-CE2 4.49Å; W60-L372 HydrophobicContact CE3-CD1 3.95Å; W60-L372 HydrophobicContact CE3-CG 4.48Å; W60-L372 HydrophobicContact CZ3-CD1 3.65Å; W60-L372 HydrophobicContact CZ3-CD2 4.37Å; W60-L372 HydrophobicContact CZ3-CG 3.72Å; W60-L373 HydrophobicContact CH2-CD2 3.85Å; W60-P376 HydrophobicContact CD2-CB 4.01Å; W60-P376 HydrophobicContact CD2-CG 3.57Å; W60-P376 VanDerWaalsContact CE2-CB 3.49Å; W60-P376 HydrophobicContact CE3-CG 4.07Å; W60-P376 HydrophobicContact CG-CB 4.22Å; W60-P376 HydrophobicContact CG-CG 3.8Å; W60-P376 HydrophobicContact CZ2-CB 3.88Å; W60-P376 HydrophobicContact CZ2-CG 4.09Å
61I94.2Very high91.9Very high3 Ų328.8 Ų28.82%0.01516%0.155CC..Hα-helixtrans-58.5-54.6-179.8-58.4171.7000110.7I40 F44 V58 S59 M65 V109 L112 Y113 V116I40-I61 HydrophobicContact CD1-CG2 4.34Å; F44-I61 HydrophobicContact CE1-CB 4.41Å; F44-I61 HydrophobicContact CZ-CB 4.36Å; V58-I61 HydrophobicContact CG1-CD1 4.19Å; V58-I61 WeakPolarHBondContact O-CB 3.41Å; V58-I61 WeakPolarHBondContact O-CG1 3.37Å; V58-I61 PolarHBondContact O-N 2.91Å; S59-I61 PolarHBondContact O-N 3.22Å; I61-M65 WeakPolarHBondContact O-CB 3.13Å; I61-M65 PolarHBondContact O-N 2.89Å; I61-M65 VanDerWaalsContact O-N 3.16Å; I61-V109 HydrophobicContact CD1-CG1 4.49Å; I61-L112 HydrophobicContact CD1-CB 4.11Å; I61-L112 HydrophobicContact CD1-CD1 4.19Å; I61-L112 HydrophobicContact CG1-CB 4.43Å; I61-Y113 HydrophobicContact CB-CD1 4.48Å; I61-Y113 HydrophobicContact CG1-CD1 3.64Å; I61-Y113 HydrophobicContact CG1-CE1 3.7Å; I61-V116 HydrophobicContact CG2-CB 3.95Å; I61-V116 HydrophobicContact CG2-CG1 3.75Å
62S92.4Very high91.7Very high1 Ų126.8 Ų26.81%0.00715%0.147CC..Hα-helixtrans-69.9-35.6179.249.70000112.5F44 S59 W60 M65 L66F44-S62 WeakPolarHBondContact CE2-OG 3.32Å; F44-S62 WeakPolarHBondContact CZ-OG 3.36Å; S59-S62 PolarHBondContact O-OG 2.86Å; W60-S62 PolarHBondContact O-N 3.43Å; S62-M65 PolarHBondContact O-N 3.42Å; S62-L66 WeakPolarHBondContact O-CG 3.34Å; S62-L66 PolarHBondContact O-N 3.31Å
63S93.5Very high91.4Very high0 Ų019.9 Ų19.90%011%0.112CC..Hα-helixtrans-69.1-43.7-176.7-52.30000111.5S59 W60 M65 L66 A67 L372 P375 P376S59-S63 WeakPolarHBondContact O-CB 3.15Å; S59-S63 PolarHBondContact O-N 2.9Å; S59-S63 PolarHBondContact O-OG 3.29Å; W60-S63 PolarHBondContact O-N 3.31Å; S63-M65 VanDerWaalsContact C-N 3.34Å; S63-L66 PolarHBondContact O-N 3.23Å; S63-A67 WeakPolarHBondContact O-CB 3.38Å; S63-A67 PolarHBondContact O-N 3.36Å; S63-L372 WeakPolarHBondContact CB-O 3.36Å; S63-P375 WeakPolarHBondContact OG-CB 3.33Å; S63-P375 WeakPolarHBondContact OG-CG 3.39Å; S63-P376 WeakPolarHBondContact OG-CD 3.42Å
64I95.3Very high91Very high25 Ų2520.7 Ų20.713%0.12812%0.118CC..Hα-helixtrans-61.1-45.9171.8-66.1166.3000109.5W60 L66 A67 V68 Y113 V118 L372W60-I64 HydrophobicContact CB-CD1 4.17Å; W60-I64 HydrophobicContact CE3-CD1 4.16Å; W60-I64 HydrophobicContact CE3-CG1 4Å; W60-I64 VanDerWaalsContact O-CB 3.29Å; W60-I64 WeakPolarHBondContact O-CB 3.48Å; W60-I64 WeakPolarHBondContact O-CD1 3.32Å; W60-I64 WeakPolarHBondContact O-CG1 3.47Å; W60-I64 PolarHBondContact O-N 3.28Å; I64-L66 PolarHBondContact O-N 3.4Å; I64-A67 PolarHBondContact O-N 3.21Å; I64-V68 HydrophobicContact CG2-CG2 3.95Å; I64-V68 VanDerWaalsContact O-CB 3.3Å; I64-V68 WeakPolarHBondContact O-CB 3.45Å; I64-V68 WeakPolarHBondContact O-CG2 3.31Å; I64-V68 PolarHBondContact O-N 3.05Å; I64-Y113 HydrophobicContact CD1-CD1 4.14Å; I64-Y113 HydrophobicContact CD1-CD2 4.43Å; I64-Y113 HydrophobicContact CD1-CG 3.88Å; I64-V118 HydrophobicContact CG2-CG2 3.94Å; I64-L372 HydrophobicContact CB-CD1 4.36Å; I64-L372 HydrophobicContact CG1-CD1 3.69Å
65M95.4Very high90.8Very high0 Ų021.9 Ų21.90%012%0.121CC..Hα-helixtrans-60.6-45.5-179.3-162.4166.370.100112.7T36 A37 I40 I61 S62 S63 T69 F100 V116 G117 L124T36-M65 HydrophobicContact CG2-CE 3.94Å; A37-M65 HydrophobicContact CB-CE 3.28Å; I40-M65 HydrophobicContact CD1-CE 3.53Å; I40-M65 HydrophobicContact CD1-SD 4.3Å; I40-M65 HydrophobicContact CG1-CE 4.33Å; I61-M65 WeakPolarHBondContact O-CB 3.13Å; I61-M65 PolarHBondContact O-N 2.89Å; I61-M65 VanDerWaalsContact O-N 3.16Å; S62-M65 PolarHBondContact O-N 3.42Å; S63-M65 VanDerWaalsContact C-N 3.34Å; M65-T69 VanDerWaalsContact O-CB 3.29Å; M65-T69 WeakPolarHBondContact O-CB 3.32Å; M65-T69 PolarHBondContact O-N 3.02Å; M65-T69 PolarHBondContact O-OG1 3.25Å; M65-F100 HydrophobicContact SD-CE2 4.21Å; M65-F100 HydrophobicContact SD-CZ 4.34Å; M65-V116 HydrophobicContact SD-CG1 3.91Å; M65-G117 WeakPolarHBondContact CA-O 3.22Å; M65-L124 HydrophobicContact CE-CD1 4.33Å; M65-L124 HydrophobicContact CG-CD1 4.46Å; M65-L124 HydrophobicContact SD-CD1 4.12Å
66L92.3Very high90.9Very high4 Ų421.7 Ų21.72%0.02112%0.12CC..Hα-helixtrans-65.7-46.1176.8-75.6169.3000111.8A37 S62 S63 I64 V68 T69 Y70 F247 V371A37-L66 HydrophobicContact CB-CD1 4.21Å; A37-L66 HydrophobicContact CB-CD2 3.66Å; A37-L66 HydrophobicContact CB-CG 3.61Å; S62-L66 WeakPolarHBondContact O-CG 3.34Å; S62-L66 PolarHBondContact O-N 3.31Å; S63-L66 PolarHBondContact O-N 3.23Å; I64-L66 PolarHBondContact O-N 3.4Å; L66-V68 PolarHBondContact O-N 2.8Å; L66-T69 PolarHBondContact O-N 3.21Å; L66-Y70 HydrophobicContact CD2-CE1 4.42Å; L66-Y70 WeakPolarHBondContact O-CD1 3.44Å; L66-Y70 PolarHBondContact O-N 3.24Å; L66-F247 HydrophobicContact CD1-CD1 4.39Å; L66-V371 HydrophobicContact CB-CG1 3.51Å; L66-V371 HydrophobicContact CD1-CG1 4.34Å
67A93.3Very high90.4Very high9 Ų922.9 Ų22.97%0.07413%0.128CC..Hα-helixtrans-61.5-43.3179.700000111.9S63 I64 Y70 G71 C368 L372S63-A67 WeakPolarHBondContact O-CB 3.38Å; S63-A67 PolarHBondContact O-N 3.36Å; I64-A67 PolarHBondContact O-N 3.21Å; A67-Y70 PolarHBondContact O-N 3.2Å; A67-G71 WeakPolarHBondContact O-CA 3.49Å; A67-G71 PolarHBondContact O-N 3.45Å; A67-C368 PolarHBondContact O-SG 3.29Å; A67-L372 HydrophobicContact CB-CB 3.8Å; A67-L372 HydrophobicContact CB-CD1 4.03Å; A67-L372 HydrophobicContact CB-CG 4.41Å
68V94.4Very high90Very high32 Ų3223 Ų2319%0.19413%0.131CC..Hα-helixtrans-68.8-37.5176.1175.70000111.1I64 L66 Y70 G72 L122I64-V68 HydrophobicContact CG2-CG2 3.95Å; I64-V68 VanDerWaalsContact O-CB 3.3Å; I64-V68 WeakPolarHBondContact O-CB 3.45Å; I64-V68 WeakPolarHBondContact O-CG2 3.31Å; I64-V68 PolarHBondContact O-N 3.05Å; L66-V68 PolarHBondContact O-N 2.8Å; V68-Y70 VanDerWaalsContact C-N 3.34Å; V68-Y70 PolarHBondContact O-N 2.99Å; V68-G72 WeakPolarHBondContact O-CA 3.43Å; V68-G72 PolarHBondContact O-N 3Å; V68-L122 HydrophobicContact CG1-CB 4.23Å; V68-L122 HydrophobicContact CG1-CD2 3.67Å; V68-L122 HydrophobicContact CG1-CG 3.51Å
69T92.4Very high89.6Confident1 Ų125.3 Ų25.31%0.00614%0.143CC..Hα-helixtrans-60.7-44.4175.7-60.10000111.2M65 L66 G121 L124 S125 L128M65-T69 VanDerWaalsContact O-CB 3.29Å; M65-T69 WeakPolarHBondContact O-CB 3.32Å; M65-T69 PolarHBondContact O-N 3.02Å; M65-T69 PolarHBondContact O-OG1 3.25Å; L66-T69 PolarHBondContact O-N 3.21Å; T69-G121 WeakPolarHBondContact CA-O 3.47Å; T69-G121 WeakPolarHBondContact OG1-CA 3.38Å; T69-G121 PolarHBondContact OG1-O 3.02Å; T69-L124 HydrophobicContact CG2-CB 4.21Å; T69-S125 VanDerWaalsContact O-CB 3.26Å; T69-S125 WeakPolarHBondContact O-CB 3.42Å; T69-S125 PolarHBondContact O-OG 3.01Å; T69-L128 HydrophobicContact CG2-CD2 4.22Å
70Y87.9Confident89.2Confident33 Ų3325.8 Ų25.813%0.12915%0.146CC..Hα-helixtrans-76.7-45.8-177.9-7627.7000111Y34 L66 A67 V68 G72 G73Y34-Y70 HydrophobicContact CD1-CE1 4.28Å; Y34-Y70 AromaticContact CE1-CE1 3.66Å; Y34-Y70 HydrophobicContact CE1-CE1 3.66Å; Y34-Y70 AromaticContact CE1-CZ 3.86Å; Y34-Y70 WeakPolarHBondContact CE1-OH 3.19Å; L66-Y70 HydrophobicContact CD2-CE1 4.42Å; L66-Y70 WeakPolarHBondContact O-CD1 3.44Å; L66-Y70 PolarHBondContact O-N 3.24Å; A67-Y70 PolarHBondContact O-N 3.2Å; V68-Y70 VanDerWaalsContact C-N 3.34Å; V68-Y70 PolarHBondContact O-N 2.99Å; Y70-G72 VanDerWaalsContact C-N 3.3Å; Y70-G72 PolarHBondContact O-N 3.27Å; Y70-G73 PolarHBondContact O-N 3.43Å
71G88Confident88.5Confident29 Ų2926.3 Ų26.330%0.29915%0.154SC..Hα-helixtrans-71.8-21.1-179.400000114A67 G73 P74 C368A67-G71 WeakPolarHBondContact O-CA 3.49Å; A67-G71 PolarHBondContact O-N 3.45Å; G71-G73 PolarHBondContact O-N 2.83Å; G71-P74 WeakPolarHBondContact O-CD 3.11Å; G71-C368 WeakPolarHBondContact CA-SG 3.3Å; G71-C368 PolarHBondContact N-SG 3.14Å
72G87.8Confident87.9Confident2 Ų233.2 Ų33.22%0.02118%0.184CC..THydrogen-bonded Turntrans-72.3-5.9174.800000114.5V68 Y70 I75 S76 S125V68-G72 WeakPolarHBondContact O-CA 3.43Å; V68-G72 PolarHBondContact O-N 3Å; Y70-G72 VanDerWaalsContact C-N 3.3Å; Y70-G72 PolarHBondContact O-N 3.27Å; G72-I75 PolarHBondContact O-N 3.25Å; G72-S76 WeakPolarHBondContact O-CB 3.23Å; G72-S76 PolarHBondContact O-N 3.37Å; G72-S125 VanDerWaalsContact CA-OG 3.3Å; G72-S125 WeakPolarHBondContact CA-OG 3.41Å; G72-S125 PolarHBondContact O-OG 2.84Å
73G85.5Confident87.6Confident8 Ų839.7 Ų39.78%0.08221%0.209CC..Hα-helixtrans-55.5-51.1-176.800000115.3Y70 G71 I75 S76 S77 S125 N129Y70-G73 PolarHBondContact O-N 3.43Å; G71-G73 PolarHBondContact O-N 2.83Å; G73-I75 VanDerWaalsContact C-N 3.32Å; G73-I75 PolarHBondContact O-N 2.87Å; G73-S76 WeakPolarHBondContact O-CB 3.38Å; G73-S76 PolarHBondContact O-N 3.27Å; G73-S77 PolarHBondContact O-N 2.92Å; G73-S125 PolarHBondContact N-OG 2.92Å; G73-N129 WeakPolarHBondContact CA-ND2 3.46Å
74P82.8Confident87.2Confident45 Ų4541 Ų4129%0.29222%0.222SC..Hα-helixtrans-59.1-41.2175.7-25.334.8000113.1G71 S77 I78 I365G71-P74 WeakPolarHBondContact O-CD 3.11Å; P74-S77 PolarHBondContact O-N 3.09Å; P74-I78 WeakPolarHBondContact O-CG1 3.41Å; P74-I78 PolarHBondContact O-N 3.24Å; P74-I365 HydrophobicContact CG-CD1 3.78Å; P74-I365 HydrophobicContact CG-CG1 4.15Å
75I87.4Confident86.9Confident87 Ų8740 Ų4045%0.44622%0.218SC..Hα-helixtrans-63.2-47.1178.3-57174.9000109.7G72 G73 S77 I78 L79 F126G72-I75 PolarHBondContact O-N 3.25Å; G73-I75 VanDerWaalsContact C-N 3.32Å; G73-I75 PolarHBondContact O-N 2.87Å; I75-S77 VanDerWaalsContact C-N 3.34Å; I75-S77 PolarHBondContact O-N 3.03Å; I75-I78 PolarHBondContact O-N 3.05Å; I75-L79 HydrophobicContact CG2-CD1 4.05Å; I75-L79 WeakPolarHBondContact O-CG 3.37Å; I75-L79 PolarHBondContact O-N 3.33Å; I75-F126 HydrophobicContact CB-CE1 4.34Å; I75-F126 HydrophobicContact CG2-CE1 3.89Å; I75-F126 HydrophobicContact CG2-CZ 3.97Å
76S87.8Confident86.8Confident0 Ų045.4 Ų45.40%024%0.238CC..Hα-helixtrans-56.8-46.7175.8-166.30000111.4G72 G73 I78 L79 V80 S125G72-S76 WeakPolarHBondContact O-CB 3.23Å; G72-S76 PolarHBondContact O-N 3.37Å; G73-S76 WeakPolarHBondContact O-CB 3.38Å; G73-S76 PolarHBondContact O-N 3.27Å; S76-I78 PolarHBondContact O-N 3.06Å; S76-L79 PolarHBondContact O-N 2.94Å; S76-V80 VanDerWaalsContact O-CG2 3.24Å; S76-V80 WeakPolarHBondContact O-CG2 3.26Å; S76-V80 PolarHBondContact O-N 3.39Å; S76-S125 PolarHBondContact OG-O 3.45Å
77S80.8Confident86.9Confident44 Ų4448.6 Ų48.631%0.30826%0.259SS..Hα-helixtrans-60.5-45.9178.4-174.80000112.9G73 P74 I75 L79 V80 N81G73-S77 PolarHBondContact O-N 2.92Å; P74-S77 PolarHBondContact O-N 3.09Å; I75-S77 VanDerWaalsContact C-N 3.34Å; I75-S77 PolarHBondContact O-N 3.03Å; S77-L79 VanDerWaalsContact C-N 3.34Å; S77-L79 PolarHBondContact O-N 3.28Å; S77-V80 PolarHBondContact O-N 2.81Å; S77-N81 VanDerWaalsContact O-CG 3.29Å; S77-N81 PolarHBondContact O-N 3.36Å; S77-N81 PolarHBondContact O-ND2 2.84Å; S77-N81 VanDerWaalsContact O-ND2 3.14Å
78I81.1Confident86.9Confident85 Ų8548.5 Ų48.544%0.43626%0.257SS..Hα-helixtrans-60.9-45.1177.2-67.5165.8000110.7P74 I75 S76 N81 K82 F221P74-I78 WeakPolarHBondContact O-CG1 3.41Å; P74-I78 PolarHBondContact O-N 3.24Å; I75-I78 PolarHBondContact O-N 3.05Å; S76-I78 PolarHBondContact O-N 3.06Å; I78-N81 PolarHBondContact O-N 3.35Å; I78-K82 PolarHBondContact O-N 2.92Å; I78-K82 VanDerWaalsContact O-N 3.13Å; I78-F221 HydrophobicContact CG1-CE2 4.39Å
79L83.6Confident86.9Confident48 Ų4847 Ų4725%0.25125%0.248SC..Hα-helixtrans-64.5-41.4178.7-71172.1000111.9I75 S76 S77 N81 K82 Y83 V88 F126I75-L79 HydrophobicContact CG2-CD1 4.05Å; I75-L79 WeakPolarHBondContact O-CG 3.37Å; I75-L79 PolarHBondContact O-N 3.33Å; S76-L79 PolarHBondContact O-N 2.94Å; S77-L79 VanDerWaalsContact C-N 3.34Å; S77-L79 PolarHBondContact O-N 3.28Å; L79-N81 VanDerWaalsContact C-N 3.33Å; L79-N81 PolarHBondContact O-N 3.22Å; L79-K82 PolarHBondContact O-N 3.4Å; L79-Y83 HydrophobicContact CD2-CD2 3.92Å; L79-Y83 HydrophobicContact CD2-CE2 3.82Å; L79-Y83 PolarHBondContact O-N 3.26Å; L79-V88 HydrophobicContact CB-CG1 4.37Å; L79-V88 HydrophobicContact CB-CG2 3.83Å; L79-F126 HydrophobicContact CD1-CD1 4.47Å; L79-F126 HydrophobicContact CD1-CE1 3.78Å; L79-F126 HydrophobicContact CD1-CE2 4.04Å; L79-F126 HydrophobicContact CD1-CZ 3.54Å
80V83Confident87.1Confident10 Ų1050.4 Ų50.46%0.06127%0.265CS..Hα-helixtrans-62.7-40.8176.4169.30000111.4S76 S77 K82 G84 S85 V88 P130S76-V80 VanDerWaalsContact O-CG2 3.24Å; S76-V80 WeakPolarHBondContact O-CG2 3.26Å; S76-V80 PolarHBondContact O-N 3.39Å; S77-V80 PolarHBondContact O-N 2.81Å; V80-K82 VanDerWaalsContact C-N 3.29Å; V80-K82 PolarHBondContact O-N 2.97Å; V80-G84 CarbonylContact O-C 3.59Å; V80-G84 WeakPolarHBondContact O-CA 3.44Å; V80-G84 PolarHBondContact O-N 2.96Å; V80-S85 WeakPolarHBondContact CG1-OG 3.3Å; V80-V88 HydrophobicContact CG2-CB 4.14Å; V80-V88 HydrophobicContact CG2-CG1 4.07Å; V80-V88 HydrophobicContact CG2-CG2 4.18Å; V80-P130 HydrophobicContact CG2-CB 3.64Å; V80-P130 HydrophobicContact CG2-CG 3.44Å; V80-P130 VanDerWaalsContact CG2-CG 3.44Å
81N79.7Confident87.5Confident86 Ų8654.1 Ų54.146%0.4628%0.282SS..Hα-helixtrans-66.3-33.5178.6-71.8-31.6000112.1S77 I78 L79S77-N81 VanDerWaalsContact O-CG 3.29Å; S77-N81 PolarHBondContact O-N 3.36Å; S77-N81 PolarHBondContact O-ND2 2.84Å; S77-N81 VanDerWaalsContact O-ND2 3.14Å; I78-N81 PolarHBondContact O-N 3.35Å; L79-N81 VanDerWaalsContact C-N 3.33Å; L79-N81 PolarHBondContact O-N 3.22Å
82K81.8Confident87.9Confident149 Ų14952.8 Ų52.865%0.64827%0.268SS*.Hα-helixtrans-84.9-44.2-179-170.3174.7-179.7-172.30113.7I78 L79 V80I78-K82 PolarHBondContact O-N 2.92Å; I78-K82 VanDerWaalsContact O-N 3.13Å; L79-K82 PolarHBondContact O-N 3.4Å; V80-K82 VanDerWaalsContact C-N 3.29Å; V80-K82 PolarHBondContact O-N 2.97Å
83Y85.8Confident88.3Confident137 Ų13752.7 Ų52.754%0.53727%0.267SS..Hα-helixtrans-112.9-6.6-170.4-59.2-66.1000113.9L79 P87L79-Y83 HydrophobicContact CD2-CD2 3.92Å; L79-Y83 HydrophobicContact CD2-CE2 3.82Å; L79-Y83 PolarHBondContact O-N 3.26Å; Y83-P87 WeakPolarHBondContact O-CG 3.49Å
84G86.1Confident88.8Confident26 Ų2657.8 Ų57.827%0.26829%0.287SS..  trans84.8162.2-175.800000113.4V80 V88V80-G84 CarbonylContact O-C 3.59Å; V80-G84 WeakPolarHBondContact O-CA 3.44Å; V80-G84 PolarHBondContact O-N 2.96Å; G84-V88 VanDerWaalsContact O-CG2 3.26Å; G84-V88 WeakPolarHBondContact O-CG2 3.5Å
85S87.9Confident89.5Confident6 Ų657 Ų574%0.04228%0.281CS..Hα-helixtrans-68.9-38.7-173.6-51.10000114.2V80 V88 M89 M134V80-S85 WeakPolarHBondContact CG1-OG 3.3Å; S85-V88 PolarHBondContact O-N 3.22Å; S85-M89 WeakPolarHBondContact O-CG 3.36Å; S85-M89 PolarHBondContact O-N 3.08Å; S85-M89 VanDerWaalsContact O-N 3.07Å; S85-M134 VanDerWaalsContact CB-SD 3.6Å; S85-M134 PolarHBondContact OG-SD 3.03Å
86R93.1Very high89.9Confident112 Ų11252.9 Ų52.942%0.42326%0.259SS..Hα-helixtrans-64.9-51.5-174.3172.9174.5177.3-179.23.1113.2V88 M89 M90 M195R86-V88 VanDerWaalsContact C-N 3.29Å; R86-V88 PolarHBondContact O-N 3.3Å; R86-M89 PolarHBondContact O-N 3.44Å; R86-M90 HydrophobicContact CG-SD 4.01Å; R86-M90 WeakPolarHBondContact O-CG 3.49Å; R86-M90 PolarHBondContact O-N 2.89Å; R86-M195 HydrophobicContact CB-CB 4.47Å
87P94.1Very high90.3Very high71 Ų7152.9 Ų52.946%0.46126%0.259SS..Hα-helixtrans-61.9-37.6177.9-24.736.5000112.8Y83 M90 F91Y83-P87 WeakPolarHBondContact O-CG 3.49Å; P87-M90 PolarHBondContact O-N 2.74Å; P87-F91 WeakPolarHBondContact O-CB 3.37Å; P87-F91 PolarHBondContact O-N 2.92Å
88V94.4Very high91.1Very high7 Ų752.9 Ų52.94%0.04226%0.257CS..Hα-helixtrans-64.1-44.7179.3176.40000111.4L79 V80 G84 S85 R86 F91 G92 F126 P130L79-V88 HydrophobicContact CB-CG1 4.37Å; L79-V88 HydrophobicContact CB-CG2 3.83Å; V80-V88 HydrophobicContact CG2-CB 4.14Å; V80-V88 HydrophobicContact CG2-CG1 4.07Å; V80-V88 HydrophobicContact CG2-CG2 4.18Å; G84-V88 VanDerWaalsContact O-CG2 3.26Å; G84-V88 WeakPolarHBondContact O-CG2 3.5Å; S85-V88 PolarHBondContact O-N 3.22Å; R86-V88 VanDerWaalsContact C-N 3.29Å; R86-V88 PolarHBondContact O-N 3.3Å; V88-F91 PolarHBondContact O-N 3.05Å; V88-G92 PolarHBondContact O-N 3.33Å; V88-F126 HydrophobicContact CG1-CB 4.01Å; V88-F126 HydrophobicContact CG1-CG 4.23Å; V88-P130 HydrophobicContact CG1-CG 4.03Å
89M94.9Very high91.8Very high0 Ų048.8 Ų48.80%024%0.237CC..Hα-helixtrans-66.9-41.8177-70.4-173.164.200112.6S29 S85 R86 F91 G92 G93 F126 N127 P130 A131 M195S29-M89 WeakPolarHBondContact OG-CE 3.45Å; S85-M89 WeakPolarHBondContact O-CG 3.36Å; S85-M89 PolarHBondContact O-N 3.08Å; S85-M89 VanDerWaalsContact O-N 3.07Å; R86-M89 PolarHBondContact O-N 3.44Å; M89-F91 VanDerWaalsContact C-N 3.34Å; M89-F91 PolarHBondContact O-N 3.19Å; M89-G92 PolarHBondContact O-N 3.28Å; M89-G93 PolarHBondContact O-N 3.29Å; M89-F126 WeakPolarHBondContact CG-O 3.3Å; M89-N127 PolarHBondContact O-OD1 3.48Å; M89-P130 HydrophobicContact CG-CB 3.65Å; M89-P130 HydrophobicContact CG-CG 3.81Å; M89-P130 HydrophobicContact SD-CB 3.86Å; M89-A131 HydrophobicContact CE-CB 4.04Å; M89-A131 HydrophobicContact SD-CB 4.34Å; M89-M195 HydrophobicContact CE-CE 3.86Å; M89-M195 HydrophobicContact CE-CG 4.25Å; M89-M195 HydrophobicContact SD-CB 4.49Å; M89-M195 HydrophobicContact SD-CE 4.05Å; M89-M195 HydrophobicContact SD-CG 3.58Å; M89-M195 VanDerWaalsContact SD-CG 3.58Å; M89-M195 HydrophobicContact SD-SD 4.33Å
90M96.1Very high92.4Very high74 Ų7446.5 Ų46.537%0.36523%0.225SC..Hα-helixtrans-62.2-42.9176.2-69.3179.568.600111.6R86 P87 G92 G93 F94 C189R86-M90 HydrophobicContact CG-SD 4.01Å; R86-M90 WeakPolarHBondContact O-CG 3.49Å; R86-M90 PolarHBondContact O-N 2.89Å; P87-M90 PolarHBondContact O-N 2.74Å; M90-G92 VanDerWaalsContact C-N 3.34Å; M90-G93 PolarHBondContact O-N 3.34Å; M90-F94 PolarHBondContact O-N 2.95Å; M90-F94 VanDerWaalsContact O-N 3.08Å; M90-C189 PolarHBondContact O-SG 3.15Å
91F96.4Very high93.1Very high111 Ų11148.3 Ų48.349%0.48724%0.235SC..Hα-helixtrans-63.9-40.5173.6-178.6-107.3000111.9P87 V88 M89 F94 L95 F126P87-F91 WeakPolarHBondContact O-CB 3.37Å; P87-F91 PolarHBondContact O-N 2.92Å; V88-F91 PolarHBondContact O-N 3.05Å; M89-F91 VanDerWaalsContact C-N 3.34Å; M89-F91 PolarHBondContact O-N 3.19Å; F91-F94 PolarHBondContact O-N 2.99Å; F91-L95 HydrophobicContact CE1-CD2 4.26Å; F91-L95 VanDerWaalsContact O-CB 3.3Å; F91-L95 WeakPolarHBondContact O-CB 3.25Å; F91-L95 PolarHBondContact O-N 3.34Å; F91-F126 AromaticContact CD1-CD2 3.97Å; F91-F126 HydrophobicContact CD1-CD2 3.97Å; F91-F126 HydrophobicContact CD1-CE2 4.14Å; F91-F126 HydrophobicContact CE1-CD2 4.3Å; F91-F126 HydrophobicContact CE1-CE2 4.05Å
92G95.7Very high93.9Very high0 Ų046 Ų460%023%0.229CC..Hα-helixtrans-60.1-45.7176.300000113.2V88 M89 M90 L95 S96 G123V88-G92 PolarHBondContact O-N 3.33Å; M89-G92 PolarHBondContact O-N 3.28Å; M90-G92 VanDerWaalsContact C-N 3.34Å; G92-L95 PolarHBondContact O-N 3.18Å; G92-S96 PolarHBondContact O-N 2.94Å; G92-S96 PolarHBondContact O-OG 3.45Å; G92-G123 CarbonylContact C-O 3.57Å; G92-G123 WeakPolarHBondContact CA-O 3.39Å; G92-G123 CarbonylContact O-C 3.21Å; G92-G123 WeakPolarHBondContact O-CA 3.4Å
93G95.9Very high94.5Very high0 Ų039 Ų390%020%0.198CC..Hα-helixtrans-65.6-38.417700000112.7M89 M90 S96 G97 N127 C189M89-G93 PolarHBondContact O-N 3.29Å; M90-G93 PolarHBondContact O-N 3.34Å; G93-S96 PolarHBondContact O-OG 3.1Å; G93-G97 PolarHBondContact O-N 2.94Å; G93-N127 PolarHBondContact N-ND2 3.07Å; G93-C189 VanDerWaalsContact C-SG 3.51Å
94F97.1Very high95Very high115 Ų11532.7 Ų32.750%0.50417%0.174SC..Hα-helixtrans-64.1-44.6173.3178.3-100.3000111.6M90 F91 G97 T98 L186 C189M90-F94 PolarHBondContact O-N 2.95Å; M90-F94 VanDerWaalsContact O-N 3.08Å; F91-F94 PolarHBondContact O-N 2.99Å; F94-G97 PolarHBondContact O-N 2.86Å; F94-T98 HydrophobicContact CD1-CG2 4.35Å; F94-T98 HydrophobicContact CD2-CG2 4.15Å; F94-T98 HydrophobicContact CE1-CG2 3.96Å; F94-T98 HydrophobicContact CE2-CG2 3.74Å; F94-T98 HydrophobicContact CG-CG2 4.45Å; F94-T98 HydrophobicContact CZ-CG2 3.64Å; F94-T98 WeakPolarHBondContact O-CB 3.29Å; F94-T98 WeakPolarHBondContact O-CG2 3.47Å; F94-T98 PolarHBondContact O-N 3.34Å; F94-T98 PolarHBondContact O-OG1 2.83Å; F94-L186 HydrophobicContact CD2-CD2 4.31Å; F94-C189 PolarHBondContact N-SG 3.32Å
95L96.8Very high95.4Very high30 Ų3038.3 Ų38.316%0.15719%0.191CC..Hα-helixtrans-65-42.9179.9-173.665.2000112.1F91 G92 T98 G99 M119 L122 F126F91-L95 HydrophobicContact CE1-CD2 4.26Å; F91-L95 VanDerWaalsContact O-CB 3.3Å; F91-L95 WeakPolarHBondContact O-CB 3.25Å; F91-L95 PolarHBondContact O-N 3.34Å; G92-L95 PolarHBondContact O-N 3.18Å; L95-T98 WeakPolarHBondContact CA-OG1 3.26Å; L95-T98 PolarHBondContact O-OG1 3.41Å; L95-T98 VanDerWaalsContact O-OG1 3.1Å; L95-G99 PolarHBondContact O-N 3.17Å; L95-M119 HydrophobicContact CD1-CE 3.97Å; L95-L122 HydrophobicContact CD2-CB 3.97Å; L95-F126 HydrophobicContact CD2-CE2 4.42Å
96S96.1Very high95.7Very high0 Ų038.7 Ų38.70%019%0.194CC..Hα-helixtrans-69.8-42.2176.759.70000112.2G92 G93 G99 F100G92-S96 PolarHBondContact O-N 2.94Å; G92-S96 PolarHBondContact O-OG 3.45Å; G93-S96 PolarHBondContact O-OG 3.1Å; S96-G99 PolarHBondContact O-N 3.42Å; S96-F100 WeakPolarHBondContact O-CD2 3.41Å; S96-F100 PolarHBondContact O-N 3.45Å; S96-F100 VanDerWaalsContact O-N 3.09Å
97G96.3Very high95.6Very high0 Ų039.2 Ų39.20%021%0.205CC..Hα-helixtrans-60.1-50.2175.800000112.3G93 F94 G99 F100 V101 G182G93-G97 PolarHBondContact O-N 2.94Å; F94-G97 PolarHBondContact O-N 2.86Å; G97-G99 VanDerWaalsContact C-N 3.33Å; G97-G99 PolarHBondContact O-N 3.46Å; G97-F100 PolarHBondContact O-N 3.46Å; G97-V101 VanDerWaalsContact O-CG2 3.3Å; G97-V101 WeakPolarHBondContact O-CG2 3.42Å; G97-V101 PolarHBondContact O-N 3.23Å; G97-G182 WeakPolarHBondContact CA-O 3.45Å
98T96.6Very high95.4Very high43 Ų4338.3 Ų38.326%0.26420%0.201SC..Hα-helixtrans-63.4-36.3176.650.90000112.6F94 L95 F100 V101 A102F94-T98 HydrophobicContact CD1-CG2 4.35Å; F94-T98 HydrophobicContact CD2-CG2 4.15Å; F94-T98 HydrophobicContact CE1-CG2 3.96Å; F94-T98 HydrophobicContact CE2-CG2 3.74Å; F94-T98 HydrophobicContact CG-CG2 4.45Å; F94-T98 HydrophobicContact CZ-CG2 3.64Å; F94-T98 WeakPolarHBondContact O-CB 3.29Å; F94-T98 WeakPolarHBondContact O-CG2 3.47Å; F94-T98 PolarHBondContact O-N 3.34Å; F94-T98 PolarHBondContact O-OG1 2.83Å; L95-T98 WeakPolarHBondContact CA-OG1 3.26Å; L95-T98 PolarHBondContact O-OG1 3.41Å; L95-T98 VanDerWaalsContact O-OG1 3.1Å; T98-F100 PolarHBondContact O-N 3.43Å; T98-V101 PolarHBondContact O-N 3.09Å; T98-A102 VanDerWaalsContact O-CB 3.27Å; T98-A102 WeakPolarHBondContact O-CB 3.46Å; T98-A102 PolarHBondContact O-N 3.32Å
99G96.8Very high95.3Very high0 Ų038.7 Ų38.70%020%0.203CC..Hα-helixtrans-58.6-45.417300000112.8L95 S96 G97 A102 A103 C115L95-G99 PolarHBondContact O-N 3.17Å; S96-G99 PolarHBondContact O-N 3.42Å; G97-G99 VanDerWaalsContact C-N 3.33Å; G97-G99 PolarHBondContact O-N 3.46Å; G99-A102 PolarHBondContact O-N 2.99Å; G99-A103 WeakPolarHBondContact O-CB 3.28Å; G99-A103 PolarHBondContact O-N 3.32Å; G99-C115 WeakPolarHBondContact O-CB 3.41Å
100F96.5Very high95.2Very high0 Ų045.9 Ų45.90%024%0.236CC..Hα-helixtrans-71.4-37.7177.4-90.5-103.8000113.3T36 I40 M65 S96 G97 T98 A103 S104 V116 F178 L181 L185T36-F100 HydrophobicContact CG2-CE1 4.3Å; T36-F100 HydrophobicContact CG2-CE2 4.08Å; T36-F100 HydrophobicContact CG2-CZ 3.52Å; I40-F100 HydrophobicContact CG2-CE1 3.86Å; I40-F100 HydrophobicContact CG2-CZ 4.11Å; M65-F100 HydrophobicContact SD-CE2 4.21Å; M65-F100 HydrophobicContact SD-CZ 4.34Å; S96-F100 WeakPolarHBondContact O-CD2 3.41Å; S96-F100 PolarHBondContact O-N 3.45Å; S96-F100 VanDerWaalsContact O-N 3.09Å; G97-F100 PolarHBondContact O-N 3.46Å; T98-F100 PolarHBondContact O-N 3.43Å; F100-A103 WeakPolarHBondContact O-CB 3.24Å; F100-A103 PolarHBondContact O-N 2.89Å; F100-S104 PolarHBondContact O-N 2.98Å; F100-V116 HydrophobicContact CE1-CG1 4.38Å; F100-V116 HydrophobicContact CE2-CG1 4Å; F100-V116 HydrophobicContact CZ-CG1 3.74Å; F100-F178 HydrophobicContact CD1-CD1 4.47Å; F100-L181 HydrophobicContact CD1-CB 3.92Å; F100-L181 HydrophobicContact CE1-CB 4.36Å; F100-L181 HydrophobicContact CE1-CD1 4.34Å; F100-L185 HydrophobicContact CB-CD1 4.26Å; F100-L185 HydrophobicContact CD1-CD1 4.27Å; F100-L185 HydrophobicContact CD2-CD1 3.28Å; F100-L185 HydrophobicContact CE1-CD1 4.47Å; F100-L185 HydrophobicContact CE2-CD1 3.54Å; F100-L185 HydrophobicContact CG-CD1 3.67Å; F100-L185 HydrophobicContact CZ-CD1 4.14Å
101V97Very high95.2Very high47 Ų4743.7 Ų43.729%0.28523%0.231SC..Hα-helixtrans-61.5-46.8172.5172.30000110.2G97 T98 A103 S104 F105 L179G97-V101 VanDerWaalsContact O-CG2 3.3Å; G97-V101 WeakPolarHBondContact O-CG2 3.42Å; G97-V101 PolarHBondContact O-N 3.23Å; T98-V101 PolarHBondContact O-N 3.09Å; V101-A103 VanDerWaalsContact C-N 3.31Å; V101-A103 PolarHBondContact O-N 3.31Å; V101-S104 WeakPolarHBondContact O-CB 3.49Å; V101-S104 PolarHBondContact O-N 3.49Å; V101-S104 PolarHBondContact O-OG 3.4Å; V101-F105 HydrophobicContact CG1-CE2 4.27Å; V101-F105 VanDerWaalsContact O-CD2 3.29Å; V101-F105 WeakPolarHBondContact O-CD2 3.25Å; V101-L179 HydrophobicContact CB-CD1 4.33Å; V101-L179 HydrophobicContact CG1-CD1 3.8Å; V101-L179 HydrophobicContact CG2-CD1 4.11Å
102A96.1Very high95.1Very high39 Ų3938.4 Ų38.432%0.32221%0.207SC..Hα-helixtrans-61.4-39.9176.400000111.8T98 G99 S104 F105 C106T98-A102 VanDerWaalsContact O-CB 3.27Å; T98-A102 WeakPolarHBondContact O-CB 3.46Å; T98-A102 PolarHBondContact O-N 3.32Å; G99-A102 PolarHBondContact O-N 2.99Å; A102-S104 PolarHBondContact O-N 2.92Å; A102-F105 PolarHBondContact O-N 3.06Å; A102-C106 PolarHBondContact O-SG 3.17Å
103A95.7Very high95.1Very high0 Ų040.7 Ų40.70%022%0.216CC..Hα-helixtrans-58.1-29.9176.800000113.3G99 F100 V101 F105 C106 L112 C115 V116 F178G99-A103 WeakPolarHBondContact O-CB 3.28Å; G99-A103 PolarHBondContact O-N 3.32Å; F100-A103 WeakPolarHBondContact O-CB 3.24Å; F100-A103 PolarHBondContact O-N 2.89Å; V101-A103 VanDerWaalsContact C-N 3.31Å; V101-A103 PolarHBondContact O-N 3.31Å; A103-F105 PolarHBondContact O-N 2.73Å; A103-C106 WeakPolarHBondContact O-CB 3.36Å; A103-C106 PolarHBondContact O-N 3.35Å; A103-L112 HydrophobicContact CB-CD2 3.87Å; A103-C115 HydrophobicContact CB-CB 3.97Å; A103-V116 HydrophobicContact CB-CG2 3.47Å; A103-V116 VanDerWaalsContact CB-CG2 3.47Å; A103-F178 HydrophobicContact CB-CD2 3.88Å; A103-F178 HydrophobicContact CB-CE2 4.5Å
104S95.6Very high95.1Very high6 Ų646.3 Ų46.34%0.04224%0.241CC..THydrogen-bonded Turntrans-64.6-22.317775.20000113.7F100 V101 A102 R175F100-S104 PolarHBondContact O-N 2.98Å; V101-S104 WeakPolarHBondContact O-CB 3.49Å; V101-S104 PolarHBondContact O-N 3.49Å; V101-S104 PolarHBondContact O-OG 3.4Å; A102-S104 PolarHBondContact O-N 2.92Å; S104-R175 WeakPolarHBondContact CB-O 3.38Å; S104-R175 WeakPolarHBondContact O-CB 3.24Å; S104-R175 WeakPolarHBondContact O-CD 3.48Å; S104-R175 WeakPolarHBondContact O-CG 3.45Å
105F94.6Very high95.1Very high143 Ų14341.4 Ų41.463%0.62722%0.221SC*.THydrogen-bonded Turntrans-100.3-1.7178.8-58.5-77.4000113.1V101 A102 A103V101-F105 HydrophobicContact CG1-CE2 4.27Å; V101-F105 VanDerWaalsContact O-CD2 3.29Å; V101-F105 WeakPolarHBondContact O-CD2 3.25Å; A102-F105 PolarHBondContact O-N 3.06Å; A103-F105 PolarHBondContact O-N 2.73Å
106C93.1Very high95.1Very high14 Ų1440 Ų4010%0.09521%0.213CC..  trans-71.1141.8-178.4-68.20000112.2A102 A103 A111 L112 W174A102-C106 PolarHBondContact O-SG 3.17Å; A103-C106 WeakPolarHBondContact O-CB 3.36Å; A103-C106 PolarHBondContact O-N 3.35Å; C106-A111 HydrophobicContact CB-CB 3.92Å; C106-L112 HydrophobicContact CB-CD2 3.87Å; C106-L112 HydrophobicContact CB-CG 4.29Å; C106-W174 WeakPolarHBondContact O-CH2 3.45Å
107N91Very high95Very high123 Ų12340 Ų4066%0.65821%0.213SC*.  trans-118.310.3176.5-63.8-39.7000112.8F51 R175F51-N107 WeakPolarHBondContact CE1-O 3.44Å; N107-R175 PolarHBondContact OD1-NH2 3.11Å
108S91.9Very high95Very high53 Ų5342.3 Ų42.337%0.37123%0.227SC..SBendtrans-139.4150.1174.770.20000111E110 A111 L112S108-E110 VanDerWaalsContact C-N 3.29Å; S108-E110 PolarHBondContact O-N 3.33Å; S108-A111 PolarHBondContact O-N 2.85Å; S108-A111 VanDerWaalsContact OG-CB 3.31Å; S108-A111 WeakPolarHBondContact OG-CB 3.36Å; S108-A111 PolarHBondContact OG-N 3.43Å; S108-L112 PolarHBondContact O-N 3.46Å
109V91.4Very high95Very high14 Ų1442.1 Ų42.19%0.08522%0.224CC..Hα-helixtrans-68.7-31.5178.8-1760000111.2F51 V53 I61 A111 L112 Y113F51-V109 HydrophobicContact CB-CG2 3.66Å; F51-V109 HydrophobicContact CD1-CG2 4.21Å; F51-V109 HydrophobicContact CD2-CG2 4.06Å; F51-V109 HydrophobicContact CG-CG2 3.71Å; V53-V109 HydrophobicContact CG1-CG2 3.88Å; V53-V109 HydrophobicContact CG2-CG2 4.07Å; I61-V109 HydrophobicContact CD1-CG1 4.49Å; V109-A111 VanDerWaalsContact C-N 3.33Å; V109-A111 PolarHBondContact O-N 2.97Å; V109-L112 WeakPolarHBondContact O-CA 3.3Å; V109-L112 WeakPolarHBondContact O-CB 3.43Å; V109-L112 PolarHBondContact O-N 3.32Å; V109-L112 VanDerWaalsContact O-N 3.09Å; V109-Y113 HydrophobicContact CG1-CD1 4.35Å; V109-Y113 HydrophobicContact CG1-CE1 3.57Å; V109-Y113 HydrophobicContact CG1-CE2 4.44Å; V109-Y113 WeakPolarHBondContact O-CD1 3.35Å; V109-Y113 PolarHBondContact O-N 3.29Å
110E93.3Very high95Very high151 Ų15142.1 Ų42.171%0.70622%0.224SC*.Hα-helixtrans-62.9-39.9174-62.4179.3178.600112.1S108 L112 Y113 F114S108-E110 VanDerWaalsContact C-N 3.29Å; S108-E110 PolarHBondContact O-N 3.33Å; E110-L112 VanDerWaalsContact C-N 3.27Å; E110-L112 PolarHBondContact O-N 3.43Å; E110-Y113 WeakPolarHBondContact O-CB 3.48Å; E110-Y113 PolarHBondContact O-N 3.39Å; E110-F114 PolarHBondContact O-N 3.25Å
111A94.9Very high94.9Very high29 Ų2942.1 Ų42.124%0.2422%0.224CC..Hα-helixtrans-65.1-33173.800000111.6C106 S108 V109 F114 C115C106-A111 HydrophobicContact CB-CB 3.92Å; S108-A111 PolarHBondContact O-N 2.85Å; S108-A111 VanDerWaalsContact OG-CB 3.31Å; S108-A111 WeakPolarHBondContact OG-CB 3.36Å; S108-A111 PolarHBondContact OG-N 3.43Å; V109-A111 VanDerWaalsContact C-N 3.33Å; V109-A111 PolarHBondContact O-N 2.97Å; A111-F114 PolarHBondContact O-N 2.85Å; A111-C115 WeakPolarHBondContact O-CB 3.36Å; A111-C115 PolarHBondContact O-N 2.89Å; A111-C115 PolarHBondContact O-SG 3.01Å
112L94.9Very high94.9Very high0 Ų042.1 Ų42.10%022%0.222CC..Hα-helixtrans-68.1-36.6172.7-64.6177.2000112.5F51 I61 A103 C106 S108 V109 E110 F114 V116 G117 W174 F178F51-L112 HydrophobicContact CE2-CD1 4.16Å; I61-L112 HydrophobicContact CD1-CB 4.11Å; I61-L112 HydrophobicContact CD1-CD1 4.19Å; I61-L112 HydrophobicContact CG1-CB 4.43Å; A103-L112 HydrophobicContact CB-CD2 3.87Å; C106-L112 HydrophobicContact CB-CD2 3.87Å; C106-L112 HydrophobicContact CB-CG 4.29Å; S108-L112 PolarHBondContact O-N 3.46Å; V109-L112 WeakPolarHBondContact O-CA 3.3Å; V109-L112 WeakPolarHBondContact O-CB 3.43Å; V109-L112 PolarHBondContact O-N 3.32Å; V109-L112 VanDerWaalsContact O-N 3.09Å; E110-L112 VanDerWaalsContact C-N 3.27Å; E110-L112 PolarHBondContact O-N 3.43Å; L112-F114 VanDerWaalsContact C-N 3.26Å; L112-F114 PolarHBondContact O-N 2.93Å; L112-V116 HydrophobicContact CD2-CG2 4.47Å; L112-V116 WeakPolarHBondContact O-CB 3.19Å; L112-V116 PolarHBondContact O-N 3.05Å; L112-G117 PolarHBondContact O-N 2.91Å; L112-W174 HydrophobicContact CD2-CZ3 4.12Å; L112-F178 HydrophobicContact CD2-CE2 4.15Å
113Y95.8Very high94.9Very high47 Ų4740.2 Ų40.218%0.18421%0.207CC..Iπ-helixtrans-58.6-41.4172.7-60.6-24.5000111.6Q57 W60 I61 I64 V109 E110 G117 V118Q57-Y113 WeakPolarHBondContact O-CE1 3.12Å; Q57-Y113 PolarHBondContact O-OH 3.47Å; W60-Y113 HydrophobicContact CB-CD1 4.07Å; W60-Y113 HydrophobicContact CB-CE1 3.5Å; W60-Y113 HydrophobicContact CB-CE2 4.49Å; I61-Y113 HydrophobicContact CB-CD1 4.48Å; I61-Y113 HydrophobicContact CG1-CD1 3.64Å; I61-Y113 HydrophobicContact CG1-CE1 3.7Å; I64-Y113 HydrophobicContact CD1-CD1 4.14Å; I64-Y113 HydrophobicContact CD1-CD2 4.43Å; I64-Y113 HydrophobicContact CD1-CG 3.88Å; V109-Y113 HydrophobicContact CG1-CD1 4.35Å; V109-Y113 HydrophobicContact CG1-CE1 3.57Å; V109-Y113 HydrophobicContact CG1-CE2 4.44Å; V109-Y113 WeakPolarHBondContact O-CD1 3.35Å; V109-Y113 PolarHBondContact O-N 3.29Å; E110-Y113 WeakPolarHBondContact O-CB 3.48Å; E110-Y113 PolarHBondContact O-N 3.39Å; Y113-G117 CarbonylContact O-C 3.53Å; Y113-G117 WeakPolarHBondContact O-CA 3.4Å; Y113-G117 PolarHBondContact O-N 3.08Å; Y113-G117 VanDerWaalsContact O-N 3.1Å; Y113-V118 PolarHBondContact O-N 3.24Å
114F96.7Very high94.9Very high118 Ų11840.2 Ų40.252%0.51821%0.207SC..Iπ-helixtrans-72.8-52.1178.6-175.3-100.1000112.2E110 A111 L112 V118 M119E110-F114 PolarHBondContact O-N 3.25Å; A111-F114 PolarHBondContact O-N 2.85Å; L112-F114 VanDerWaalsContact C-N 3.26Å; L112-F114 PolarHBondContact O-N 2.93Å; F114-V118 HydrophobicContact CD2-CB 4.33Å; F114-V118 WeakPolarHBondContact O-CB 3.38Å; F114-V118 PolarHBondContact O-N 3.16Å; F114-V118 VanDerWaalsContact O-N 3.14Å; F114-M119 HydrophobicContact CD1-CG 4.42Å; F114-M119 HydrophobicContact CD1-SD 4.16Å; F114-M119 HydrophobicContact CE1-CG 4Å; F114-M119 HydrophobicContact CE1-SD 3.68Å; F114-M119 HydrophobicContact CZ-CG 4.33Å; F114-M119 HydrophobicContact CZ-SD 4.45Å; F114-M119 PolarHBondContact O-N 3.14Å
115C96.8Very high94.8Very high13 Ų1340 Ų409%0.08821%0.205CC..Iπ-helixtrans-71.1-50.2-173.1-62.80000112.5G99 A103 A111 M119 G120G99-C115 WeakPolarHBondContact O-CB 3.41Å; A103-C115 HydrophobicContact CB-CB 3.97Å; A111-C115 WeakPolarHBondContact O-CB 3.36Å; A111-C115 PolarHBondContact O-N 2.89Å; A111-C115 PolarHBondContact O-SG 3.01Å; C115-M119 WeakPolarHBondContact O-CB 3.38Å; C115-G120 PolarHBondContact O-N 3.32Å; C115-G120 VanDerWaalsContact O-N 3.14Å
116V95.6Very high94.8Very high0 Ų033.8 Ų33.80%018%0.178CC..Iπ-helixtrans-83.6-46.7-179.7179.90000110.5I40 I61 M65 F100 A103 L112 G120 F178I40-V116 HydrophobicContact CD1-CG1 3.77Å; I61-V116 HydrophobicContact CG2-CB 3.95Å; I61-V116 HydrophobicContact CG2-CG1 3.75Å; M65-V116 HydrophobicContact SD-CG1 3.91Å; F100-V116 HydrophobicContact CE1-CG1 4.38Å; F100-V116 HydrophobicContact CE2-CG1 4Å; F100-V116 HydrophobicContact CZ-CG1 3.74Å; A103-V116 HydrophobicContact CB-CG2 3.47Å; A103-V116 VanDerWaalsContact CB-CG2 3.47Å; L112-V116 HydrophobicContact CD2-CG2 4.47Å; L112-V116 WeakPolarHBondContact O-CB 3.19Å; L112-V116 PolarHBondContact O-N 3.05Å; V116-G120 VanDerWaalsContact O-CA 3.28Å; V116-G120 WeakPolarHBondContact O-CA 3.27Å; V116-G120 PolarHBondContact O-N 2.95Å; V116-F178 HydrophobicContact CG2-CE2 4.33Å
117G95.1Very high94.8Very high0 Ų033.1 Ų33.10%017%0.173CC..Iπ-helixtrans-68.7-64.4-176.900000112.9M65 L112 Y113 G121M65-G117 WeakPolarHBondContact CA-O 3.22Å; L112-G117 PolarHBondContact O-N 2.91Å; Y113-G117 CarbonylContact O-C 3.53Å; Y113-G117 WeakPolarHBondContact O-CA 3.4Å; Y113-G117 PolarHBondContact O-N 3.08Å; Y113-G117 VanDerWaalsContact O-N 3.1Å; G117-G121 WeakPolarHBondContact O-CA 3.43Å; G117-G121 PolarHBondContact O-N 3.22Å
118V96.3Very high94.8Very high48 Ų4827.6 Ų27.629%0.29114%0.144SC..Iπ-helixtrans-77.7-57.1-172.4-178.50000112.1I64 Y113 F114 G121 L122I64-V118 HydrophobicContact CG2-CG2 3.94Å; Y113-V118 PolarHBondContact O-N 3.24Å; F114-V118 HydrophobicContact CD2-CB 4.33Å; F114-V118 WeakPolarHBondContact O-CB 3.38Å; F114-V118 PolarHBondContact O-N 3.16Å; F114-V118 VanDerWaalsContact O-N 3.14Å; V118-G121 PolarHBondContact O-N 3.29Å; V118-L122 HydrophobicContact CG1-CD1 4.2Å; V118-L122 WeakPolarHBondContact O-CB 3.27Å; V118-L122 WeakPolarHBondContact O-CG 3.42Å; V118-L122 PolarHBondContact O-N 3.28Å
119M96.6Very high94.6Very high39 Ų3927.3 Ų27.319%0.19214%0.138CC..Iπ-helixtrans-66-47.5-178.5-65.9178.261.200111.3L95 F114 C115 G123L95-M119 HydrophobicContact CD1-CE 3.97Å; F114-M119 HydrophobicContact CD1-CG 4.42Å; F114-M119 HydrophobicContact CD1-SD 4.16Å; F114-M119 HydrophobicContact CE1-CG 4Å; F114-M119 HydrophobicContact CE1-SD 3.68Å; F114-M119 HydrophobicContact CZ-CG 4.33Å; F114-M119 HydrophobicContact CZ-SD 4.45Å; F114-M119 PolarHBondContact O-N 3.14Å; C115-M119 WeakPolarHBondContact O-CB 3.38Å; M119-G123 PolarHBondContact O-N 3.28Å
120G96Very high94.5Very high0 Ų026.6 Ų26.60%013%0.134CC..Iπ-helixtrans-57-50.6173.800000112.3C115 V116 L122 G123 L124C115-G120 PolarHBondContact O-N 3.32Å; C115-G120 VanDerWaalsContact O-N 3.14Å; V116-G120 VanDerWaalsContact O-CA 3.28Å; V116-G120 WeakPolarHBondContact O-CA 3.27Å; V116-G120 PolarHBondContact O-N 2.95Å; G120-L122 PolarHBondContact O-N 3.33Å; G120-G123 PolarHBondContact O-N 2.92Å; G120-L124 WeakPolarHBondContact O-CB 3.18Å; G120-L124 VanDerWaalsContact O-CG 3.27Å; G120-L124 WeakPolarHBondContact O-CG 3.28Å; G120-L124 PolarHBondContact O-N 3.46Å
121G95.6Very high94.3Very high0 Ų019.4 Ų19.40%010%0.1CC..Hα-helixtrans-62.3-43.8-179.700000113.8T69 G117 V118 L124 S125T69-G121 WeakPolarHBondContact CA-O 3.47Å; T69-G121 WeakPolarHBondContact OG1-CA 3.38Å; T69-G121 PolarHBondContact OG1-O 3.02Å; G117-G121 WeakPolarHBondContact O-CA 3.43Å; G117-G121 PolarHBondContact O-N 3.22Å; V118-G121 PolarHBondContact O-N 3.29Å; G121-L124 PolarHBondContact O-N 3.21Å; G121-S125 WeakPolarHBondContact O-CB 3.38Å; G121-S125 PolarHBondContact O-N 3.36Å
122L95.6Very high93.9Very high47 Ų4720.7 Ų20.725%0.24610%0.102CC..Hα-helixtrans-63.7-44.5176.4-77.3177.3000110.9V68 L95 V118 G120 L124 S125 F126V68-L122 HydrophobicContact CG1-CB 4.23Å; V68-L122 HydrophobicContact CG1-CD2 3.67Å; V68-L122 HydrophobicContact CG1-CG 3.51Å; L95-L122 HydrophobicContact CD2-CB 3.97Å; V118-L122 HydrophobicContact CG1-CD1 4.2Å; V118-L122 WeakPolarHBondContact O-CB 3.27Å; V118-L122 WeakPolarHBondContact O-CG 3.42Å; V118-L122 PolarHBondContact O-N 3.28Å; G120-L122 PolarHBondContact O-N 3.33Å; L122-L124 VanDerWaalsContact C-N 3.33Å; L122-L124 PolarHBondContact O-N 3.39Å; L122-S125 WeakPolarHBondContact O-CB 3.47Å; L122-S125 PolarHBondContact O-N 3.19Å; L122-F126 WeakPolarHBondContact O-CG 3.28Å; L122-F126 PolarHBondContact O-N 3.3Å
123G95.9Very high93.4Very high0 Ų023.6 Ų23.60%012%0.121CC..Hα-helixtrans-59.1-43.7176.400000112.4G92 M119 G120 F126 N127G92-G123 CarbonylContact C-O 3.57Å; G92-G123 WeakPolarHBondContact CA-O 3.39Å; G92-G123 CarbonylContact O-C 3.21Å; G92-G123 WeakPolarHBondContact O-CA 3.4Å; M119-G123 PolarHBondContact O-N 3.28Å; G120-G123 PolarHBondContact O-N 2.92Å; G123-F126 PolarHBondContact O-N 3.42Å; G123-N127 PolarHBondContact O-N 2.89Å; G123-N127 PolarHBondContact O-ND2 3.47Å
124L95.3Very high92.9Very high0 Ų021.4 Ų21.40%011%0.112CC..Hα-helixtrans-68.3-32.6176-67.9178.4000112.7F32 S33 T36 M65 T69 G120 G121 L122 N127 L128 L185F32-L124 HydrophobicContact CB-CD2 4.42Å; S33-L124 PolarHBondContact OG-O 2.93Å; T36-L124 HydrophobicContact CG2-CD1 4.46Å; M65-L124 HydrophobicContact CE-CD1 4.33Å; M65-L124 HydrophobicContact CG-CD1 4.46Å; M65-L124 HydrophobicContact SD-CD1 4.12Å; T69-L124 HydrophobicContact CG2-CB 4.21Å; G120-L124 WeakPolarHBondContact O-CB 3.18Å; G120-L124 VanDerWaalsContact O-CG 3.27Å; G120-L124 WeakPolarHBondContact O-CG 3.28Å; G120-L124 PolarHBondContact O-N 3.46Å; G121-L124 PolarHBondContact O-N 3.21Å; L122-L124 VanDerWaalsContact C-N 3.33Å; L122-L124 PolarHBondContact O-N 3.39Å; L124-N127 PolarHBondContact O-N 2.95Å; L124-L128 WeakPolarHBondContact O-CB 3.46Å; L124-L128 PolarHBondContact O-N 3.09Å; L124-L185 HydrophobicContact CD2-CD2 3.92Å
125S94.1Very high92.4Very high0 Ų015.8 Ų15.80%09%0.087CC..Hα-helixtrans-66.2-38.3173.5-160.60000112.6T69 G72 G73 S76 G121 L122 N127 L128 N129T69-S125 VanDerWaalsContact O-CB 3.26Å; T69-S125 WeakPolarHBondContact O-CB 3.42Å; T69-S125 PolarHBondContact O-OG 3.01Å; G72-S125 VanDerWaalsContact CA-OG 3.3Å; G72-S125 WeakPolarHBondContact CA-OG 3.41Å; G72-S125 PolarHBondContact O-OG 2.84Å; G73-S125 PolarHBondContact N-OG 2.92Å; S76-S125 PolarHBondContact OG-O 3.45Å; G121-S125 WeakPolarHBondContact O-CB 3.38Å; G121-S125 PolarHBondContact O-N 3.36Å; L122-S125 WeakPolarHBondContact O-CB 3.47Å; L122-S125 PolarHBondContact O-N 3.19Å; S125-N127 PolarHBondContact O-N 3.09Å; S125-L128 PolarHBondContact O-N 3.21Å; S125-N129 PolarHBondContact O-N 3.39Å; S125-N129 PolarHBondContact O-ND2 2.78Å; S125-N129 PolarHBondContact OG-ND2 3.33Å
126F94.6Very high91.6Very high13 Ų1316.3 Ų16.36%0.0579%0.094CC..Hα-helixtrans-71.9-14.9174.8-65.6-10.6000113I75 L79 V88 M89 F91 L95 L122 G123 P130I75-F126 HydrophobicContact CB-CE1 4.34Å; I75-F126 HydrophobicContact CG2-CE1 3.89Å; I75-F126 HydrophobicContact CG2-CZ 3.97Å; L79-F126 HydrophobicContact CD1-CD1 4.47Å; L79-F126 HydrophobicContact CD1-CE1 3.78Å; L79-F126 HydrophobicContact CD1-CE2 4.04Å; L79-F126 HydrophobicContact CD1-CZ 3.54Å; V88-F126 HydrophobicContact CG1-CB 4.01Å; V88-F126 HydrophobicContact CG1-CG 4.23Å; M89-F126 WeakPolarHBondContact CG-O 3.3Å; F91-F126 AromaticContact CD1-CD2 3.97Å; F91-F126 HydrophobicContact CD1-CD2 3.97Å; F91-F126 HydrophobicContact CD1-CE2 4.14Å; F91-F126 HydrophobicContact CE1-CD2 4.3Å; F91-F126 HydrophobicContact CE1-CE2 4.05Å; L95-F126 HydrophobicContact CD2-CE2 4.42Å; L122-F126 WeakPolarHBondContact O-CG 3.28Å; L122-F126 PolarHBondContact O-N 3.3Å; G123-F126 PolarHBondContact O-N 3.42Å; F126-P130 VanDerWaalsContact O-CD 3.23Å; F126-P130 WeakPolarHBondContact O-CD 3.29Å; F126-P130 WeakPolarHBondContact O-CG 3.33Å
127N94.2Very high90.9Very high0 Ų020.4 Ų20.40%011%0.112CC..Hα-helixtrans-90-42.2169.4-80.5-74.8000112.6M89 G93 G123 L124 S125 A131 C188M89-N127 PolarHBondContact O-OD1 3.48Å; G93-N127 PolarHBondContact N-ND2 3.07Å; G123-N127 PolarHBondContact O-N 2.89Å; G123-N127 PolarHBondContact O-ND2 3.47Å; L124-N127 PolarHBondContact O-N 2.95Å; S125-N127 PolarHBondContact O-N 3.09Å; N127-A131 VanDerWaalsContact O-CB 3.31Å; N127-A131 WeakPolarHBondContact O-CB 3.08Å; N127-A131 PolarHBondContact O-N 3.25Å; N127-C188 WeakPolarHBondContact OD1-CB 3.39Å
128L90.9Very high90.5Very high8 Ų820.6 Ų20.64%0.04211%0.113CC..Hα-helixtrans-65.9-56-173.3175.959.1000113.2I30 Y34 T69 L124 S125 A131 L132I30-L128 HydrophobicContact CG1-CD1 3.95Å; I30-L128 HydrophobicContact CG2-CD1 4.48Å; Y34-L128 HydrophobicContact CD2-CD1 4.34Å; Y34-L128 HydrophobicContact CE2-CD1 3.6Å; Y34-L128 HydrophobicContact CE2-CD2 4.18Å; T69-L128 HydrophobicContact CG2-CD2 4.22Å; L124-L128 WeakPolarHBondContact O-CB 3.46Å; L124-L128 PolarHBondContact O-N 3.09Å; S125-L128 PolarHBondContact O-N 3.21Å; L128-A131 PolarHBondContact O-N 3.43Å; L128-L132 HydrophobicContact CD1-CD1 4.26Å; L128-L132 PolarHBondContact O-N 3.29Å
129N87.2Confident89.7Confident46 Ų4618.3 Ų18.325%0.24610%0.099CC..Hα-helixtrans-67.3-43.4-171.8-68.8-78.1000113.8G73 S125 A131 L132 T133G73-N129 WeakPolarHBondContact CA-ND2 3.46Å; S125-N129 PolarHBondContact O-N 3.39Å; S125-N129 PolarHBondContact O-ND2 2.78Å; S125-N129 PolarHBondContact OG-ND2 3.33Å; N129-A131 VanDerWaalsContact C-N 3.31Å; N129-A131 PolarHBondContact O-N 2.99Å; N129-L132 PolarHBondContact O-N 3.01Å; N129-T133 PolarHBondContact O-N 3.01Å; N129-T133 VanDerWaalsContact O-N 3.09Å; N129-T133 PolarHBondContact O-OG1 2.93Å
130P88.6Confident88.8Confident0 Ų021.4 Ų21.40%011%0.112CC..Hα-helixtrans-70.7-30.1-179.8-13.729.6000111.6V80 V88 M89 F126 T133 M134V80-P130 HydrophobicContact CG2-CB 3.64Å; V80-P130 HydrophobicContact CG2-CG 3.44Å; V80-P130 VanDerWaalsContact CG2-CG 3.44Å; V88-P130 HydrophobicContact CG1-CG 4.03Å; M89-P130 HydrophobicContact CG-CB 3.65Å; M89-P130 HydrophobicContact CG-CG 3.81Å; M89-P130 HydrophobicContact SD-CB 3.86Å; F126-P130 VanDerWaalsContact O-CD 3.23Å; F126-P130 WeakPolarHBondContact O-CD 3.29Å; F126-P130 WeakPolarHBondContact O-CG 3.33Å; P130-T133 PolarHBondContact O-N 2.95Å; P130-M134 WeakPolarHBondContact O-CB 3.19Å; P130-M134 VanDerWaalsContact O-CG 3.23Å; P130-M134 WeakPolarHBondContact O-CG 3.3Å; P130-M134 PolarHBondContact O-N 3.25Å
131A90.4Very high87.7Confident0 Ų030.1 Ų30.10%015%0.15CC..Hα-helixtrans-59.6-48.717400000111.8A26 I30 M89 N127 L128 N129 T133 M134 I135 M195A26-A131 HydrophobicContact CB-CB 3.94Å; I30-A131 HydrophobicContact CG1-CB 4.48Å; M89-A131 HydrophobicContact CE-CB 4.04Å; M89-A131 HydrophobicContact SD-CB 4.34Å; N127-A131 VanDerWaalsContact O-CB 3.31Å; N127-A131 WeakPolarHBondContact O-CB 3.08Å; N127-A131 PolarHBondContact O-N 3.25Å; L128-A131 PolarHBondContact O-N 3.43Å; N129-A131 VanDerWaalsContact C-N 3.31Å; N129-A131 PolarHBondContact O-N 2.99Å; A131-T133 VanDerWaalsContact C-N 3.33Å; A131-T133 PolarHBondContact O-N 3.27Å; A131-M134 PolarHBondContact O-N 3.4Å; A131-I135 WeakPolarHBondContact O-CG1 3.4Å; A131-I135 PolarHBondContact O-N 2.77Å; A131-I135 VanDerWaalsContact O-N 3.07Å; A131-M195 HydrophobicContact CB-CE 4.2Å
132L85.8Confident86.8Confident55 Ų5536.5 Ų36.529%0.28817%0.174SC..Hα-helixtrans-62.4-40.1175.8-69.5173.1000112.2I30 L128 N129 G136I30-L132 HydrophobicContact CD1-CD2 3.82Å; I30-L132 HydrophobicContact CD1-CG 4.31Å; L128-L132 HydrophobicContact CD1-CD1 4.26Å; L128-L132 PolarHBondContact O-N 3.29Å; N129-L132 PolarHBondContact O-N 3.01Å; L132-G136 PolarHBondContact O-N 3.31Å
133T84.5Confident85.9Confident62 Ų6239.8 Ų39.838%0.3818%0.183SC..Hα-helixtrans-63.2-42.4177.1-56.90000111.4N129 P130 A131 G136 K137N129-T133 PolarHBondContact O-N 3.01Å; N129-T133 VanDerWaalsContact O-N 3.09Å; N129-T133 PolarHBondContact O-OG1 2.93Å; P130-T133 PolarHBondContact O-N 2.95Å; A131-T133 VanDerWaalsContact C-N 3.33Å; A131-T133 PolarHBondContact O-N 3.27Å; T133-G136 PolarHBondContact O-N 3.24Å; T133-K137 PolarHBondContact O-N 2.86Å; T133-K137 VanDerWaalsContact O-N 3.16Å
134M85.8Confident84.9Confident1 Ų144.4 Ų44.41%0.00521%0.213CC..Hα-helixtrans-68.5-40.2-179.6-73.3-56.2-63.800112.3V22 S85 P130 A131 G136 K137 Y138 M195 R196 I198V22-M134 HydrophobicContact CG1-CB 4.06Å; S85-M134 VanDerWaalsContact CB-SD 3.6Å; S85-M134 PolarHBondContact OG-SD 3.03Å; P130-M134 WeakPolarHBondContact O-CB 3.19Å; P130-M134 VanDerWaalsContact O-CG 3.23Å; P130-M134 WeakPolarHBondContact O-CG 3.3Å; P130-M134 PolarHBondContact O-N 3.25Å; A131-M134 PolarHBondContact O-N 3.4Å; M134-G136 VanDerWaalsContact C-N 3.27Å; M134-G136 PolarHBondContact O-N 3.35Å; M134-K137 PolarHBondContact O-N 2.81Å; M134-K137 VanDerWaalsContact O-N 3.08Å; M134-K137 HydrophobicContact SD-CD 4.23Å; M134-Y138 HydrophobicContact CE-CD2 4.13Å; M134-Y138 HydrophobicContact CE-CE2 3.58Å; M134-Y138 WeakPolarHBondContact O-CD2 3.41Å; M134-Y138 PolarHBondContact O-N 3.43Å; M134-M195 HydrophobicContact CB-SD 3.76Å; M134-M195 HydrophobicContact CE-CB 4.45Å; M134-M195 HydrophobicContact CG-CB 4.22Å; M134-M195 HydrophobicContact CG-CG 4.46Å; M134-M195 HydrophobicContact CG-SD 3.98Å; M134-R196 WeakPolarHBondContact CE-O 3.37Å; M134-I198 HydrophobicContact CE-CG1 4.49Å
135I85.4Confident84.3Confident0 Ų048.5 Ų48.50%024%0.238CC..Hα-helixtrans-56.3-45.7172.3-66.9165.2000110.4A26 A131 K137 Y138 F139 A146 N147 A150A26-I135 HydrophobicContact CB-CD1 3.54Å; A26-I135 HydrophobicContact CB-CG1 4Å; A131-I135 WeakPolarHBondContact O-CG1 3.4Å; A131-I135 PolarHBondContact O-N 2.77Å; A131-I135 VanDerWaalsContact O-N 3.07Å; I135-K137 PolarHBondContact O-N 2.9Å; I135-Y138 PolarHBondContact O-N 3.37Å; I135-Y138 VanDerWaalsContact O-N 3.16Å; I135-F139 HydrophobicContact CG2-CD2 4.37Å; I135-F139 PolarHBondContact O-N 2.96Å; I135-A146 HydrophobicContact CG2-CB 3.63Å; I135-N147 VanDerWaalsContact CG2-OD1 3.32Å; I135-N147 WeakPolarHBondContact CG2-OD1 3.41Å; I135-A150 HydrophobicContact CD1-CB 3.53Å
136G79.4Confident83.8Confident23 Ų2348.5 Ų48.524%0.23724%0.238CC..Hα-helixtrans-64-23.6178.400000114.7L132 T133 M134L132-G136 PolarHBondContact O-N 3.31Å; T133-G136 PolarHBondContact O-N 3.24Å; M134-G136 VanDerWaalsContact C-N 3.27Å; M134-G136 PolarHBondContact O-N 3.35Å
137K82.6Confident83.3Confident86 Ų8650 Ų5037%0.37425%0.246SC..Hα-helixtrans-82.4-32.7173.3-69.9-177178.2-177.30112.7Y11 T133 M134 I135 I198Y11-K137 VanDerWaalsContact CE1-O 3.31Å; Y11-K137 WeakPolarHBondContact CE1-O 3.49Å; T133-K137 PolarHBondContact O-N 2.86Å; T133-K137 VanDerWaalsContact O-N 3.16Å; M134-K137 PolarHBondContact O-N 2.81Å; M134-K137 VanDerWaalsContact O-N 3.08Å; M134-K137 HydrophobicContact SD-CD 4.23Å; I135-K137 PolarHBondContact O-N 2.9Å; K137-I198 VanDerWaalsContact C-CD1 3.49Å; K137-I198 HydrophobicContact CB-CD1 3.66Å; K137-I198 HydrophobicContact CB-CG1 4.21Å; K137-I198 VanDerWaalsContact O-CD1 3.32Å; K137-I198 WeakPolarHBondContact O-CD1 3.36Å
138Y84.9Confident82.7Confident5 Ų552 Ų522%0.0227%0.268CS..Hα-helixtrans-83.4-31.3-178.8-89-89.3000113.4P14 E15 W18 V22 M134 I135 R196 I198P14-Y138 HydrophobicContact CG-CD1 3.72Å; P14-Y138 HydrophobicContact CG-CE1 4.15Å; E15-Y138 PolarHBondContact N-O 2.99Å; W18-Y138 HydrophobicContact CB-CE1 4.29Å; V22-Y138 HydrophobicContact CB-CD2 4.28Å; V22-Y138 HydrophobicContact CG1-CD2 4.03Å; V22-Y138 HydrophobicContact CG2-CD2 3.94Å; V22-Y138 HydrophobicContact CG2-CE1 4.47Å; V22-Y138 HydrophobicContact CG2-CE2 3.68Å; V22-Y138 HydrophobicContact CG2-CG 4.47Å; M134-Y138 HydrophobicContact CE-CD2 4.13Å; M134-Y138 HydrophobicContact CE-CE2 3.58Å; M134-Y138 WeakPolarHBondContact O-CD2 3.41Å; M134-Y138 PolarHBondContact O-N 3.43Å; I135-Y138 PolarHBondContact O-N 3.37Å; I135-Y138 VanDerWaalsContact O-N 3.16Å; Y138-R196 WeakPolarHBondContact CE2-O 3.28Å; Y138-R196 WeakPolarHBondContact OH-CB 3.42Å; Y138-R196 PolarHBondContact OH-O 3.44Å; Y138-I198 HydrophobicContact CD1-CD1 3.98Å; Y138-I198 HydrophobicContact CD2-CD1 3.3Å; Y138-I198 HydrophobicContact CD2-CG1 4.03Å; Y138-I198 HydrophobicContact CE1-CD1 4.03Å; Y138-I198 HydrophobicContact CE1-CG2 4.2Å; Y138-I198 HydrophobicContact CE2-CD1 3.32Å; Y138-I198 HydrophobicContact CE2-CG1 3.54Å; Y138-I198 HydrophobicContact CE2-CG2 4.28Å; Y138-I198 HydrophobicContact CG-CD1 3.63Å; Y138-I198 WeakPolarHBondContact OH-CG2 3.49Å
139F79.9Confident82.6Confident0 Ų055 Ų550%028%0.283CS..  trans-129.9133.1-176.5-60.3-80.9000111.6G19 W20 V23 I135 R142 R143 A146G19-F139 WeakPolarHBondContact O-CE2 3.41Å; W20-F139 HydrophobicContact CD2-CZ 4.11Å; W20-F139 HydrophobicContact CE3-CZ 4.4Å; W20-F139 HydrophobicContact CG-CZ 4.45Å; W20-F139 HydrophobicContact CZ2-CE1 4.39Å; V23-F139 HydrophobicContact CG2-CD2 4.37Å; V23-F139 HydrophobicContact CG2-CE2 3.65Å; V23-F139 HydrophobicContact CG2-CZ 4.36Å; I135-F139 HydrophobicContact CG2-CD2 4.37Å; I135-F139 PolarHBondContact O-N 2.96Å; F139-R142 HydrophobicContact CD1-CB 3.93Å; F139-R143 HydrophobicContact CB-CB 4.28Å; F139-R143 WeakPolarHBondContact O-CB 3.39Å; F139-A146 HydrophobicContact CB-CB 4.43Å; F139-A146 HydrophobicContact CD2-CB 3.67Å; F139-A146 HydrophobicContact CE2-CB 4.05Å; F139-A146 HydrophobicContact CG-CB 4.06Å
140F77.6Confident82.7Confident103 Ų10352.9 Ų52.945%0.45227%0.271SS..SBendtrans-115-55.7171-178.6-102.7000110.1G6 P13 E15 R143G6-F140 WeakPolarHBondContact O-CZ 3.41Å; P13-F140 HydrophobicContact CB-CB 4.35Å; P13-F140 HydrophobicContact CG-CB 3.88Å; E15-F140 VanDerWaalsContact OE1-CA 3.3Å; E15-F140 WeakPolarHBondContact OE1-CA 3.21Å; E15-F140 WeakPolarHBondContact OE1-CB 3.47Å; E15-F140 PolarHBondContact OE1-N 3.43Å; F140-R143 WeakPolarHBondContact O-CB 3.28Å
141K73.9Confident82.6Confident184 Ų18454.9 Ų54.980%0.828%0.281SS*.THydrogen-bonded Turntrans-73.3-43.5179.1-169.8175.5-177.91770112.1E15 R143E15-K141 PolarHBondContact OE1-N 3.45Å; E15-K141 PolarHBondContact OE2-N 2.89Å; K141-R143 VanDerWaalsContact C-N 3.33Å
142R77.3Confident82.4Confident133 Ų13356.3 Ų56.350%0.50229%0.293SS..THydrogen-bonded Turntrans-92.612.6178.8-60.1-179.4179.4-167.4-0.6113.7E15 F139 V145 A146E15-R142 PolarHBondContact OE2-N 3.01Å; E15-R142 VanDerWaalsContact OE2-N 3.08Å; F139-R142 HydrophobicContact CD1-CB 3.93Å; R142-V145 PolarHBondContact O-N 3.48Å; R142-V145 VanDerWaalsContact O-N 3.17Å; R142-A146 PolarHBondContact O-N 3.41Å
143R75.8Confident82.6Confident116 Ų11653.7 Ų53.744%0.43828%0.279SS..Hα-helixtrans-56.1-42.8-177.3-169.7178.5177.2-171.1-0.4113.8F139 F140 K141 V145 A146 N147F139-R143 HydrophobicContact CB-CB 4.28Å; F139-R143 WeakPolarHBondContact O-CB 3.39Å; F140-R143 WeakPolarHBondContact O-CB 3.28Å; K141-R143 VanDerWaalsContact C-N 3.33Å; R143-V145 VanDerWaalsContact C-N 3.33Å; R143-V145 PolarHBondContact O-N 3.17Å; R143-A146 PolarHBondContact O-N 3.5Å; R143-N147 WeakPolarHBondContact O-CB 3.21Å; R143-N147 PolarHBondContact O-N 3.09Å
144P74.8Confident82.8Confident98 Ų9850.9 Ų50.964%0.63626%0.262SS*.Hα-helixtrans-62.3-40177.8-23.735.5000112.6G148P144-G148 PolarHBondContact O-N 2.93Å
145V82.3Confident83Confident85 Ų8550.9 Ų50.952%0.51526%0.262SS..Hα-helixtrans-66.5-46.6177.5-179.80000110.7R142 R143 G148 I149R142-V145 PolarHBondContact O-N 3.48Å; R142-V145 VanDerWaalsContact O-N 3.17Å; R143-V145 VanDerWaalsContact C-N 3.33Å; R143-V145 PolarHBondContact O-N 3.17Å; V145-G148 PolarHBondContact O-N 3.34Å; V145-I149 HydrophobicContact CG1-CD1 4.04Å; V145-I149 WeakPolarHBondContact O-CG1 3.27Å; V145-I149 PolarHBondContact O-N 2.83Å
146A83.6Confident83.3Confident0 Ų053 Ų530%028%0.275CS..Hα-helixtrans-61.9-44.9178.700000112.4V23 I135 F139 R142 R143 A150V23-A146 HydrophobicContact CG2-CB 3.76Å; I135-A146 HydrophobicContact CG2-CB 3.63Å; F139-A146 HydrophobicContact CB-CB 4.43Å; F139-A146 HydrophobicContact CD2-CB 3.67Å; F139-A146 HydrophobicContact CE2-CB 4.05Å; F139-A146 HydrophobicContact CG-CB 4.06Å; R142-A146 PolarHBondContact O-N 3.41Å; R143-A146 PolarHBondContact O-N 3.5Å; A146-A150 WeakPolarHBondContact O-CB 3.21Å; A146-A150 PolarHBondContact O-N 2.9Å
147N84.4Confident84.1Confident45 Ų4553.6 Ų53.624%0.24127%0.271CS..Hα-helixtrans-63.4-42.5173.3-82-15000111.7I135 R143 I149 A150 M151I135-N147 VanDerWaalsContact CG2-OD1 3.32Å; I135-N147 WeakPolarHBondContact CG2-OD1 3.41Å; R143-N147 WeakPolarHBondContact O-CB 3.21Å; R143-N147 PolarHBondContact O-N 3.09Å; N147-I149 PolarHBondContact O-N 3.36Å; N147-A150 PolarHBondContact O-N 3.43Å; N147-M151 VanDerWaalsContact O-CB 3.28Å; N147-M151 WeakPolarHBondContact O-CB 3.5Å; N147-M151 WeakPolarHBondContact O-CG 3.12Å; N147-M151 PolarHBondContact O-N 2.84Å
148G82.1Confident84.5Confident43 Ų4349.7 Ų49.744%0.44325%0.254SS..Hα-helixtrans-58.3-47.4178.200000112.2P144 V145 M151 A152P144-G148 PolarHBondContact O-N 2.93Å; V145-G148 PolarHBondContact O-N 3.34Å; G148-M151 PolarHBondContact O-N 3.02Å; G148-A152 PolarHBondContact O-N 3.21Å
149I89.1Confident84.8Confident71 Ų7150.9 Ų50.936%0.36426%0.264SS..Hα-helixtrans-61-51.8175.3-67.3164000110W20 V23 F27 V145 N147 M151 A152W20-I149 HydrophobicContact CH2-CD1 4.49Å; W20-I149 HydrophobicContact CZ3-CD1 3.8Å; V23-I149 HydrophobicContact CG1-CB 3.98Å; V23-I149 HydrophobicContact CG1-CG2 3.6Å; F27-I149 HydrophobicContact CD2-CG2 4.32Å; F27-I149 WeakPolarHBondContact CD2-O 3.1Å; V145-I149 HydrophobicContact CG1-CD1 4.04Å; V145-I149 WeakPolarHBondContact O-CG1 3.27Å; V145-I149 PolarHBondContact O-N 2.83Å; N147-I149 PolarHBondContact O-N 3.36Å; I149-M151 VanDerWaalsContact C-N 3.3Å; I149-M151 PolarHBondContact O-N 2.93Å; I149-A152 WeakPolarHBondContact O-CB 3.09Å; I149-A152 PolarHBondContact O-N 3.14Å; I149-A152 VanDerWaalsContact O-N 3.09Å
150A89.2Confident85.4Confident0 Ų054.8 Ų54.80%029%0.287CS..Hα-helixtrans-61-38.6-177.400000112.7A26 I30 I135 A146 N147 G153A26-A150 HydrophobicContact CB-CB 3.96Å; I30-A150 HydrophobicContact CD1-CB 3.82Å; I135-A150 HydrophobicContact CD1-CB 3.53Å; A146-A150 WeakPolarHBondContact O-CB 3.21Å; A146-A150 PolarHBondContact O-N 2.9Å; N147-A150 PolarHBondContact O-N 3.43Å; A150-G153 PolarHBondContact O-N 2.9Å
151M86.4Confident86.1Confident42 Ų4250.2 Ų50.221%0.20727%0.268CS..Hα-helixtrans-71.7-26.1176.6-70.2-66.2-69.200113.4I30 Y34 N147 G148 I149 G153 S154I30-M151 HydrophobicContact CD1-SD 4.33Å; I30-M151 HydrophobicContact CG2-SD 3.99Å; Y34-M151 HydrophobicContact CE2-CE 4.47Å; N147-M151 VanDerWaalsContact O-CB 3.28Å; N147-M151 WeakPolarHBondContact O-CB 3.5Å; N147-M151 WeakPolarHBondContact O-CG 3.12Å; N147-M151 PolarHBondContact O-N 2.84Å; G148-M151 PolarHBondContact O-N 3.02Å; I149-M151 VanDerWaalsContact C-N 3.3Å; I149-M151 PolarHBondContact O-N 2.93Å; M151-G153 PolarHBondContact O-N 3.14Å; M151-S154 PolarHBondContact O-N 2.93Å
152A86.4Confident86.9Confident30 Ų3041.5 Ų41.525%0.24823%0.23CC..Hα-helixtrans-67.4-15.4171.600000112.5F27 G148 I149 S154 P155 V156F27-A152 HydrophobicContact CE2-CB 4.47Å; G148-A152 PolarHBondContact O-N 3.21Å; I149-A152 WeakPolarHBondContact O-CB 3.09Å; I149-A152 PolarHBondContact O-N 3.14Å; I149-A152 VanDerWaalsContact O-N 3.09Å; A152-S154 VanDerWaalsContact C-N 3.27Å; A152-S154 PolarHBondContact O-N 3.48Å; A152-P155 WeakPolarHBondContact O-CD 3.41Å; A152-P155 VanDerWaalsContact O-CG 3.28Å; A152-P155 WeakPolarHBondContact O-CG 3.2Å; A152-V156 WeakPolarHBondContact O-CG2 3.34Å; A152-V156 PolarHBondContact O-N 2.97Å
153G88.8Confident87.6Confident0 Ų037.4 Ų37.40%022%0.22CC..Hα-helixtrans-59.3-36171.500000113.2F27 A150 M151 V156 F157F27-G153 VanDerWaalsContact CE2-N 3.29Å; F27-G153 VanDerWaalsContact CZ-CA 3.45Å; A150-G153 PolarHBondContact O-N 2.9Å; M151-G153 PolarHBondContact O-N 3.14Å; G153-V156 PolarHBondContact O-N 3.44Å; G153-F157 WeakPolarHBondContact O-CB 3.38Å; G153-F157 VanDerWaalsContact O-CD2 3.28Å; G153-F157 WeakPolarHBondContact O-CD2 3.35Å; G153-F157 PolarHBondContact O-N 2.72Å
154S90.3Very high88.4Confident3 Ų335 Ų352%0.02122%0.216CC..Hα-helixtrans-57.3-54.3180172.90000113.7Y34 M151 A152 L158Y34-S154 VanDerWaalsContact CB-OG 3.24Å; Y34-S154 WeakPolarHBondContact CB-OG 3.38Å; M151-S154 PolarHBondContact O-N 2.93Å; A152-S154 VanDerWaalsContact C-N 3.27Å; A152-S154 PolarHBondContact O-N 3.48Å; S154-L158 WeakPolarHBondContact O-CB 3.25Å; S154-L158 PolarHBondContact O-N 3.03Å
155P89.4Confident89.2Confident1 Ų130.3 Ų30.31%0.00619%0.186CC..Hα-helixtrans-68.2-35.7178.722.1-32.3000113A152 L158 S159 A275 M279A152-P155 WeakPolarHBondContact O-CD 3.41Å; A152-P155 VanDerWaalsContact O-CG 3.28Å; A152-P155 WeakPolarHBondContact O-CG 3.2Å; P155-L158 PolarHBondContact O-N 2.92Å; P155-S159 PolarHBondContact O-N 3.2Å; P155-S159 PolarHBondContact O-OG 2.84Å; P155-A275 HydrophobicContact CB-CB 4.16Å; P155-A275 WeakPolarHBondContact CB-O 3.49Å; P155-A275 WeakPolarHBondContact O-CB 3.35Å; P155-M279 HydrophobicContact CB-CB 3.97Å; P155-M279 HydrophobicContact CG-CB 3.87Å; P155-M279 HydrophobicContact CG-CG 4.16Å
156V92.1Very high89.6Confident46 Ų4626.8 Ų26.828%0.27916%0.164SC..Hα-helixtrans-63.5-43.7178.1173.70000111.7F27 A152 G153 S159 T160 M279F27-V156 HydrophobicContact CE1-CG1 4.43Å; F27-V156 HydrophobicContact CZ-CB 4Å; F27-V156 HydrophobicContact CZ-CG1 4.14Å; F27-V156 HydrophobicContact CZ-CG2 4.09Å; A152-V156 WeakPolarHBondContact O-CG2 3.34Å; A152-V156 PolarHBondContact O-N 2.97Å; G153-V156 PolarHBondContact O-N 3.44Å; V156-S159 PolarHBondContact O-OG 3.31Å; V156-T160 WeakPolarHBondContact O-CG2 3.42Å; V156-T160 PolarHBondContact O-N 2.66Å; V156-T160 PolarHBondContact O-OG1 3.49Å; V156-M279 HydrophobicContact CG2-SD 3.63Å
157F94.6Very high90Very high34 Ų3433.4 Ų33.415%0.14919%0.189CC..Hα-helixtrans-68.3-37.6176-86.9-110.6000111.3F27 I28 F32 A35 G153 T160 L161F27-F157 AromaticContact CD1-CE2 3.87Å; F27-F157 HydrophobicContact CD1-CE2 3.87Å; F27-F157 HydrophobicContact CE1-CD2 4.14Å; F27-F157 AromaticContact CE1-CE2 3.69Å; F27-F157 HydrophobicContact CE1-CE2 3.69Å; I28-F157 HydrophobicContact CB-CZ 4.3Å; I28-F157 HydrophobicContact CG1-CZ 4.21Å; I28-F157 HydrophobicContact CG2-CZ 4.16Å; F32-F157 HydrophobicContact CD1-CD1 4.05Å; F32-F157 HydrophobicContact CD1-CE1 4.2Å; F32-F157 HydrophobicContact CD2-CD1 4.19Å; F32-F157 AromaticContact CD2-CE1 3.65Å; F32-F157 HydrophobicContact CD2-CE1 3.65Å; F32-F157 HydrophobicContact CD2-CZ 4.47Å; F32-F157 HydrophobicContact CE1-CD1 4.06Å; F32-F157 AromaticContact CE1-CE1 3.98Å; F32-F157 HydrophobicContact CE1-CE1 3.98Å; F32-F157 HydrophobicContact CE2-CD1 4.24Å; F32-F157 AromaticContact CE2-CE1 3.44Å; F32-F157 HydrophobicContact CE2-CE1 3.44Å; F32-F157 VanDerWaalsContact CE2-CE1 3.44Å; F32-F157 HydrophobicContact CE2-CZ 4.27Å; F32-F157 HydrophobicContact CG-CD1 4.11Å; F32-F157 HydrophobicContact CG-CE1 4.05Å; F32-F157 HydrophobicContact CZ-CD1 4.17Å; F32-F157 AromaticContact CZ-CE1 3.61Å; F32-F157 HydrophobicContact CZ-CE1 3.61Å; A35-F157 HydrophobicContact CB-CB 3.65Å; G153-F157 WeakPolarHBondContact O-CB 3.38Å; G153-F157 VanDerWaalsContact O-CD2 3.28Å; G153-F157 WeakPolarHBondContact O-CD2 3.35Å; G153-F157 PolarHBondContact O-N 2.72Å; F157-T160 WeakPolarHBondContact CA-OG1 3.24Å; F157-T160 PolarHBondContact O-N 3.42Å; F157-T160 PolarHBondContact O-OG1 2.8Å; F157-T160 VanDerWaalsContact O-OG1 3.1Å; F157-L161 HydrophobicContact CB-CD1 4.27Å; F157-L161 HydrophobicContact CD1-CD1 4.25Å; F157-L161 WeakPolarHBondContact O-CB 3.47Å; F157-L161 WeakPolarHBondContact O-CG 3.22Å; F157-L161 PolarHBondContact O-N 3.21Å
158L91.6Very high90.5Very high4 Ų431.5 Ų31.52%0.02118%0.179CC..Hα-helixtrans-64.7-42.9177.5-178.756.6000112.1A35 K38 S154 P155 T160 A162 A275A35-L158 HydrophobicContact CB-CB 4Å; K38-L158 HydrophobicContact CB-CD1 3.66Å; K38-L158 HydrophobicContact CB-CD2 4.26Å; K38-L158 HydrophobicContact CD-CD2 3.86Å; S154-L158 WeakPolarHBondContact O-CB 3.25Å; S154-L158 PolarHBondContact O-N 3.03Å; P155-L158 PolarHBondContact O-N 2.92Å; L158-T160 VanDerWaalsContact C-N 3.26Å; L158-T160 PolarHBondContact O-N 3.45Å; L158-A162 WeakPolarHBondContact O-CB 3.43Å; L158-A162 PolarHBondContact O-N 3.33Å; L158-A162 VanDerWaalsContact O-N 3.13Å; L158-A275 HydrophobicContact CB-CB 4.07Å; L158-A275 HydrophobicContact CD2-CB 4.05Å; L158-A275 HydrophobicContact CG-CB 4.06Å
159S91.6Very high90.9Very high31 Ų3131.9 Ų31.922%0.21717%0.168CC..Hα-helixtrans-67.7-27.6-178.668.30000113.5P155 V156 P163 S272P155-S159 PolarHBondContact O-N 3.2Å; P155-S159 PolarHBondContact O-OG 2.84Å; V156-S159 PolarHBondContact O-OG 3.31Å; S159-P163 WeakPolarHBondContact O-CD 3.18Å; S159-P163 WeakPolarHBondContact O-CG 3.48Å; S159-S272 PolarHBondContact O-OG 3.46Å
160T93Very high91Very high81 Ų8132.1 Ų32.150%0.49717%0.17SC..Hα-helixtrans-89.5-43.2177.548.40000112.5V156 F157 L158 P163 L164V156-T160 WeakPolarHBondContact O-CG2 3.42Å; V156-T160 PolarHBondContact O-N 2.66Å; V156-T160 PolarHBondContact O-OG1 3.49Å; F157-T160 WeakPolarHBondContact CA-OG1 3.24Å; F157-T160 PolarHBondContact O-N 3.42Å; F157-T160 PolarHBondContact O-OG1 2.8Å; F157-T160 VanDerWaalsContact O-OG1 3.1Å; L158-T160 VanDerWaalsContact C-N 3.26Å; L158-T160 PolarHBondContact O-N 3.45Å; T160-P163 WeakPolarHBondContact O-CD 3.43Å; T160-L164 VanDerWaalsContact O-CB 3.24Å; T160-L164 WeakPolarHBondContact O-CB 3.37Å; T160-L164 PolarHBondContact O-N 3.22Å
161L92.7Very high91.2Very high8 Ų838 Ų384%0.04220%0.197CC..Hα-helixtrans-68.9-35.5-178.5-71.7173.5000112.9F32 A35 F157 L164 N165 L181F32-L161 HydrophobicContact CD1-CD1 4.24Å; F32-L161 HydrophobicContact CE1-CD1 4.28Å; F32-L161 HydrophobicContact CE1-CD2 4.46Å; A35-L161 HydrophobicContact CB-CD1 4.08Å; F157-L161 HydrophobicContact CB-CD1 4.27Å; F157-L161 HydrophobicContact CD1-CD1 4.25Å; F157-L161 WeakPolarHBondContact O-CB 3.47Å; F157-L161 WeakPolarHBondContact O-CG 3.22Å; F157-L161 PolarHBondContact O-N 3.21Å; L161-L164 HydrophobicContact CD2-CD2 4.32Å; L161-L164 PolarHBondContact O-N 2.94Å; L161-N165 WeakPolarHBondContact O-CB 3.31Å; L161-N165 PolarHBondContact O-N 2.9Å; L161-N165 PolarHBondContact O-ND2 3.45Å; L161-N165 PolarHBondContact O-OD1 3.25Å; L161-L181 HydrophobicContact CD2-CD2 4.37Å
162A90.2Very high91.5Very high0 Ų041.5 Ų41.50%021%0.211CC..Hα-helixtrans-64.1-48.4-177.500000113.4V42 L158 T166 L271V42-A162 HydrophobicContact CG1-CB 4.47Å; L158-A162 WeakPolarHBondContact O-CB 3.43Å; L158-A162 PolarHBondContact O-N 3.33Å; L158-A162 VanDerWaalsContact O-N 3.13Å; A162-T166 PolarHBondContact O-N 3.47Å; A162-T166 PolarHBondContact O-OG1 3.41Å; A162-T166 VanDerWaalsContact O-OG1 3.12Å; A162-L271 HydrophobicContact CB-CB 4Å; A162-L271 HydrophobicContact CB-CD1 4.17Å
163P90.6Very high91.8Very high47 Ų4741.3 Ų41.331%0.30521%0.212SC..Hα-helixtrans-66.2-41.7172.3-22.234.5000112.5S159 T160 N165 T166 W167 S272S159-P163 WeakPolarHBondContact O-CD 3.18Å; S159-P163 WeakPolarHBondContact O-CG 3.48Å; T160-P163 WeakPolarHBondContact O-CD 3.43Å; P163-N165 VanDerWaalsContact C-N 3.31Å; P163-N165 PolarHBondContact O-N 2.91Å; P163-T166 WeakPolarHBondContact O-CB 3.19Å; P163-T166 PolarHBondContact O-N 3.48Å; P163-T166 VanDerWaalsContact O-N 3.12Å; P163-W167 PolarHBondContact O-N 3.21Å; P163-S272 VanDerWaalsContact CD-OG 3.3Å; P163-S272 WeakPolarHBondContact CD-OG 3.49Å; P163-S272 VanDerWaalsContact CG-OG 3.25Å; P163-S272 WeakPolarHBondContact CG-OG 3.44Å
164L93.3Very high91.9Very high66 Ų6641.7 Ų41.735%0.34621%0.214SC..Hα-helixtrans-58.3-43.6178179.864.6000111.5T160 L161 T166 W167 L168 L184T160-L164 VanDerWaalsContact O-CB 3.24Å; T160-L164 WeakPolarHBondContact O-CB 3.37Å; T160-L164 PolarHBondContact O-N 3.22Å; L161-L164 HydrophobicContact CD2-CD2 4.32Å; L161-L164 PolarHBondContact O-N 2.94Å; L164-T166 VanDerWaalsContact C-N 3.28Å; L164-T166 PolarHBondContact O-N 3.11Å; L164-W167 HydrophobicContact CD1-CE3 4.24Å; L164-W167 PolarHBondContact O-N 3.35Å; L164-L168 HydrophobicContact CD1-CD1 4.44Å; L164-L168 HydrophobicContact CD1-CG 4.27Å; L164-L168 HydrophobicContact CG-CD1 4Å; L164-L168 HydrophobicContact CG-CG 4.28Å; L164-L168 WeakPolarHBondContact O-CB 3.17Å; L164-L168 VanDerWaalsContact O-CG 3.25Å; L164-L168 WeakPolarHBondContact O-CG 3.4Å; L164-L168 PolarHBondContact O-N 3.44Å; L164-L184 HydrophobicContact CD2-CD1 4.21Å
165N92.7Very high92.1Very high0 Ų046.4 Ų46.40%023%0.231CC..Hα-helixtrans-63.2-35.2178.3-75.7-4.4000112.6S39 V42 F43 L161 P163 Y169 L181S39-N165 WeakPolarHBondContact CB-ND2 3.29Å; S39-N165 PolarHBondContact O-ND2 3.39Å; S39-N165 PolarHBondContact OG-ND2 2.88Å; V42-N165 HydrophobicContact CG2-CB 3.59Å; F43-N165 WeakPolarHBondContact CE1-O 3.28Å; F43-N165 HydrophobicContact CE2-CB 3.8Å; F43-N165 HydrophobicContact CZ-CB 3.63Å; F43-N165 WeakPolarHBondContact CZ-O 3.39Å; L161-N165 WeakPolarHBondContact O-CB 3.31Å; L161-N165 PolarHBondContact O-N 2.9Å; L161-N165 PolarHBondContact O-ND2 3.45Å; L161-N165 PolarHBondContact O-OD1 3.25Å; P163-N165 VanDerWaalsContact C-N 3.31Å; P163-N165 PolarHBondContact O-N 2.91Å; N165-Y169 WeakPolarHBondContact O-CB 3.37Å; N165-Y169 PolarHBondContact O-N 2.84Å; N165-L181 WeakPolarHBondContact OD1-CD2 3.29Å
166T89.9Confident92.3Very high10 Ų1047.3 Ų47.36%0.06124%0.24CC..Hα-helixtrans-68.2-47.6175.7-54.50000110.2A162 P163 L164 L168 Y169 D170 K264 E265 A268A162-T166 PolarHBondContact O-N 3.47Å; A162-T166 PolarHBondContact O-OG1 3.41Å; A162-T166 VanDerWaalsContact O-OG1 3.12Å; P163-T166 WeakPolarHBondContact O-CB 3.19Å; P163-T166 PolarHBondContact O-N 3.48Å; P163-T166 VanDerWaalsContact O-N 3.12Å; L164-T166 VanDerWaalsContact C-N 3.28Å; L164-T166 PolarHBondContact O-N 3.11Å; T166-L168 PolarHBondContact O-N 3.49Å; T166-Y169 WeakPolarHBondContact O-CB 3.47Å; T166-Y169 PolarHBondContact O-N 2.95Å; T166-Y169 VanDerWaalsContact O-N 3.15Å; T166-D170 PolarHBondContact O-N 3.39Å; T166-K264 HydrophobicContact CG2-CB 4.27Å; T166-E265 HydrophobicContact CG2-CG 4.45Å; T166-A268 WeakPolarHBondContact OG1-CB 3.47Å
167W92.8Very high92.5Very high139 Ų13945.1 Ų45.153%0.52723%0.227SC..Hα-helixtrans-60.9-43.4175.9179.582.8000112.6P163 L164 Y169 D170 Q171 F172P163-W167 PolarHBondContact O-N 3.21Å; L164-W167 HydrophobicContact CD1-CE3 4.24Å; L164-W167 PolarHBondContact O-N 3.35Å; W167-Y169 VanDerWaalsContact C-N 3.29Å; W167-Y169 PolarHBondContact O-N 3.35Å; W167-D170 PolarHBondContact O-N 3.38Å; W167-Q171 HydrophobicContact CD2-CG 4.31Å; W167-Q171 HydrophobicContact CZ2-CG 3.97Å; W167-Q171 WeakPolarHBondContact O-CG 3.18Å; W167-Q171 PolarHBondContact O-N 3.05Å; W167-Q171 VanDerWaalsContact O-N 3.14Å; W167-F172 HydrophobicContact CH2-CE2 4.28Å; W167-F172 HydrophobicContact CZ3-CE2 4.22Å
168L93.6Very high92.5Very high6 Ų643.7 Ų43.73%0.03122%0.221CC..Hα-helixtrans-60.6-40.7175.3-73.7174.4000111.4L164 T166 Q171 F172 S177 I180L164-L168 HydrophobicContact CD1-CD1 4.44Å; L164-L168 HydrophobicContact CD1-CG 4.27Å; L164-L168 HydrophobicContact CG-CD1 4Å; L164-L168 HydrophobicContact CG-CG 4.28Å; L164-L168 WeakPolarHBondContact O-CB 3.17Å; L164-L168 VanDerWaalsContact O-CG 3.25Å; L164-L168 WeakPolarHBondContact O-CG 3.4Å; L164-L168 PolarHBondContact O-N 3.44Å; T166-L168 PolarHBondContact O-N 3.49Å; L168-Q171 PolarHBondContact O-N 3.45Å; L168-F172 HydrophobicContact CD2-CD2 4.01Å; L168-F172 HydrophobicContact CD2-CE2 4.14Å; L168-F172 WeakPolarHBondContact O-CB 3.24Å; L168-F172 PolarHBondContact O-N 3.32Å; L168-S177 WeakPolarHBondContact CB-OG 3.47Å; L168-S177 PolarHBondContact O-OG 2.89Å; L168-I180 HydrophobicContact CD1-CG2 4.1Å; L168-I180 HydrophobicContact CD2-CD1 3.71Å; L168-I180 HydrophobicContact CD2-CG2 4.12Å
169Y90.4Very high92.8Very high51 Ų5147.4 Ų47.420%0.224%0.241CC..Hα-helixtrans-60.4-46.9175.9-178.6-94.6000111.6F43 E46 N165 T166 W167 Q171 G173 W174 S177F43-Y169 AromaticContact CD1-CD2 3.72Å; F43-Y169 HydrophobicContact CD1-CD2 3.72Å; F43-Y169 HydrophobicContact CD1-CG 4.3Å; F43-Y169 HydrophobicContact CE1-CD2 4.01Å; F43-Y169 HydrophobicContact CE1-CG 4.34Å; E46-Y169 HydrophobicContact CB-CE2 3.89Å; E46-Y169 HydrophobicContact CG-CE1 3.93Å; E46-Y169 HydrophobicContact CG-CE2 4Å; E46-Y169 WeakPolarHBondContact CG-OH 3.43Å; N165-Y169 WeakPolarHBondContact O-CB 3.37Å; N165-Y169 PolarHBondContact O-N 2.84Å; T166-Y169 WeakPolarHBondContact O-CB 3.47Å; T166-Y169 PolarHBondContact O-N 2.95Å; T166-Y169 VanDerWaalsContact O-N 3.15Å; W167-Y169 VanDerWaalsContact C-N 3.29Å; W167-Y169 PolarHBondContact O-N 3.35Å; Y169-Q171 VanDerWaalsContact C-N 3.29Å; Y169-Q171 PolarHBondContact O-N 2.89Å; Y169-G173 WeakPolarHBondContact O-CA 3.02Å; Y169-G173 PolarHBondContact O-N 3.06Å; Y169-W174 HydrophobicContact CD2-CB 4.05Å; Y169-W174 HydrophobicContact CE2-CB 3.97Å; Y169-S177 WeakPolarHBondContact CA-OG 3.5Å; Y169-S177 PolarHBondContact N-OG 3.49Å; Y169-S177 VanDerWaalsContact N-OG 3.14Å
170D90.9Very high93Very high76 Ų7649 Ų4941%0.40625%0.246SC..Hα-helixtrans-67.9-30.9-175.1-66-30.3000112.3T166 W167T166-D170 PolarHBondContact O-N 3.39Å; W167-D170 PolarHBondContact O-N 3.38Å
171Q94.3Very high93.1Very high122 Ų12245.4 Ų45.457%0.5722%0.224SC*.Hα-helixtrans-88.2-39.7179.6-63-57-58.100113.9W167 L168 Y169W167-Q171 HydrophobicContact CD2-CG 4.31Å; W167-Q171 HydrophobicContact CZ2-CG 3.97Å; W167-Q171 WeakPolarHBondContact O-CG 3.18Å; W167-Q171 PolarHBondContact O-N 3.05Å; W167-Q171 VanDerWaalsContact O-N 3.14Å; L168-Q171 PolarHBondContact O-N 3.45Å; Y169-Q171 VanDerWaalsContact C-N 3.29Å; Y169-Q171 PolarHBondContact O-N 2.89Å
172F92.9Very high93.2Very high116 Ų11645 Ų4551%0.50922%0.222SC..Hα-helixtrans-121.9-4.2-168.2-55.8-73.9000114W167 L168 I180W167-F172 HydrophobicContact CH2-CE2 4.28Å; W167-F172 HydrophobicContact CZ3-CE2 4.22Å; L168-F172 HydrophobicContact CD2-CD2 4.01Å; L168-F172 HydrophobicContact CD2-CE2 4.14Å; L168-F172 WeakPolarHBondContact O-CB 3.24Å; L168-F172 PolarHBondContact O-N 3.32Å; F172-I180 HydrophobicContact CD2-CD1 3.89Å; F172-I180 HydrophobicContact CE2-CD1 4.11Å; F172-I180 HydrophobicContact CG-CD1 4.3Å
173G92.4Very high93.5Very high26 Ų2646.7 Ų46.727%0.26824%0.238SC..Hα-helixtrans67.7175-170.900000113Y169 R175 G176 S177Y169-G173 WeakPolarHBondContact O-CA 3.02Å; Y169-G173 PolarHBondContact O-N 3.06Å; G173-R175 VanDerWaalsContact C-N 3.32Å; G173-R175 PolarHBondContact O-N 3.45Å; G173-G176 PolarHBondContact O-N 3.04Å; G173-S177 PolarHBondContact O-N 3.35Å; G173-S177 PolarHBondContact O-OG 2.96Å
174W91.1Very high93.6Very high9 Ų946.8 Ų46.83%0.03424%0.236CC..Hα-helixtrans-63.2-34.2-174.872.8-88.9000114F43 F51 C106 L112 Y169 S177 F178F43-W174 HydrophobicContact CD1-CB 4.38Å; F51-W174 HydrophobicContact CE2-CH2 4.13Å; F51-W174 AromaticContact CE2-CZ2 3.82Å; F51-W174 HydrophobicContact CE2-CZ2 3.82Å; F51-W174 AromaticContact CZ-CH2 3.91Å; F51-W174 HydrophobicContact CZ-CH2 3.91Å; F51-W174 AromaticContact CZ-CZ2 3.66Å; F51-W174 HydrophobicContact CZ-CZ2 3.66Å; C106-W174 WeakPolarHBondContact O-CH2 3.45Å; L112-W174 HydrophobicContact CD2-CZ3 4.12Å; Y169-W174 HydrophobicContact CD2-CB 4.05Å; Y169-W174 HydrophobicContact CE2-CB 3.97Å; W174-S177 PolarHBondContact O-N 3.44Å; W174-F178 AromaticContact CE3-CD2 3.74Å; W174-F178 HydrophobicContact CE3-CD2 3.74Å; W174-F178 AromaticContact CE3-CE2 3.75Å; W174-F178 HydrophobicContact CE3-CE2 3.75Å; W174-F178 HydrophobicContact CE3-CG 4.46Å; W174-F178 HydrophobicContact CE3-CZ 4.48Å; W174-F178 AromaticContact CZ3-CD2 3.86Å; W174-F178 HydrophobicContact CZ3-CD2 3.86Å; W174-F178 AromaticContact CZ3-CE2 3.94Å; W174-F178 HydrophobicContact CZ3-CE2 3.94Å; W174-F178 WeakPolarHBondContact O-CG 3.37Å; W174-F178 PolarHBondContact O-N 3.07Å
175R93.8Very high93.7Very high101 Ų10143.8 Ų43.838%0.38122%0.22SC..Hα-helixtrans-66.4-49.6178.6-67.7-171.2168.295-4.6111.2S104 N107 G173 S177 F178 L179S104-R175 WeakPolarHBondContact CB-O 3.38Å; S104-R175 WeakPolarHBondContact O-CB 3.24Å; S104-R175 WeakPolarHBondContact O-CD 3.48Å; S104-R175 WeakPolarHBondContact O-CG 3.45Å; N107-R175 PolarHBondContact OD1-NH2 3.11Å; G173-R175 VanDerWaalsContact C-N 3.32Å; G173-R175 PolarHBondContact O-N 3.45Å; R175-S177 VanDerWaalsContact C-N 3.31Å; R175-S177 PolarHBondContact O-N 3.24Å; R175-F178 PolarHBondContact O-N 3.4Å; R175-L179 PolarHBondContact O-N 2.99Å; R175-L179 VanDerWaalsContact O-N 3.08Å
176G94.4Very high93.8Very high20 Ų2047 Ų4721%0.20624%0.237CC..Hα-helixtrans-61.7-39.9175.600000112G173 F178 L179 I180G173-G176 PolarHBondContact O-N 3.04Å; G176-F178 PolarHBondContact O-N 3.15Å; G176-L179 WeakPolarHBondContact O-CB 3.31Å; G176-L179 PolarHBondContact O-N 3.34Å; G176-I180 WeakPolarHBondContact O-CG1 3.39Å; G176-I180 PolarHBondContact O-N 3.21Å
177S95.4Very high94Very high0 Ų050.3 Ų50.30%026%0.255CS..Hα-helixtrans-59.5-45.2174.5-590000112.7L168 Y169 G173 W174 R175 L179 I180 L181L168-S177 WeakPolarHBondContact CB-OG 3.47Å; L168-S177 PolarHBondContact O-OG 2.89Å; Y169-S177 WeakPolarHBondContact CA-OG 3.5Å; Y169-S177 PolarHBondContact N-OG 3.49Å; Y169-S177 VanDerWaalsContact N-OG 3.14Å; G173-S177 PolarHBondContact O-N 3.35Å; G173-S177 PolarHBondContact O-OG 2.96Å; W174-S177 PolarHBondContact O-N 3.44Å; R175-S177 VanDerWaalsContact C-N 3.31Å; R175-S177 PolarHBondContact O-N 3.24Å; S177-L179 VanDerWaalsContact C-N 3.35Å; S177-I180 PolarHBondContact O-N 3.47Å; S177-L181 VanDerWaalsContact O-CB 3.31Å; S177-L181 WeakPolarHBondContact O-CB 3.49Å; S177-L181 VanDerWaalsContact O-CG 3.29Å; S177-L181 WeakPolarHBondContact O-CG 3.35Å; S177-L181 PolarHBondContact O-N 3.49Å
178F95.5Very high94Very high5 Ų543.7 Ų43.72%0.02223%0.229CC..Hα-helixtrans-66.8-35.8178.8-762.5000112.5I40 F43 I47 F100 A103 L112 V116 W174 R175 G176 L181 G182I40-F178 HydrophobicContact CG2-CE1 4.28Å; F43-F178 AromaticContact CD2-CE1 3.71Å; F43-F178 HydrophobicContact CD2-CE1 3.71Å; F43-F178 HydrophobicContact CD2-CZ 4.45Å; F43-F178 HydrophobicContact CE2-CD1 4.45Å; F43-F178 AromaticContact CE2-CE1 3.91Å; F43-F178 HydrophobicContact CE2-CE1 3.91Å; F43-F178 HydrophobicContact CG-CE1 4.18Å; I47-F178 HydrophobicContact CD1-CZ 4.24Å; F100-F178 HydrophobicContact CD1-CD1 4.47Å; A103-F178 HydrophobicContact CB-CD2 3.88Å; A103-F178 HydrophobicContact CB-CE2 4.5Å; L112-F178 HydrophobicContact CD2-CE2 4.15Å; V116-F178 HydrophobicContact CG2-CE2 4.33Å; W174-F178 AromaticContact CE3-CD2 3.74Å; W174-F178 HydrophobicContact CE3-CD2 3.74Å; W174-F178 AromaticContact CE3-CE2 3.75Å; W174-F178 HydrophobicContact CE3-CE2 3.75Å; W174-F178 HydrophobicContact CE3-CG 4.46Å; W174-F178 HydrophobicContact CE3-CZ 4.48Å; W174-F178 AromaticContact CZ3-CD2 3.86Å; W174-F178 HydrophobicContact CZ3-CD2 3.86Å; W174-F178 AromaticContact CZ3-CE2 3.94Å; W174-F178 HydrophobicContact CZ3-CE2 3.94Å; W174-F178 WeakPolarHBondContact O-CG 3.37Å; W174-F178 PolarHBondContact O-N 3.07Å; R175-F178 PolarHBondContact O-N 3.4Å; G176-F178 PolarHBondContact O-N 3.15Å; F178-L181 HydrophobicContact CD1-CD1 4.23Å; F178-L181 PolarHBondContact O-N 3.36Å; F178-G182 PolarHBondContact O-N 2.93Å
179L96.7Very high94Very high82 Ų8244.6 Ų44.643%0.42924%0.236SC..Hα-helixtrans-61.3-47.4173.5-17568.1000111.6V101 R175 G176 S177 G182 G183V101-L179 HydrophobicContact CB-CD1 4.33Å; V101-L179 HydrophobicContact CG1-CD1 3.8Å; V101-L179 HydrophobicContact CG2-CD1 4.11Å; R175-L179 PolarHBondContact O-N 2.99Å; R175-L179 VanDerWaalsContact O-N 3.08Å; G176-L179 WeakPolarHBondContact O-CB 3.31Å; G176-L179 PolarHBondContact O-N 3.34Å; S177-L179 VanDerWaalsContact C-N 3.35Å; L179-G182 PolarHBondContact O-N 2.98Å; L179-G183 PolarHBondContact O-N 3.12Å; L179-G183 VanDerWaalsContact O-N 3.17Å
180I96.8Very high94.2Very high64 Ų6446.2 Ų46.233%0.32825%0.251SS..Hα-helixtrans-66.9-42.6178.8-66.5167.2000111L168 F172 G176 S177 G182 G183 L184L168-I180 HydrophobicContact CD1-CG2 4.1Å; L168-I180 HydrophobicContact CD2-CD1 3.71Å; L168-I180 HydrophobicContact CD2-CG2 4.12Å; F172-I180 HydrophobicContact CD2-CD1 3.89Å; F172-I180 HydrophobicContact CE2-CD1 4.11Å; F172-I180 HydrophobicContact CG-CD1 4.3Å; G176-I180 WeakPolarHBondContact O-CG1 3.39Å; G176-I180 PolarHBondContact O-N 3.21Å; S177-I180 PolarHBondContact O-N 3.47Å; I180-G182 VanDerWaalsContact C-N 3.28Å; I180-G182 PolarHBondContact O-N 2.94Å; I180-G183 WeakPolarHBondContact O-CA 3.15Å; I180-G183 PolarHBondContact O-N 3.21Å; I180-G183 VanDerWaalsContact O-N 3.07Å; I180-L184 PolarHBondContact O-N 3.36Å
181L95.1Very high94.3Very high6 Ų642.7 Ų42.73%0.03123%0.232CC..Hα-helixtrans-61.1-36.6174.5-78.6172.3000112.2F43 F100 L161 N165 S177 F178 G183 L184 L185F43-L181 HydrophobicContact CE2-CD1 4.04Å; F43-L181 HydrophobicContact CZ-CD1 4.31Å; F100-L181 HydrophobicContact CD1-CB 3.92Å; F100-L181 HydrophobicContact CE1-CB 4.36Å; F100-L181 HydrophobicContact CE1-CD1 4.34Å; L161-L181 HydrophobicContact CD2-CD2 4.37Å; N165-L181 WeakPolarHBondContact OD1-CD2 3.29Å; S177-L181 VanDerWaalsContact O-CB 3.31Å; S177-L181 WeakPolarHBondContact O-CB 3.49Å; S177-L181 VanDerWaalsContact O-CG 3.29Å; S177-L181 WeakPolarHBondContact O-CG 3.35Å; S177-L181 PolarHBondContact O-N 3.49Å; F178-L181 HydrophobicContact CD1-CD1 4.23Å; F178-L181 PolarHBondContact O-N 3.36Å; L181-G183 VanDerWaalsContact C-N 3.33Å; L181-G183 PolarHBondContact O-N 3.4Å; L181-L184 HydrophobicContact CD2-CD1 4.21Å; L181-L184 PolarHBondContact O-N 3.04Å; L181-L185 WeakPolarHBondContact O-CG 3.2Å; L181-L185 PolarHBondContact O-N 3.3Å
182G95.2Very high94.2Very high0 Ų036.9 Ų36.90%021%0.205CC..Hα-helixtrans-59.3-43.8171.200000112.1G97 F178 L179 I180 L184 L185 L186G97-G182 WeakPolarHBondContact CA-O 3.45Å; F178-G182 PolarHBondContact O-N 2.93Å; L179-G182 PolarHBondContact O-N 2.98Å; I180-G182 VanDerWaalsContact C-N 3.28Å; I180-G182 PolarHBondContact O-N 2.94Å; G182-L184 PolarHBondContact O-N 3.17Å; G182-L185 PolarHBondContact O-N 3.07Å; G182-L186 WeakPolarHBondContact O-CG 3.38Å; G182-L186 PolarHBondContact O-N 3.08Å
183G94.9Very high94.2Very high34 Ų3433.2 Ų33.235%0.35119%0.194SC..Hα-helixtrans-60.5-41.5172.200000113.4L179 I180 L181 L186L179-G183 PolarHBondContact O-N 3.12Å; L179-G183 VanDerWaalsContact O-N 3.17Å; I180-G183 WeakPolarHBondContact O-CA 3.15Å; I180-G183 PolarHBondContact O-N 3.21Å; I180-G183 VanDerWaalsContact O-N 3.07Å; L181-G183 VanDerWaalsContact C-N 3.33Å; L181-G183 PolarHBondContact O-N 3.4Å; G183-L186 WeakPolarHBondContact O-CB 3.49Å; G183-L186 PolarHBondContact O-N 2.62Å
184L94.4Very high94.2Very high50 Ų5034 Ų3426%0.26219%0.192SC..Hα-helixtrans-64.4-40.1175-69.9176.7000112.1F32 L164 I180 L181 G182 L186 N187F32-L184 HydrophobicContact CE1-CB 4.18Å; F32-L184 HydrophobicContact CZ-CB 4.08Å; L164-L184 HydrophobicContact CD2-CD1 4.21Å; I180-L184 PolarHBondContact O-N 3.36Å; L181-L184 HydrophobicContact CD2-CD1 4.21Å; L181-L184 PolarHBondContact O-N 3.04Å; G182-L184 PolarHBondContact O-N 3.17Å; L184-L186 VanDerWaalsContact C-N 3.32Å; L184-L186 PolarHBondContact O-N 3.29Å; L184-N187 VanDerWaalsContact O-CB 3.25Å; L184-N187 WeakPolarHBondContact O-CB 3.31Å; L184-N187 PolarHBondContact O-N 2.88Å; L184-N187 VanDerWaalsContact O-N 3.09Å
185L94.5Very high94.1Very high2 Ų233.5 Ų33.51%0.0119%0.19CC..Hα-helixtrans-68.5-28.2176.4-73.5170.2000112.9F32 T36 F100 L124 L181 G182 N187 C188F32-L185 HydrophobicContact CB-CD2 4.02Å; F32-L185 HydrophobicContact CD1-CD2 3.8Å; F32-L185 HydrophobicContact CE1-CD2 4.49Å; F32-L185 HydrophobicContact CG-CD2 4.03Å; T36-L185 HydrophobicContact CG2-CD1 4.49Å; F100-L185 HydrophobicContact CB-CD1 4.26Å; F100-L185 HydrophobicContact CD1-CD1 4.27Å; F100-L185 HydrophobicContact CD2-CD1 3.28Å; F100-L185 HydrophobicContact CE1-CD1 4.47Å; F100-L185 HydrophobicContact CE2-CD1 3.54Å; F100-L185 HydrophobicContact CG-CD1 3.67Å; F100-L185 HydrophobicContact CZ-CD1 4.14Å; L124-L185 HydrophobicContact CD2-CD2 3.92Å; L181-L185 WeakPolarHBondContact O-CG 3.2Å; L181-L185 PolarHBondContact O-N 3.3Å; G182-L185 PolarHBondContact O-N 3.07Å; L185-N187 PolarHBondContact O-N 3.5Å; L185-C188 WeakPolarHBondContact O-CB 3.27Å; L185-C188 PolarHBondContact O-N 2.85Å; L185-C188 PolarHBondContact O-SG 2.87Å; L185-C188 VanDerWaalsContact O-SG 3.4Å
186L94.8Very high93.9Very high67 Ų6736 Ų3635%0.35120%0.2SC..Hα-helixtrans-63-22.4170.5-70.9173.2000112.4F94 G182 G183 L184 C188 C189F94-L186 HydrophobicContact CD2-CD2 4.31Å; G182-L186 WeakPolarHBondContact O-CG 3.38Å; G182-L186 PolarHBondContact O-N 3.08Å; G183-L186 WeakPolarHBondContact O-CB 3.49Å; G183-L186 PolarHBondContact O-N 2.62Å; L184-L186 VanDerWaalsContact C-N 3.32Å; L184-L186 PolarHBondContact O-N 3.29Å; L186-C188 PolarHBondContact O-N 2.88Å; L186-C189 WeakPolarHBondContact O-CB 3.46Å; L186-C189 PolarHBondContact O-N 3.37Å; L186-C189 PolarHBondContact O-SG 3.48Å; L186-C189 VanDerWaalsContact O-SG 3.4Å
187N94.1Very high93.3Very high80 Ų8039.7 Ų39.743%0.42822%0.22SC..Hα-helixtrans-66.2-16.2171.1-68-53.3000112.9L184 L185 C189 V190 A191L184-N187 VanDerWaalsContact O-CB 3.25Å; L184-N187 WeakPolarHBondContact O-CB 3.31Å; L184-N187 PolarHBondContact O-N 2.88Å; L184-N187 VanDerWaalsContact O-N 3.09Å; L185-N187 PolarHBondContact O-N 3.5Å; N187-C189 PolarHBondContact O-N 3.33Å; N187-V190 WeakPolarHBondContact O-CB 3.34Å; N187-V190 PolarHBondContact O-N 3.09Å; N187-A191 PolarHBondContact O-N 3.02Å
188C92.6Very high92.5Very high0 Ų041.6 Ų41.60%023%0.229CC..Hα-helixtrans-60.2-28167.1-65.10000111.8F32 N127 L185 L186 V190 A191 G192F32-C188 VanDerWaalsContact CD2-SG 3.53Å; N127-C188 WeakPolarHBondContact OD1-CB 3.39Å; L185-C188 WeakPolarHBondContact O-CB 3.27Å; L185-C188 PolarHBondContact O-N 2.85Å; L185-C188 PolarHBondContact O-SG 2.87Å; L185-C188 VanDerWaalsContact O-SG 3.4Å; L186-C188 PolarHBondContact O-N 2.88Å; C188-V190 VanDerWaalsContact C-N 3.35Å; C188-A191 PolarHBondContact O-N 3.31Å; C188-G192 PolarHBondContact O-N 3.47Å
189C93.8Very high91.2Very high26 Ų2643.2 Ų43.218%0.17625%0.248CC..Hα-helixtrans-63.7-41.8172.1-59.10000111.7M90 G93 F94 L186 N187 G192 S193M90-C189 PolarHBondContact O-SG 3.15Å; G93-C189 VanDerWaalsContact C-SG 3.51Å; F94-C189 PolarHBondContact N-SG 3.32Å; L186-C189 WeakPolarHBondContact O-CB 3.46Å; L186-C189 PolarHBondContact O-N 3.37Å; L186-C189 PolarHBondContact O-SG 3.48Å; L186-C189 VanDerWaalsContact O-SG 3.4Å; N187-C189 PolarHBondContact O-N 3.33Å; C189-G192 PolarHBondContact O-N 3.19Å; C189-S193 PolarHBondContact O-N 3.21Å
190V94.2Very high89.5Confident85 Ų8544.5 Ų44.552%0.51526%0.261SS..Hα-helixtrans-65.3-45.1176.2-1770000109.7N187 C188 G192 S193N187-V190 WeakPolarHBondContact O-CB 3.34Å; N187-V190 PolarHBondContact O-N 3.09Å; C188-V190 VanDerWaalsContact C-N 3.35Å; V190-G192 VanDerWaalsContact C-N 3.31Å; V190-G192 PolarHBondContact O-N 2.84Å; V190-S193 WeakPolarHBondContact O-CB 3.16Å; V190-S193 PolarHBondContact O-N 3.27Å; V190-S193 VanDerWaalsContact O-N 3.08Å; V190-S193 PolarHBondContact O-OG 3.17Å
191A93Very high87.6Confident1 Ų150.4 Ų50.41%0.00828%0.284CS..Hα-helixtrans-59.2-41.1174.400000112.4I28 N187 C188 S193 L194I28-A191 HydrophobicContact CB-CB 4.07Å; I28-A191 HydrophobicContact CG2-CB 4Å; N187-A191 PolarHBondContact O-N 3.02Å; C188-A191 PolarHBondContact O-N 3.31Å; A191-S193 VanDerWaalsContact C-N 3.33Å; A191-S193 PolarHBondContact O-N 3.03Å; A191-L194 WeakPolarHBondContact O-CB 3.38Å; A191-L194 PolarHBondContact O-N 3.26Å
192G91.8Very high85.8Confident0 Ų054.9 Ų54.90%031%0.313CS..Hα-helixtrans-66-31174.200000113.6C188 C189 V190 L194 M195C188-G192 PolarHBondContact O-N 3.47Å; C189-G192 PolarHBondContact O-N 3.19Å; V190-G192 VanDerWaalsContact C-N 3.31Å; V190-G192 PolarHBondContact O-N 2.84Å; G192-L194 PolarHBondContact O-N 3.41Å; G192-M195 VanDerWaalsContact O-CB 3.25Å; G192-M195 WeakPolarHBondContact O-CB 3.43Å; G192-M195 WeakPolarHBondContact O-CG 3.21Å; G192-M195 PolarHBondContact O-N 3.48Å; G192-M195 VanDerWaalsContact O-N 3.12Å
193S93.6Very high83.5Confident39 Ų3963.9 Ų63.927%0.27335%0.353SS..Hα-helixtrans-64.8-26.9178.181.60000113.2C189 V190 A191 M195C189-S193 PolarHBondContact O-N 3.21Å; V190-S193 WeakPolarHBondContact O-CB 3.16Å; V190-S193 PolarHBondContact O-N 3.27Å; V190-S193 VanDerWaalsContact O-N 3.08Å; V190-S193 PolarHBondContact O-OG 3.17Å; A191-S193 VanDerWaalsContact C-N 3.33Å; A191-S193 PolarHBondContact O-N 3.03Å; S193-M195 PolarHBondContact O-N 3.19Å
194L93.1Very high81.1Confident42 Ų4268 Ų6822%0.2237%0.373CS..THydrogen-bonded Turntrans-70.3-16.3176.7-61174.4000112.8W18 A191 G192 R196W18-L194 HydrophobicContact CZ2-CD2 4.43Å; W18-L194 PolarHBondContact NE1-O 2.82Å; A191-L194 WeakPolarHBondContact O-CB 3.38Å; A191-L194 PolarHBondContact O-N 3.26Å; G192-L194 PolarHBondContact O-N 3.41Å; L194-R196 PolarHBondContact O-N 3.3Å
195M89.3Confident78.8Confident0 Ų070 Ų700%040%0.397CS..  trans-77.168.1-175.4-59.4-6517700112.2V22 A26 R86 M89 A131 M134 G192 S193 P197V22-M195 HydrophobicContact CB-SD 4.34Å; V22-M195 HydrophobicContact CG1-CE 4.46Å; V22-M195 HydrophobicContact CG1-SD 3.71Å; V22-M195 HydrophobicContact CG2-SD 4.28Å; A26-M195 HydrophobicContact CB-CE 4.11Å; R86-M195 HydrophobicContact CB-CB 4.47Å; M89-M195 HydrophobicContact CE-CE 3.86Å; M89-M195 HydrophobicContact CE-CG 4.25Å; M89-M195 HydrophobicContact SD-CB 4.49Å; M89-M195 HydrophobicContact SD-CE 4.05Å; M89-M195 HydrophobicContact SD-CG 3.58Å; M89-M195 VanDerWaalsContact SD-CG 3.58Å; M89-M195 HydrophobicContact SD-SD 4.33Å; A131-M195 HydrophobicContact CB-CE 4.2Å; M134-M195 HydrophobicContact CB-SD 3.76Å; M134-M195 HydrophobicContact CE-CB 4.45Å; M134-M195 HydrophobicContact CG-CB 4.22Å; M134-M195 HydrophobicContact CG-CG 4.46Å; M134-M195 HydrophobicContact CG-SD 3.98Å; G192-M195 VanDerWaalsContact O-CB 3.25Å; G192-M195 WeakPolarHBondContact O-CB 3.43Å; G192-M195 WeakPolarHBondContact O-CG 3.21Å; G192-M195 PolarHBondContact O-N 3.48Å; G192-M195 VanDerWaalsContact O-N 3.12Å; S193-M195 PolarHBondContact O-N 3.19Å; M195-P197 WeakPolarHBondContact O-CD 3.25Å
196R87.9Confident76.2Confident154 Ų15478.3 Ų78.358%0.58144%0.436SS*.  trans-64.5120.2180-179.6178.7-175.7179.72.2110.1M134 Y138 L194M134-R196 WeakPolarHBondContact CE-O 3.37Å; Y138-R196 WeakPolarHBondContact CE2-O 3.28Å; Y138-R196 WeakPolarHBondContact OH-CB 3.42Å; Y138-R196 PolarHBondContact OH-O 3.44Å; L194-R196 PolarHBondContact O-N 3.3Å
197P82.4Confident73.5Confident97 Ų9784.7 Ų84.763%0.6346%0.461SS*.  trans-66137.8178.127.6-33.4000110.1M195M195-P197 WeakPolarHBondContact O-CD 3.25Å
198I79.4Confident70.8Confident39 Ų3986.7 Ų86.720%0.248%0.476CS..  trans-134.9149-177.341.1157.8000108.7Y11 M134 K137 Y138Y11-I198 HydrophobicContact CE1-CD1 4.36Å; Y11-I198 HydrophobicContact CE2-CB 4.22Å; Y11-I198 WeakPolarHBondContact OH-CD1 3.42Å; M134-I198 HydrophobicContact CE-CG1 4.49Å; K137-I198 VanDerWaalsContact C-CD1 3.49Å; K137-I198 HydrophobicContact CB-CD1 3.66Å; K137-I198 HydrophobicContact CB-CG1 4.21Å; K137-I198 VanDerWaalsContact O-CD1 3.32Å; K137-I198 WeakPolarHBondContact O-CD1 3.36Å; Y138-I198 HydrophobicContact CD1-CD1 3.98Å; Y138-I198 HydrophobicContact CD2-CD1 3.3Å; Y138-I198 HydrophobicContact CD2-CG1 4.03Å; Y138-I198 HydrophobicContact CE1-CD1 4.03Å; Y138-I198 HydrophobicContact CE1-CG2 4.2Å; Y138-I198 HydrophobicContact CE2-CD1 3.32Å; Y138-I198 HydrophobicContact CE2-CG1 3.54Å; Y138-I198 HydrophobicContact CE2-CG2 4.28Å; Y138-I198 HydrophobicContact CG-CD1 3.63Å; Y138-I198 WeakPolarHBondContact OH-CG2 3.49Å
199G68.1Low68.3Low40 Ų4093.7 Ų93.741%0.41252%0.519SS..SBendtrans93.3174.1-17400000113.4K201G199-K201 PolarHBondContact O-N 2.59Å
200P59.7Low65.9Low108 Ų10899.7 Ų99.770%0.70154%0.544SS*.SBendtrans-55.4137.8176.8-18.529.3000109.8
201K58.1Low63.5Low189 Ų189107.6 Ų107.682%0.82257%0.565SS**PPolyproline II helixtrans-51.8134.1168.2-71.1-177.7-179.8177.80107.1G199 K203G199-K201 PolarHBondContact O-N 2.59Å; K201-K203 PolarHBondContact O-N 3.01Å
202P56.1Low61.4Low99 Ų99114.1 Ų114.164%0.64359%0.593SS**PPolyproline II helixtrans-51.6116.3173.419.4-28.1000106.5
203K47.2Very low59.5Low189 Ų189116.9 Ų116.982%0.82261%0.612SS**PPolyproline II helixtrans-53.8133.6176.6-74.7-176177.3-177.10105.6K201 A205K201-K203 PolarHBondContact O-N 3.01Å; K203-A205 PolarHBondContact O-N 2.9Å
204P44.5Very low57.8Low121 Ų121121.6 Ų121.679%0.78663%0.633SS**PPolyproline II helixtrans-50.9123.6164.8-6.616.6000104.8E206P204-E206 PolarHBondContact O-N 3.08Å
205A47Very low55.9Low91 Ų91126 Ų12675%0.75266%0.656SS**PPolyproline II helixtrans-47119.7177.200000106.4K203 K207K203-A205 PolarHBondContact O-N 2.9Å; A205-K207 PolarHBondContact O-N 3.3Å; A205-K207 VanDerWaalsContact O-N 3.07Å
206E39.1Very low54.4Low177 Ų177131 Ų13183%0.82768%0.679SS**PPolyproline II helixtrans-46.9126.7166-90.2175.816200105.1P204 T208P204-E206 PolarHBondContact O-N 3.08Å; E206-T208 PolarHBondContact O-N 3.36Å; E206-T208 PolarHBondContact O-OG1 2.93Å
207K38.1Very low53Low202 Ų202126.1 Ų126.188%0.87867%0.667SS**  trans-64.675.1175.2-72.2179.1177.7177.20107.2A205 T209A205-K207 PolarHBondContact O-N 3.3Å; A205-K207 VanDerWaalsContact O-N 3.07Å; K207-T209 PolarHBondContact O-N 3.4Å
208T38.3Very low51.9Low121 Ų121125.5 Ų125.574%0.74266%0.657SS**  trans-63.9120.2154.3-1.80000104.1E206 E210E206-T208 PolarHBondContact O-N 3.36Å; E206-T208 PolarHBondContact O-OG1 2.93Å; T208-E210 PolarHBondContact O-N 3.39Å
209T39.6Very low50.9Low147 Ų147127.9 Ų127.990%0.90267%0.67SS**SBendtrans-68.541-172.5-35.10000112.5K207K207-T209 PolarHBondContact O-N 3.4Å
210E44.4Very low50.4Low152 Ų152129.6 Ų129.671%0.7168%0.676SS**  trans-118.2106.1168.1-71.8-167.2167.400107.6T208 K212T208-E210 PolarHBondContact O-N 3.39Å; E210-K212 PolarHBondContact O-N 3.39Å
211R42Very low50.4Low251 Ų251128.3 Ų128.395%0.94766%0.66SS**  trans-58.495.4160.8-89.4-177.4172.5177-1.4106.6S213R211-S213 PolarHBondContact O-N 3.1Å
212K49.4Very low50.7Low139 Ų139120.7 Ų120.760%0.60463%0.628SS**  trans-55.9119.9167.2-73.2-172.4179.6-177.50106.8E210 Q216E210-K212 PolarHBondContact O-N 3.39Å; K212-Q216 VanDerWaalsContact CA-OE1 3.29Å; K212-Q216 HydrophobicContact CB-CB 4.15Å
213S52.9Low51.6Low58 Ų58117.7 Ų117.741%0.40661%0.606SS.*  trans-54.3149.4174.9171.50000108.8R211 L215 Q216 T217R211-S213 PolarHBondContact O-N 3.1Å; S213-L215 PolarHBondContact O-N 2.88Å; S213-L215 PolarHBondContact OG-N 3.26Å; S213-Q216 VanDerWaalsContact N-OE1 3.15Å; S213-Q216 WeakPolarHBondContact O-CA 3.41Å; S213-Q216 WeakPolarHBondContact O-CB 3.36Å; S213-Q216 PolarHBondContact O-N 2.74Å; S213-T217 PolarHBondContact O-N 3.09Å
214I58.2Low53Low137 Ų137112.9 Ų112.970%0.70359%0.589SS**Hα-helixtrans-49.6-35.8173.6-63.1170.4000109.8T217 I218I214-T217 PolarHBondContact O-N 3.29Å; I214-I218 HydrophobicContact CG2-CD1 3.78Å; I214-I218 HydrophobicContact CG2-CG1 4.4Å; I214-I218 WeakPolarHBondContact O-CB 3.27Å; I214-I218 WeakPolarHBondContact O-CG1 3.47Å; I214-I218 PolarHBondContact O-N 3.48Å
215L53.3Low54.8Low135 Ų135110.3 Ų110.371%0.70757%0.571SS**Hα-helixtrans-63.6-38.2172.6-92.5113.8000114.4S213 I218 N219S213-L215 PolarHBondContact O-N 2.88Å; S213-L215 PolarHBondContact OG-N 3.26Å; L215-I218 PolarHBondContact O-N 2.96Å; L215-N219 WeakPolarHBondContact O-CB 3.5Å; L215-N219 PolarHBondContact O-N 3.34Å
216Q57.8Low56.5Low105 Ų105106 Ų10649%0.49154%0.536SS..Hα-helixtrans-72.9-34.2176.9-77.5172.9-27.900111.9K212 S213 S220K212-Q216 VanDerWaalsContact CA-OE1 3.29Å; K212-Q216 HydrophobicContact CB-CB 4.15Å; S213-Q216 VanDerWaalsContact N-OE1 3.15Å; S213-Q216 WeakPolarHBondContact O-CA 3.41Å; S213-Q216 WeakPolarHBondContact O-CB 3.36Å; S213-Q216 PolarHBondContact O-N 2.74Å; Q216-S220 PolarHBondContact O-N 3.41Å
217T58.4Low58.7Low51 Ų51101.1 Ų101.131%0.31351%0.512SS..Hα-helixtrans-65.1-46.1170.3-530000110.3S213 I214 N219 S220 F221S213-T217 PolarHBondContact O-N 3.09Å; I214-T217 PolarHBondContact O-N 3.29Å; T217-N219 PolarHBondContact O-N 3.46Å; T217-S220 PolarHBondContact O-N 3.3Å; T217-S220 PolarHBondContact O-OG 2.91Å; T217-F221 HydrophobicContact CG2-CD2 3.98Å; T217-F221 HydrophobicContact CG2-CE2 3.78Å; T217-F221 WeakPolarHBondContact O-CD2 3.06Å; T217-F221 PolarHBondContact O-N 3.19Å
218I59.1Low60.9Low85 Ų85100 Ų10044%0.43651%0.507SS..Hα-helixtrans-60.6-45.2175.2-69.3167.9000110.8I214 L215 S220 F221 L222I214-I218 HydrophobicContact CG2-CD1 3.78Å; I214-I218 HydrophobicContact CG2-CG1 4.4Å; I214-I218 WeakPolarHBondContact O-CB 3.27Å; I214-I218 WeakPolarHBondContact O-CG1 3.47Å; I214-I218 PolarHBondContact O-N 3.48Å; L215-I218 PolarHBondContact O-N 2.96Å; I218-S220 VanDerWaalsContact C-N 3.29Å; I218-S220 PolarHBondContact O-N 2.84Å; I218-F221 CarbonylContact O-C 3.59Å; I218-F221 PolarHBondContact O-N 3.16Å; I218-L222 HydrophobicContact CG2-CD1 3.76Å; I218-L222 HydrophobicContact CG2-CG 4.31Å; I218-L222 WeakPolarHBondContact O-CB 3.48Å; I218-L222 PolarHBondContact O-N 3.5Å
219N57.8Low63.2Low88 Ų8898.3 Ų98.347%0.47149%0.49SS..Hα-helixtrans-68.6-25.2179.7-162.235.9000112.9L215 T217 F221L215-N219 WeakPolarHBondContact O-CB 3.5Å; L215-N219 PolarHBondContact O-N 3.34Å; T217-N219 PolarHBondContact O-N 3.46Å; N219-F221 VanDerWaalsContact C-N 3.34Å
220S58Low65.5Low77 Ų7798.6 Ų98.654%0.53848%0.475SS..Hα-helixtrans-75.5-24.2171.280.30000113Q216 T217 I218Q216-S220 PolarHBondContact O-N 3.41Å; T217-S220 PolarHBondContact O-N 3.3Å; T217-S220 PolarHBondContact O-OG 2.91Å; I218-S220 VanDerWaalsContact C-N 3.29Å; I218-S220 PolarHBondContact O-N 2.84Å
221F58.6Low67.5Low81 Ų8191.4 Ų91.436%0.35544%0.441SS..Hα-helixtrans-93.9-30.9176.9-76.8-68.5000113.2I78 T217 I218 N219I78-F221 HydrophobicContact CG1-CE2 4.39Å; T217-F221 HydrophobicContact CG2-CD2 3.98Å; T217-F221 HydrophobicContact CG2-CE2 3.78Å; T217-F221 WeakPolarHBondContact O-CD2 3.06Å; T217-F221 PolarHBondContact O-N 3.19Å; I218-F221 CarbonylContact O-C 3.59Å; I218-F221 PolarHBondContact O-N 3.16Å; N219-F221 VanDerWaalsContact C-N 3.34Å
222L66Low69.8Low28 Ų2879.4 Ų79.415%0.14740%0.396CS..SBendtrans-115.991.7179.6-60.3-178.5000107.4I218 L224 L362 I365I218-L222 HydrophobicContact CG2-CD1 3.76Å; I218-L222 HydrophobicContact CG2-CG 4.31Å; I218-L222 WeakPolarHBondContact O-CB 3.48Å; I218-L222 PolarHBondContact O-N 3.5Å; L222-L224 VanDerWaalsContact C-N 3.26Å; L222-L224 PolarHBondContact O-N 3.44Å; L222-L362 HydrophobicContact CB-CD2 3.88Å; L222-L362 HydrophobicContact CB-CG 4.24Å; L222-L362 HydrophobicContact CD1-CD2 4.22Å; L222-L362 HydrophobicContact CD2-CD2 3.89Å; L222-L362 HydrophobicContact CD2-CG 3.92Å; L222-L362 HydrophobicContact CG-CD2 4.21Å; L222-I365 HydrophobicContact CD1-CD1 3.74Å; L222-I365 HydrophobicContact CD2-CD1 3.77Å; L222-I365 HydrophobicContact CG-CD1 4.4Å
223D73.1Confident71.7Confident36 Ų3676.1 Ų76.119%0.19339%0.385CS..  trans-6687.4175.4178.87.9000109.5T225 L226 R355D223-T225 VanDerWaalsContact CG-OG1 3.23Å; D223-T225 PolarHBondContact O-N 3.48Å; D223-T225 VanDerWaalsContact OD1-CB 3.24Å; D223-T225 WeakPolarHBondContact OD1-CB 3.44Å; D223-T225 VanDerWaalsContact OD1-CG2 3.31Å; D223-T225 WeakPolarHBondContact OD1-CG2 3.49Å; D223-T225 PolarHBondContact OD1-N 3.34Å; D223-T225 VanDerWaalsContact OD1-N 3.14Å; D223-T225 PolarHBondContact OD1-OG1 3.41Å; D223-T225 PolarHBondContact OD2-OG1 2.69Å; D223-L226 HydrophobicContact CB-CD1 4.06Å; D223-L226 VanDerWaalsContact O-CB 3.27Å; D223-L226 WeakPolarHBondContact O-CB 3.24Å; D223-L226 WeakPolarHBondContact O-CD1 3.49Å; D223-L226 WeakPolarHBondContact O-CG 3.46Å; D223-L226 PolarHBondContact O-N 2.93Å; D223-R355 IonicContact OD2-NH1 2.72Å
224L77.4Confident73.5Confident89 Ų8975.1 Ų75.147%0.46638%0.375SS..G310 helixtrans-62.8-12.2-178.1-64.1178.8000112.5L222 L226 F227 L362L222-L224 VanDerWaalsContact C-N 3.26Å; L222-L224 PolarHBondContact O-N 3.44Å; L224-L226 PolarHBondContact O-N 3.41Å; L224-F227 HydrophobicContact CD2-CD2 4.03Å; L224-F227 HydrophobicContact CD2-CE2 3.75Å; L224-F227 PolarHBondContact O-N 2.8Å; L224-F227 VanDerWaalsContact O-N 3.14Å; L224-L362 HydrophobicContact CD2-CD2 4.2Å
225T81.6Confident75.1Confident66 Ų6668.7 Ų68.741%0.40534%0.342SS..G310 helixtrans-64.2-19.4172.177.80000112.2D223 F227 K228 R355D223-T225 VanDerWaalsContact CG-OG1 3.23Å; D223-T225 PolarHBondContact O-N 3.48Å; D223-T225 VanDerWaalsContact OD1-CB 3.24Å; D223-T225 WeakPolarHBondContact OD1-CB 3.44Å; D223-T225 VanDerWaalsContact OD1-CG2 3.31Å; D223-T225 WeakPolarHBondContact OD1-CG2 3.49Å; D223-T225 PolarHBondContact OD1-N 3.34Å; D223-T225 VanDerWaalsContact OD1-N 3.14Å; D223-T225 PolarHBondContact OD1-OG1 3.41Å; D223-T225 PolarHBondContact OD2-OG1 2.69Å; T225-F227 PolarHBondContact O-N 3.22Å; T225-K228 WeakPolarHBondContact O-CB 3.35Å; T225-K228 PolarHBondContact O-N 2.94Å; T225-R355 PolarHBondContact OG1-NH1 2.86Å
226L83.3Confident76.9Confident2 Ų262.4 Ų62.41%0.0131%0.309CS..G310 helixtrans-58.6-30.4172.3-78.3157.9000112.9D223 L224 K228 H229 F232 V351 R355 A359 L362D223-L226 HydrophobicContact CB-CD1 4.06Å; D223-L226 VanDerWaalsContact O-CB 3.27Å; D223-L226 WeakPolarHBondContact O-CB 3.24Å; D223-L226 WeakPolarHBondContact O-CD1 3.49Å; D223-L226 WeakPolarHBondContact O-CG 3.46Å; D223-L226 PolarHBondContact O-N 2.93Å; L224-L226 PolarHBondContact O-N 3.41Å; L226-K228 PolarHBondContact O-N 3.13Å; L226-H229 VanDerWaalsContact O-CB 3.28Å; L226-H229 WeakPolarHBondContact O-CB 3.37Å; L226-H229 PolarHBondContact O-N 3.36Å; L226-F232 HydrophobicContact CB-CD1 3.9Å; L226-F232 HydrophobicContact CB-CE1 3.87Å; L226-F232 HydrophobicContact CB-CG 4.45Å; L226-F232 HydrophobicContact CB-CZ 4.41Å; L226-F232 HydrophobicContact CD2-CG 4.47Å; L226-F232 VanDerWaalsContact O-CD1 3.26Å; L226-F232 WeakPolarHBondContact O-CD1 3.29Å; L226-V351 HydrophobicContact CD2-CB 4.38Å; L226-V351 HydrophobicContact CD2-CG1 3.47Å; L226-V351 VanDerWaalsContact CD2-CG1 3.47Å; L226-V351 HydrophobicContact CD2-CG2 3.97Å; L226-R355 HydrophobicContact CD2-CB 4.48Å; L226-A359 HydrophobicContact CD1-CB 3.94Å; L226-A359 HydrophobicContact CD2-CB 4.29Å; L226-L362 HydrophobicContact CB-CD1 4.02Å; L226-L362 HydrophobicContact CD1-CD1 3.75Å
227F85.9Confident78.6Confident73 Ų7361.2 Ų61.232%0.3230%0.304SS..G310 helixtrans-67.5-16.2175.4-71.9-69.5000113.7L224 T225 H229 F232 L233 L362 M366L224-F227 HydrophobicContact CD2-CD2 4.03Å; L224-F227 HydrophobicContact CD2-CE2 3.75Å; L224-F227 PolarHBondContact O-N 2.8Å; L224-F227 VanDerWaalsContact O-N 3.14Å; T225-F227 PolarHBondContact O-N 3.22Å; F227-H229 VanDerWaalsContact C-N 3.33Å; F227-F232 HydrophobicContact CD1-CE1 4.48Å; F227-F232 HydrophobicContact CE1-CE1 4.42Å; F227-L233 HydrophobicContact CD1-CD1 4.15Å; F227-L362 HydrophobicContact CE2-CD1 4.27Å; F227-L362 HydrophobicContact CE2-CD2 3.83Å; F227-L362 HydrophobicContact CZ-CD2 4.13Å; F227-M366 HydrophobicContact CE1-SD 3.67Å; F227-M366 HydrophobicContact CZ-SD 3.69Å
228K84.1Confident80.2Confident180 Ų18058.8 Ų58.878%0.78329%0.289SS*.G310 helixtrans-81.6-15.5171-59.5-176.1177.8-177.90112.3T225 L226 R230T225-K228 WeakPolarHBondContact O-CB 3.35Å; T225-K228 PolarHBondContact O-N 2.94Å; L226-K228 PolarHBondContact O-N 3.13Å; K228-R230 PolarHBondContact O-N 3.44Å
229H85.9Confident81.7Confident84 Ų8454.7 Ų54.739%0.38927%0.268SS..  trans-79.3110.6-179.8-168.8-94.9000110.3L226 F227 G231 F232 L233 L350L226-H229 VanDerWaalsContact O-CB 3.28Å; L226-H229 WeakPolarHBondContact O-CB 3.37Å; L226-H229 PolarHBondContact O-N 3.36Å; F227-H229 VanDerWaalsContact C-N 3.33Å; H229-G231 VanDerWaalsContact C-N 3.33Å; H229-G231 PolarHBondContact O-N 2.9Å; H229-F232 HydrophobicContact CB-CB 4Å; H229-F232 PolarHBondContact ND1-N 3.18Å; H229-F232 PolarHBondContact O-N 3.02Å; H229-L233 PolarHBondContact O-N 3.43Å; H229-L350 PolarHBondContact CE1-O 3.35Å
230R87.6Confident83.4Confident153 Ų15352.2 Ų52.258%0.57726%0.256SS*.Hα-helixtrans-53.1-47.8-173.8-62.2177.4-176.5155.80.2112.7K228 F232 L233 L234 E420K228-R230 PolarHBondContact O-N 3.44Å; R230-F232 VanDerWaalsContact C-N 3.35Å; R230-F232 PolarHBondContact O-N 3.37Å; R230-L233 PolarHBondContact O-N 3.35Å; R230-L234 WeakPolarHBondContact O-CG 3.39Å; R230-L234 PolarHBondContact O-N 3.37Å; R230-L234 VanDerWaalsContact O-N 3.11Å; R230-E420 IonicContact NH1-OE1 3.54Å; R230-E420 PolarHBondContact NH1-OE1 3Å
231G87.3Confident85Confident1 Ų151.4 Ų51.41%0.0125%0.248CC..Hα-helixtrans-59.1-46.9178.500000111.8H229 L233 L234 Y235 L350H229-G231 VanDerWaalsContact C-N 3.33Å; H229-G231 PolarHBondContact O-N 2.9Å; G231-L233 VanDerWaalsContact C-N 3.32Å; G231-L233 PolarHBondContact O-N 3.41Å; G231-L234 PolarHBondContact O-N 3.2Å; G231-Y235 WeakPolarHBondContact O-CB 3.45Å; G231-Y235 PolarHBondContact O-N 3.37Å; G231-L350 VanDerWaalsContact C-CD2 3.41Å; G231-L350 WeakPolarHBondContact O-CD2 3.17Å
232F89.4Confident86.7Confident0 Ų047.6 Ų47.60%023%0.231CC..Hα-helixtrans-63.7-39.3-178.3178.6-102.3000111.6L226 F227 H229 R230 Y235 I236 L347 V351 A359 L362 V363L226-F232 HydrophobicContact CB-CD1 3.9Å; L226-F232 HydrophobicContact CB-CE1 3.87Å; L226-F232 HydrophobicContact CB-CG 4.45Å; L226-F232 HydrophobicContact CB-CZ 4.41Å; L226-F232 HydrophobicContact CD2-CG 4.47Å; L226-F232 VanDerWaalsContact O-CD1 3.26Å; L226-F232 WeakPolarHBondContact O-CD1 3.29Å; F227-F232 HydrophobicContact CD1-CE1 4.48Å; F227-F232 HydrophobicContact CE1-CE1 4.42Å; H229-F232 HydrophobicContact CB-CB 4Å; H229-F232 PolarHBondContact ND1-N 3.18Å; H229-F232 PolarHBondContact O-N 3.02Å; R230-F232 VanDerWaalsContact C-N 3.35Å; R230-F232 PolarHBondContact O-N 3.37Å; F232-Y235 PolarHBondContact O-N 2.94Å; F232-I236 HydrophobicContact CE1-CD1 3.98Å; F232-I236 HydrophobicContact CE2-CD1 4.48Å; F232-I236 HydrophobicContact CZ-CD1 3.71Å; F232-I236 PolarHBondContact O-N 3.5Å; F232-L347 HydrophobicContact CD2-CD1 3.89Å; F232-L347 HydrophobicContact CE2-CD1 3.88Å; F232-V351 HydrophobicContact CB-CG2 4.2Å; F232-V351 HydrophobicContact CD2-CG2 3.67Å; F232-V351 HydrophobicContact CG-CG2 4.28Å; F232-A359 HydrophobicContact CD2-CB 4.47Å; F232-A359 HydrophobicContact CE2-CB 3.89Å; F232-L362 HydrophobicContact CZ-CB 4.12Å; F232-L362 HydrophobicContact CZ-CD1 4.45Å; F232-V363 HydrophobicContact CE2-CG2 3.73Å; F232-V363 HydrophobicContact CZ-CG2 4.02Å
233L90.7Very high87.9Confident69 Ų6946.5 Ų46.536%0.36123%0.226SC..Hα-helixtrans-63.9-43.8176.5-164.371.9000111.8F227 H229 R230 G231 Y235 I236 M237F227-L233 HydrophobicContact CD1-CD1 4.15Å; H229-L233 PolarHBondContact O-N 3.43Å; R230-L233 PolarHBondContact O-N 3.35Å; G231-L233 VanDerWaalsContact C-N 3.32Å; G231-L233 PolarHBondContact O-N 3.41Å; L233-Y235 VanDerWaalsContact C-N 3.32Å; L233-Y235 PolarHBondContact O-N 2.88Å; L233-I236 HydrophobicContact CD1-CG2 4.48Å; L233-I236 WeakPolarHBondContact O-CG2 3.38Å; L233-I236 PolarHBondContact O-N 3.32Å; L233-M237 HydrophobicContact CD2-CE 4.42Å; L233-M237 HydrophobicContact CG-CE 4.04Å; L233-M237 HydrophobicContact CG-SD 4.5Å; L233-M237 WeakPolarHBondContact O-CB 3.42Å; L233-M237 WeakPolarHBondContact O-CE 3.13Å; L233-M237 VanDerWaalsContact O-CG 3.25Å; L233-M237 WeakPolarHBondContact O-CG 3.17Å; L233-M237 PolarHBondContact O-N 3.46Å
234L90.9Very high88.7Confident38 Ų3847.9 Ų47.920%0.19923%0.23CC..Hα-helixtrans-62.4-41.5175.3-70168.3000111.9R230 G231 M237 G238 F405 G409 M410 N413R230-L234 WeakPolarHBondContact O-CG 3.39Å; R230-L234 PolarHBondContact O-N 3.37Å; R230-L234 VanDerWaalsContact O-N 3.11Å; G231-L234 PolarHBondContact O-N 3.2Å; L234-M237 HydrophobicContact CD2-CE 3.9Å; L234-M237 HydrophobicContact CG-CE 4.48Å; L234-G238 PolarHBondContact O-N 3.14Å; L234-G238 VanDerWaalsContact O-N 3.14Å; L234-F405 HydrophobicContact CD2-CZ 4.38Å; L234-G409 WeakPolarHBondContact CD1-O 3.47Å; L234-M410 HydrophobicContact CB-CE 4Å; L234-N413 HydrophobicContact CD1-CB 4.24Å
235Y91.6Very high89.3Confident1 Ų143.7 Ų43.70%0.00421%0.208CC..Hα-helixtrans-62.5-49.2177.4177-92.7000111.7G231 F232 L233 G238 N239 F302 L343 T346 L347 L350 V363 M410G231-Y235 WeakPolarHBondContact O-CB 3.45Å; G231-Y235 PolarHBondContact O-N 3.37Å; F232-Y235 PolarHBondContact O-N 2.94Å; L233-Y235 VanDerWaalsContact C-N 3.32Å; L233-Y235 PolarHBondContact O-N 2.88Å; Y235-G238 PolarHBondContact O-N 3.47Å; Y235-N239 WeakPolarHBondContact CE1-ND2 3.41Å; Y235-N239 WeakPolarHBondContact O-CB 3.28Å; Y235-N239 PolarHBondContact O-N 3.31Å; Y235-N239 PolarHBondContact OH-ND2 2.9Å; Y235-F302 HydrophobicContact CE2-CE1 4.14Å; Y235-F302 HydrophobicContact CE2-CZ 4.49Å; Y235-L343 VanDerWaalsContact OH-CD1 3.25Å; Y235-L343 WeakPolarHBondContact OH-CD1 3.31Å; Y235-L343 PolarHBondContact OH-O 2.85Å; Y235-T346 HydrophobicContact CD2-CG2 4.11Å; Y235-T346 HydrophobicContact CE2-CG2 3.97Å; Y235-L347 HydrophobicContact CD1-CD1 4.09Å; Y235-L347 HydrophobicContact CE1-CB 4.25Å; Y235-L347 HydrophobicContact CE1-CD1 3.86Å; Y235-L347 HydrophobicContact CE1-CG 4.47Å; Y235-L350 HydrophobicContact CD2-CD2 4.38Å; Y235-L350 HydrophobicContact CG-CD2 4Å; Y235-V363 HydrophobicContact CE1-CG2 4.15Å; Y235-M410 HydrophobicContact CD2-CE 4.44Å
236I91.4Very high89.7Confident4 Ų440.7 Ų40.72%0.02119%0.19CC..Hα-helixtrans-69.4-37.6-176.2-154.2154.2000112F232 L233 G238 N239 V240 V363 M366F232-I236 HydrophobicContact CE1-CD1 3.98Å; F232-I236 HydrophobicContact CE2-CD1 4.48Å; F232-I236 HydrophobicContact CZ-CD1 3.71Å; F232-I236 PolarHBondContact O-N 3.5Å; L233-I236 HydrophobicContact CD1-CG2 4.48Å; L233-I236 WeakPolarHBondContact O-CG2 3.38Å; L233-I236 PolarHBondContact O-N 3.32Å; I236-G238 PolarHBondContact O-N 3.07Å; I236-N239 PolarHBondContact O-N 3.45Å; I236-V240 WeakPolarHBondContact O-CB 3.4Å; I236-V240 VanDerWaalsContact O-CG2 3.27Å; I236-V240 WeakPolarHBondContact O-CG2 3.35Å; I236-V240 PolarHBondContact O-N 3.3Å; I236-V363 HydrophobicContact CD1-CG2 3.93Å; I236-V363 HydrophobicContact CG1-CG2 4.45Å; I236-M366 HydrophobicContact CD1-CB 4.16Å; I236-M366 HydrophobicContact CD1-CE 4.14Å; I236-M366 HydrophobicContact CD1-CG 4.1Å; I236-M366 HydrophobicContact CD1-SD 3.21Å; I236-M366 WeakPolarHBondContact CD1-SD 3.21Å; I236-M366 HydrophobicContact CG1-CB 4.32Å; I236-M366 HydrophobicContact CG1-CE 4.01Å; I236-M366 HydrophobicContact CG1-SD 3.76Å; I236-M366 HydrophobicContact CG2-CE 4.39Å
237M91.7Very high89.9Confident79 Ų7941 Ų4139%0.38919%0.191SC..Hα-helixtrans-60.9-45.5174.1-73.4-174.4-64.400111.3L233 L234 V241 F405L233-M237 HydrophobicContact CD2-CE 4.42Å; L233-M237 HydrophobicContact CG-CE 4.04Å; L233-M237 HydrophobicContact CG-SD 4.5Å; L233-M237 WeakPolarHBondContact O-CB 3.42Å; L233-M237 WeakPolarHBondContact O-CE 3.13Å; L233-M237 VanDerWaalsContact O-CG 3.25Å; L233-M237 WeakPolarHBondContact O-CG 3.17Å; L233-M237 PolarHBondContact O-N 3.46Å; L234-M237 HydrophobicContact CD2-CE 3.9Å; L234-M237 HydrophobicContact CG-CE 4.48Å; M237-V241 WeakPolarHBondContact O-CG2 3.18Å; M237-V241 PolarHBondContact O-N 3.27Å; M237-F405 HydrophobicContact CB-CE1 3.84Å; M237-F405 HydrophobicContact CB-CZ 4.07Å; M237-F405 HydrophobicContact CE-CZ 3.99Å; M237-F405 HydrophobicContact SD-CZ 4.48Å
238G92.5Very high90Very high0 Ų037.6 Ų37.60%018%0.176CC..Hα-helixtrans-63.8-46.3175.600000112.3L234 Y235 I236 V240 V241 M242 S402L234-G238 PolarHBondContact O-N 3.14Å; L234-G238 VanDerWaalsContact O-N 3.14Å; Y235-G238 PolarHBondContact O-N 3.47Å; I236-G238 PolarHBondContact O-N 3.07Å; G238-V240 VanDerWaalsContact C-N 3.33Å; G238-V240 PolarHBondContact O-N 3.46Å; G238-V241 PolarHBondContact O-N 2.98Å; G238-M242 WeakPolarHBondContact O-CB 3.42Å; G238-M242 PolarHBondContact O-N 3.24Å; G238-S402 PolarHBondContact O-OG 3.25Å
239N91.5Very high90.4Very high0 Ų029 Ų290%014%0.138CC..Hα-helixtrans-60.9-40.5179-81.714.9000112.8Y235 I236 V241 M242 L243Y235-N239 WeakPolarHBondContact CE1-ND2 3.41Å; Y235-N239 WeakPolarHBondContact O-CB 3.28Å; Y235-N239 PolarHBondContact O-N 3.31Å; Y235-N239 PolarHBondContact OH-ND2 2.9Å; I236-N239 PolarHBondContact O-N 3.45Å; N239-V241 PolarHBondContact O-N 2.98Å; N239-M242 HydrophobicContact CB-CE 4.41Å; N239-M242 WeakPolarHBondContact O-CB 3.47Å; N239-M242 PolarHBondContact O-N 3.47Å; N239-L243 WeakPolarHBondContact O-CB 2.97Å; N239-L243 VanDerWaalsContact O-CG 3.28Å; N239-L243 WeakPolarHBondContact O-CG 3.19Å; N239-L243 PolarHBondContact O-N 3.38Å
240V92.2Very high90.6Very high36 Ų3625 Ų2522%0.21812%0.12CC..Hα-helixtrans-59.5-46.9177.7165.90000110.7I236 G238 L243 F244 M366 P370I236-V240 WeakPolarHBondContact O-CB 3.4Å; I236-V240 VanDerWaalsContact O-CG2 3.27Å; I236-V240 WeakPolarHBondContact O-CG2 3.35Å; I236-V240 PolarHBondContact O-N 3.3Å; G238-V240 VanDerWaalsContact C-N 3.33Å; G238-V240 PolarHBondContact O-N 3.46Å; V240-L243 PolarHBondContact O-N 3.27Å; V240-F244 HydrophobicContact CG1-CE2 4.33Å; V240-F244 VanDerWaalsContact O-CD2 3.23Å; V240-F244 WeakPolarHBondContact O-CD2 3.26Å; V240-M366 HydrophobicContact CG2-CB 4.38Å; V240-M366 HydrophobicContact CG2-CE 4.32Å; V240-P370 HydrophobicContact CB-CG 4.31Å; V240-P370 HydrophobicContact CG1-CG 3.79Å; V240-P370 WeakPolarHBondContact O-CG 3.13Å
241V93.3Very high90.6Very high59 Ų5917.9 Ų17.936%0.3589%0.093SC..Hα-helixtrans-65.7-45.8177.5-179.90000111.1M237 G238 N239 L243 F244 V398M237-V241 WeakPolarHBondContact O-CG2 3.18Å; M237-V241 PolarHBondContact O-N 3.27Å; G238-V241 PolarHBondContact O-N 2.98Å; N239-V241 PolarHBondContact O-N 2.98Å; V241-L243 VanDerWaalsContact C-N 3.3Å; V241-L243 PolarHBondContact O-N 3.45Å; V241-F244 PolarHBondContact O-N 2.99Å; V241-V398 HydrophobicContact CG1-CG1 4.15Å; V241-V398 VanDerWaalsContact O-CG1 3.27Å; V241-V398 WeakPolarHBondContact O-CG1 3.33Å
242M93.8Very high90.8Very high1 Ų117.9 Ų17.91%0.0059%0.093CC..Hα-helixtrans-53.3-46.2177.2-178.5-173.970.400112G238 N239 F244 G245 L246 F302 V306 L339 L343 L399 S402G238-M242 WeakPolarHBondContact O-CB 3.42Å; G238-M242 PolarHBondContact O-N 3.24Å; N239-M242 HydrophobicContact CB-CE 4.41Å; N239-M242 WeakPolarHBondContact O-CB 3.47Å; N239-M242 PolarHBondContact O-N 3.47Å; M242-F244 VanDerWaalsContact C-N 3.29Å; M242-F244 PolarHBondContact O-N 3.14Å; M242-G245 PolarHBondContact O-N 3.1Å; M242-L246 PolarHBondContact O-N 2.79Å; M242-L246 VanDerWaalsContact O-N 3.11Å; M242-F302 HydrophobicContact CE-CZ 4.29Å; M242-F302 HydrophobicContact SD-CZ 4Å; M242-V306 HydrophobicContact CG-CG1 3.99Å; M242-V306 HydrophobicContact CG-CG2 4.47Å; M242-V306 HydrophobicContact SD-CG1 4.18Å; M242-V306 HydrophobicContact SD-CG2 3.58Å; M242-V306 VanDerWaalsContact SD-CG2 3.58Å; M242-L339 HydrophobicContact SD-CD1 3.8Å; M242-L339 HydrophobicContact SD-CG 4.46Å; M242-L343 HydrophobicContact CE-CD1 4.23Å; M242-L399 HydrophobicContact CB-CD2 4.31Å; M242-L399 HydrophobicContact CG-CD2 3.65Å; M242-L399 WeakPolarHBondContact O-CD2 3.18Å; M242-S402 WeakPolarHBondContact CB-OG 3.4Å; M242-S402 PolarHBondContact N-OG 3.37Å
243L90.4Very high90.9Very high6 Ų617.9 Ų17.93%0.0319%0.093CC..Hα-helixtrans-68.9-23.7-172.5-76.3-173.4000114.8N239 V240 V241 G245 L246 F247 E367 P370 V371N239-L243 WeakPolarHBondContact O-CB 2.97Å; N239-L243 VanDerWaalsContact O-CG 3.28Å; N239-L243 WeakPolarHBondContact O-CG 3.19Å; N239-L243 PolarHBondContact O-N 3.38Å; V240-L243 PolarHBondContact O-N 3.27Å; V241-L243 VanDerWaalsContact C-N 3.3Å; V241-L243 PolarHBondContact O-N 3.45Å; L243-G245 PolarHBondContact O-N 3.47Å; L243-L246 HydrophobicContact CD2-CB 4.25Å; L243-L246 HydrophobicContact CD2-CD2 3.69Å; L243-F247 HydrophobicContact CD2-CD2 4.17Å; L243-F247 HydrophobicContact CD2-CE2 3.65Å; L243-E367 HydrophobicContact CD1-CB 3.3Å; L243-E367 HydrophobicContact CD1-CG 3.19Å; L243-P370 HydrophobicContact CB-CB 3.63Å; L243-P370 HydrophobicContact CB-CG 4.36Å; L243-V371 HydrophobicContact CD1-CG2 4.23Å
244F90Very high90.8Very high65 Ų6514.6 Ų14.629%0.2858%0.076SC..Hα-helixtrans-58.8-36.6170.9-83.6-81.8000111.6V240 V241 M242 P370 L373 L377 L378 V398V240-F244 HydrophobicContact CG1-CE2 4.33Å; V240-F244 VanDerWaalsContact O-CD2 3.23Å; V240-F244 WeakPolarHBondContact O-CD2 3.26Å; V241-F244 PolarHBondContact O-N 2.99Å; M242-F244 VanDerWaalsContact C-N 3.29Å; M242-F244 PolarHBondContact O-N 3.14Å; F244-P370 HydrophobicContact CD1-CB 4.49Å; F244-P370 HydrophobicContact CD2-CB 3.72Å; F244-P370 HydrophobicContact CD2-CG 4.04Å; F244-P370 HydrophobicContact CE2-CB 3.79Å; F244-P370 HydrophobicContact CE2-CG 3.72Å; F244-P370 HydrophobicContact CG-CB 4.08Å; F244-P370 HydrophobicContact CZ-CB 4.23Å; F244-P370 HydrophobicContact CZ-CG 4.29Å; F244-L373 HydrophobicContact CE1-CB 3.98Å; F244-L377 HydrophobicContact CE1-CD1 4.17Å; F244-L378 WeakPolarHBondContact O-CD1 3.42Å; F244-V398 HydrophobicContact CB-CG1 4.31Å
245G89.7Confident90.7Very high0 Ų012.8 Ų12.80%07%0.067CC..Hα-helixtrans-97.1-14.3-177.700000115.3M242 L243 P249M242-G245 PolarHBondContact O-N 3.1Å; L243-G245 PolarHBondContact O-N 3.47Å; G245-P249 WeakPolarHBondContact O-CD 3.4Å
246L90.7Very high90.7Very high4 Ų412.9 Ų12.92%0.0217%0.067CC..Hα-helixtrans-77.2-43.1-170.2-173.166000113.7M242 L243 F336 L339 L399M242-L246 PolarHBondContact O-N 2.79Å; M242-L246 VanDerWaalsContact O-N 3.11Å; L243-L246 HydrophobicContact CD2-CB 4.25Å; L243-L246 HydrophobicContact CD2-CD2 3.69Å; L246-F336 HydrophobicContact CD1-CD2 4.17Å; L246-F336 HydrophobicContact CD1-CE2 4.31Å; L246-F336 HydrophobicContact CD2-CE2 4.25Å; L246-F336 HydrophobicContact CG-CE2 4.16Å; L246-L339 HydrophobicContact CD1-CD1 3.91Å; L246-L339 HydrophobicContact CD2-CD1 4.4Å; L246-L339 HydrophobicContact CD2-CD2 3.98Å; L246-L399 HydrophobicContact CB-CD2 4.47Å
247F86.7Confident90.7Very high9 Ų912.7 Ų12.74%0.0397%0.066CC..SBendtrans-89.5-30.2-169.9-75.1-72.1000114.3L66 L243 L250 V251 V371L66-F247 HydrophobicContact CD1-CD1 4.39Å; L243-F247 HydrophobicContact CD2-CD2 4.17Å; L243-F247 HydrophobicContact CD2-CE2 3.65Å; F247-L250 WeakPolarHBondContact O-CB 3.31Å; F247-L250 PolarHBondContact O-N 2.98Å; F247-L250 VanDerWaalsContact O-N 3.14Å; F247-V251 WeakPolarHBondContact O-CG2 3.48Å; F247-V251 PolarHBondContact O-N 3.27Å; F247-V371 HydrophobicContact CD2-CG2 3.71Å; F247-V371 HydrophobicContact CE2-CG2 3.57Å
248A89.4Confident90.6Very high0 Ų010.5 Ų10.50%05%0.054CC..Hα-helixtrans-60.4-44.3-176.400000113.5L250 V251 F252 P375 L378A248-L250 PolarHBondContact O-N 3.3Å; A248-V251 PolarHBondContact O-N 3.07Å; A248-V251 VanDerWaalsContact O-N 3.17Å; A248-F252 HydrophobicContact CB-CD2 4.21Å; A248-F252 HydrophobicContact CB-CE2 4.17Å; A248-F252 WeakPolarHBondContact O-CD2 3.12Å; A248-F252 PolarHBondContact O-N 3.47Å; A248-P375 HydrophobicContact CB-CB 4.31Å; A248-P375 HydrophobicContact CB-CG 4.39Å; A248-L378 HydrophobicContact CB-CB 4.05Å; A248-L378 HydrophobicContact CB-CD1 3.55Å; A248-L378 HydrophobicContact CB-CG 4.46Å
249P91.9Very high90.5Very high0 Ų013.5 Ų13.50%08%0.075CC..Hα-helixtrans-61.7-30.8175.8-26.938.7000113.6G245 L253 H313 F332 Y392 C395G245-P249 WeakPolarHBondContact O-CD 3.4Å; P249-L253 WeakPolarHBondContact O-CB 3.44Å; P249-L253 PolarHBondContact O-N 2.81Å; P249-H313 WeakPolarHBondContact CB-CE1 3.43Å; P249-H313 WeakPolarHBondContact CB-ND1 3.32Å; P249-F332 HydrophobicContact CB-CE1 4.4Å; P249-F332 HydrophobicContact CB-CZ 4.39Å; P249-Y392 HydrophobicContact CB-CD1 3.97Å; P249-Y392 HydrophobicContact CB-CE1 3.55Å; P249-Y392 PolarHBondContact O-OH 2.89Å; P249-C395 HydrophobicContact CG-CB 3.54Å; P249-C395 VanDerWaalsContact CG-SG 3.59Å
250L90.1Very high90.4Very high1 Ų117.2 Ų17.21%0.0059%0.091CC..Hα-helixtrans-72.1-44.4175.8-169.9152.6000110.7K38 F247 A248 F332 F336K38-L250 HydrophobicContact CB-CD2 3.79Å; K38-L250 HydrophobicContact CD-CD1 4.15Å; K38-L250 HydrophobicContact CD-CD2 3.61Å; K38-L250 HydrophobicContact CG-CD2 3.46Å; K38-L250 VanDerWaalsContact CG-CD2 3.46Å; F247-L250 WeakPolarHBondContact O-CB 3.31Å; F247-L250 PolarHBondContact O-N 2.98Å; F247-L250 VanDerWaalsContact O-N 3.14Å; A248-L250 PolarHBondContact O-N 3.3Å; L250-F332 HydrophobicContact CB-CE1 4Å; L250-F332 HydrophobicContact CB-CZ 3.95Å; L250-F332 HydrophobicContact CD1-CZ 4.49Å; L250-F332 HydrophobicContact CG-CE1 4.49Å; L250-F336 HydrophobicContact CD1-CE2 4.25Å; L250-F336 HydrophobicContact CD1-CZ 4.3Å
251V87.8Confident90.3Very high2 Ų224.4 Ų24.41%0.01212%0.123CC..Hα-helixtrans-63.6-41.7179.3168.60000111.4T41 F44 F247 A248 P375T41-V251 WeakPolarHBondContact CB-O 3.25Å; T41-V251 HydrophobicContact CG2-CB 4.27Å; T41-V251 HydrophobicContact CG2-CG1 3.84Å; T41-V251 HydrophobicContact CG2-CG2 4.34Å; T41-V251 PolarHBondContact OG1-O 2.77Å; F44-V251 HydrophobicContact CD2-CG1 4.31Å; F44-V251 HydrophobicContact CE2-CG1 3.86Å; F247-V251 WeakPolarHBondContact O-CG2 3.48Å; F247-V251 PolarHBondContact O-N 3.27Å; A248-V251 PolarHBondContact O-N 3.07Å; A248-V251 VanDerWaalsContact O-N 3.17Å; V251-P375 HydrophobicContact CG2-CG 4.5Å
252F90.4Very high90.3Very high1 Ų122.3 Ų22.30%0.00411%0.109CC..Hα-helixtrans-91.1-1.2-173.9-63.2-52.2000115A248 S254 N255 Y256 P375 Y388 T391 Y392A248-F252 HydrophobicContact CB-CD2 4.21Å; A248-F252 HydrophobicContact CB-CE2 4.17Å; A248-F252 WeakPolarHBondContact O-CD2 3.12Å; A248-F252 PolarHBondContact O-N 3.47Å; F252-S254 PolarHBondContact O-N 3Å; F252-N255 PolarHBondContact O-N 3.38Å; F252-Y256 WeakPolarHBondContact O-CB 3.3Å; F252-Y256 PolarHBondContact O-N 3.45Å; F252-P375 HydrophobicContact CE2-CB 4.4Å; F252-P375 WeakPolarHBondContact CE2-O 3.44Å; F252-P375 HydrophobicContact CZ-CB 4.45Å; F252-P375 WeakPolarHBondContact CZ-O 3.47Å; F252-Y388 HydrophobicContact CB-CD1 4.08Å; F252-Y388 HydrophobicContact CB-CE1 3.74Å; F252-Y388 AromaticContact CD1-CE1 3.86Å; F252-Y388 HydrophobicContact CD1-CE1 3.86Å; F252-Y388 HydrophobicContact CG-CD1 4.39Å; F252-Y388 AromaticContact CG-CE1 3.8Å; F252-Y388 HydrophobicContact CG-CE1 3.8Å; F252-T391 HydrophobicContact CD2-CG2 4.08Å; F252-T391 HydrophobicContact CE2-CG2 4.38Å; F252-Y392 HydrophobicContact CB-CE2 4.48Å
253L92Very high90.2Very high0 Ų025.6 Ų25.60%013%0.131CC..Hα-helixtrans-56.5-51.7-174.5-179.254.2000113.8P249 N255 Y256 A257 L270 L271 L274 F325 Y328 Y392P249-L253 WeakPolarHBondContact O-CB 3.44Å; P249-L253 PolarHBondContact O-N 2.81Å; L253-N255 VanDerWaalsContact C-N 3.32Å; L253-N255 PolarHBondContact O-N 3.43Å; L253-Y256 PolarHBondContact O-N 3.27Å; L253-A257 PolarHBondContact O-N 3.02Å; L253-A257 VanDerWaalsContact O-N 3.08Å; L253-L270 HydrophobicContact CD2-CB 4.24Å; L253-L270 HydrophobicContact CG-CB 4.38Å; L253-L271 HydrophobicContact CB-CD2 4.31Å; L253-L271 HydrophobicContact CD2-CD2 4.16Å; L253-L274 HydrophobicContact CD2-CD1 3.95Å; L253-F325 HydrophobicContact CD1-CD1 4.27Å; L253-Y328 HydrophobicContact CD1-CD1 3.99Å; L253-Y328 HydrophobicContact CD1-CE1 3.72Å; L253-Y392 WeakPolarHBondContact CA-OH 3.33Å; L253-Y392 PolarHBondContact N-OH 2.93Å; L253-Y392 VanDerWaalsContact N-OH 3.16Å
254S89.3Confident90Very high0 Ų029.1 Ų29.10%015%0.146CC..Hα-helixtrans-62.8-41.217956.80000111.2F252 A257 K258F252-S254 PolarHBondContact O-N 3Å; S254-A257 PolarHBondContact O-N 3.27Å; S254-K258 WeakPolarHBondContact O-CG 3.47Å; S254-K258 PolarHBondContact O-N 3.28Å
255N88.6Confident90Very high1 Ų132.7 Ų32.71%0.00516%0.163CC..Hα-helixtrans-68.5-35.2179.1-63.8-28.3000112.4F252 L253 K258 S259 Y388F252-N255 PolarHBondContact O-N 3.38Å; L253-N255 VanDerWaalsContact C-N 3.32Å; L253-N255 PolarHBondContact O-N 3.43Å; N255-K258 PolarHBondContact O-N 3.07Å; N255-S259 WeakPolarHBondContact O-CB 3.39Å; N255-S259 PolarHBondContact O-N 3.43Å; N255-Y388 HydrophobicContact CB-CE2 4.2Å; N255-Y388 VanDerWaalsContact CB-OH 3.27Å; N255-Y388 WeakPolarHBondContact CB-OH 3.25Å
256Y91.4Very high90Very high3 Ų337.4 Ų37.41%0.01218%0.184CC..Hα-helixtrans-66.4-45.1175.6-175.7-154.7000110.9F252 L253 K258 S259 K260 F325 Y388 Y392F252-Y256 WeakPolarHBondContact O-CB 3.3Å; F252-Y256 PolarHBondContact O-N 3.45Å; L253-Y256 PolarHBondContact O-N 3.27Å; Y256-K258 PolarHBondContact O-N 2.83Å; Y256-S259 PolarHBondContact O-N 2.83Å; Y256-S259 VanDerWaalsContact O-N 3.15Å; Y256-S259 PolarHBondContact O-OG 3Å; Y256-K260 HydrophobicContact CE2-CG 4.34Å; Y256-K260 PolarHBondContact O-N 2.85Å; Y256-F325 AromaticContact CD1-CE1 3.45Å; Y256-F325 HydrophobicContact CD1-CE1 3.45Å; Y256-F325 VanDerWaalsContact CD1-CE1 3.45Å; Y256-F325 AromaticContact CD1-CZ 3.75Å; Y256-F325 HydrophobicContact CD1-CZ 3.75Å; Y256-F325 HydrophobicContact CD2-CZ 4.27Å; Y256-F325 AromaticContact CE1-CE1 3.71Å; Y256-F325 HydrophobicContact CE1-CE1 3.71Å; Y256-F325 AromaticContact CE1-CZ 3.73Å; Y256-F325 HydrophobicContact CE1-CZ 3.73Å; Y256-F325 HydrophobicContact CE2-CZ 4.31Å; Y256-F325 AromaticContact CG-CE1 3.96Å; Y256-F325 HydrophobicContact CG-CE1 3.96Å; Y256-F325 HydrophobicContact CG-CZ 4.01Å; Y256-Y388 AromaticContact CD2-CD2 3.92Å; Y256-Y388 HydrophobicContact CD2-CD2 3.92Å; Y256-Y388 AromaticContact CD2-CG 3.91Å; Y256-Y388 HydrophobicContact CD2-CG 3.91Å; Y256-Y388 HydrophobicContact CG-CD2 4.37Å; Y256-Y388 HydrophobicContact CG-CG 4.15Å; Y256-Y392 AromaticContact CD1-CD2 3.93Å; Y256-Y392 HydrophobicContact CD1-CD2 3.93Å; Y256-Y392 AromaticContact CD1-CE2 3.53Å; Y256-Y392 HydrophobicContact CD1-CE2 3.53Å; Y256-Y392 AromaticContact CD1-CZ 3.89Å; Y256-Y392 HydrophobicContact CE1-CD2 4.26Å; Y256-Y392 HydrophobicContact CE1-CE2 4.3Å; Y256-Y392 AromaticContact CG-CE2 3.99Å; Y256-Y392 HydrophobicContact CG-CE2 3.99Å
257A91.8Very high90Very high0 Ų037.2 Ų37.20%018%0.183CC..Hα-helixtrans-60.2-46.1173.400000112L253 S254 S259 K260 I262 A267 L270 F325L253-A257 PolarHBondContact O-N 3.02Å; L253-A257 VanDerWaalsContact O-N 3.08Å; S254-A257 PolarHBondContact O-N 3.27Å; A257-S259 PolarHBondContact O-N 3.02Å; A257-K260 PolarHBondContact O-N 2.85Å; A257-I262 HydrophobicContact CB-CB 4.32Å; A257-I262 HydrophobicContact CB-CD1 4.04Å; A257-I262 VanDerWaalsContact O-CB 3.32Å; A257-I262 WeakPolarHBondContact O-CB 3.42Å; A257-I262 PolarHBondContact O-N 2.97Å; A257-A267 HydrophobicContact CB-CB 3.76Å; A257-L270 HydrophobicContact CB-CD1 3.59Å; A257-F325 HydrophobicContact CB-CD1 4.45Å; A257-F325 HydrophobicContact CB-CE1 4.49Å
258K89.6Confident90.1Very high33 Ų3336.9 Ų36.914%0.14318%0.182CC..Hα-helixtrans-58.6-34.5175.1-71.6179-173.8-175.30112.4V42 K45 E46 S254 N255 Y256 K260 E261 K264 A267V42-K258 PolarHBondContact O-NZ 3.11Å; K45-K258 HydrophobicContact CB-CD 4.21Å; K45-K258 HydrophobicContact CG-CD 4.48Å; E46-K258 VanDerWaalsContact CD-NZ 3.3Å; E46-K258 IonicContact OE1-NZ 2.98Å; E46-K258 PolarHBondContact OE1-NZ 3.48Å; E46-K258 IonicContact OE2-NZ 3.01Å; E46-K258 PolarHBondContact OE2-NZ 3.33Å; S254-K258 WeakPolarHBondContact O-CG 3.47Å; S254-K258 PolarHBondContact O-N 3.28Å; N255-K258 PolarHBondContact O-N 3.07Å; Y256-K258 PolarHBondContact O-N 2.83Å; K258-K260 PolarHBondContact O-N 3.21Å; K258-E261 PolarHBondContact O-N 3.44Å; K258-E261 VanDerWaalsContact O-N 3.16Å; K258-K264 HydrophobicContact CD-CG 4.39Å; K258-A267 HydrophobicContact CG-CB 3.91Å
259S89.4Confident90.2Very high62 Ų6241.9 Ų41.943%0.43420%0.204SC..Hα-helixtrans-70.2-17.4177.376.80000114.3N255 Y256 A257 E261N255-S259 WeakPolarHBondContact O-CB 3.39Å; N255-S259 PolarHBondContact O-N 3.43Å; Y256-S259 PolarHBondContact O-N 2.83Å; Y256-S259 VanDerWaalsContact O-N 3.15Å; Y256-S259 PolarHBondContact O-OG 3Å; A257-S259 PolarHBondContact O-N 3.02Å; S259-E261 VanDerWaalsContact C-N 3.31Å
260K90.3Very high90.3Very high79 Ų7941.9 Ų41.934%0.34320%0.204SC..THydrogen-bonded Turntrans-97.725.7171.6-61.9-64.4-177.6-170.80112Y256 A257 K258 I262 F325 D387Y256-K260 HydrophobicContact CE2-CG 4.34Å; Y256-K260 PolarHBondContact O-N 2.85Å; A257-K260 PolarHBondContact O-N 2.85Å; K258-K260 PolarHBondContact O-N 3.21Å; K260-I262 PolarHBondContact O-N 3.25Å; K260-I262 VanDerWaalsContact O-N 3.11Å; K260-F325 HydrophobicContact CB-CE2 4.36Å; K260-F325 HydrophobicContact CG-CE2 4.14Å; K260-F325 HydrophobicContact CG-CZ 4.26Å; K260-D387 IonicContact NZ-OD2 3.95Å
261E89.6Confident90.4Very high187 Ų18741.9 Ų41.987%0.87420%0.203SC*.THydrogen-bonded Turntrans60.919.8177.8-54.4-179.717300114.5K258 S259K258-E261 PolarHBondContact O-N 3.44Å; K258-E261 VanDerWaalsContact O-N 3.16Å; S259-E261 VanDerWaalsContact C-N 3.31Å
262I92.7Very high90.6Very high14 Ų1442.2 Ų42.27%0.07221%0.206CC..  trans-73.5132.6173.7-61.4175.4000109A257 K260 K266 Y322 F325A257-I262 HydrophobicContact CB-CB 4.32Å; A257-I262 HydrophobicContact CB-CD1 4.04Å; A257-I262 VanDerWaalsContact O-CB 3.32Å; A257-I262 WeakPolarHBondContact O-CB 3.42Å; A257-I262 PolarHBondContact O-N 2.97Å; K260-I262 PolarHBondContact O-N 3.25Å; K260-I262 VanDerWaalsContact O-N 3.11Å; I262-K266 HydrophobicContact CG2-CB 3.68Å; I262-Y322 HydrophobicContact CG2-CD2 4.05Å; I262-F325 HydrophobicContact CD1-CD2 3.46Å; I262-F325 VanDerWaalsContact CD1-CD2 3.46Å; I262-F325 HydrophobicContact CD1-CE2 3.86Å; I262-F325 HydrophobicContact CD1-CG 4.24Å
263P91.8Very high90.8Very high71 Ų7143.3 Ų43.346%0.46121%0.212SC..  trans-51.6143176.8-28.534000113.2E265 K266 A267P263-E265 VanDerWaalsContact C-N 3.3Å; P263-E265 PolarHBondContact O-N 3.35Å; P263-K266 HydrophobicContact CB-CB 4.48Å; P263-K266 HydrophobicContact CB-CG 4.45Å; P263-K266 HydrophobicContact CG-CD 4.24Å; P263-K266 WeakPolarHBondContact O-CB 3.32Å; P263-K266 PolarHBondContact O-N 2.93Å; P263-A267 PolarHBondContact O-N 3.26Å
264K87.4Confident91Very high80 Ų8043.3 Ų43.335%0.34821%0.213SC..Hα-helixtrans-55.8-42.3-174.7-58.8-174.6-176.7-165.20113E46 T166 K258 K266 A267 A268E46-K264 WeakPolarHBondContact OE1-CD 3.24Å; E46-K264 VanDerWaalsContact OE1-CE 3.23Å; E46-K264 WeakPolarHBondContact OE1-CE 3.34Å; E46-K264 IonicContact OE1-NZ 2.83Å; E46-K264 PolarHBondContact OE1-NZ 3.08Å; T166-K264 HydrophobicContact CG2-CB 4.27Å; K258-K264 HydrophobicContact CD-CG 4.39Å; K264-K266 PolarHBondContact O-N 2.68Å; K264-A267 PolarHBondContact O-N 3.38Å; K264-A268 PolarHBondContact O-N 3.42Å
265E88.6Confident91.2Very high140 Ų14043.4 Ų43.465%0.65421%0.213SC*.Hα-helixtrans-58.9-47176.8-62.8178.7175.300111.9T166 P263 A268 F269T166-E265 HydrophobicContact CG2-CG 4.45Å; P263-E265 VanDerWaalsContact C-N 3.3Å; P263-E265 PolarHBondContact O-N 3.35Å; E265-A268 PolarHBondContact O-N 2.76Å; E265-F269 WeakPolarHBondContact O-CB 3.38Å; E265-F269 PolarHBondContact O-N 3.21Å
266K91.1Very high91.4Very high99 Ų9949.4 Ų49.443%0.4324%0.239SC..Hα-helixtrans-64.7-40.7177.4-72-174.5-176.5175.20111.4I262 P263 K264 F269 L270 Y322I262-K266 HydrophobicContact CG2-CB 3.68Å; P263-K266 HydrophobicContact CB-CB 4.48Å; P263-K266 HydrophobicContact CB-CG 4.45Å; P263-K266 HydrophobicContact CG-CD 4.24Å; P263-K266 WeakPolarHBondContact O-CB 3.32Å; P263-K266 PolarHBondContact O-N 2.93Å; K264-K266 PolarHBondContact O-N 2.68Å; K266-F269 PolarHBondContact O-N 3.12Å; K266-L270 PolarHBondContact O-N 3.13Å; K266-Y322 HydrophobicContact CB-CD2 3.9Å; K266-Y322 HydrophobicContact CB-CE2 3.62Å; K266-Y322 HydrophobicContact CD-CD1 4.38Å; K266-Y322 HydrophobicContact CD-CD2 4.31Å; K266-Y322 HydrophobicContact CD-CE1 4.48Å; K266-Y322 HydrophobicContact CD-CE2 4.43Å; K266-Y322 HydrophobicContact CD-CG 4.28Å; K266-Y322 HydrophobicContact CG-CE2 4.21Å; K266-Y322 WeakPolarHBondContact O-CE2 3.36Å
267A90Very high91.6Very high0 Ų050.6 Ų50.60%025%0.247CC..Hα-helixtrans-64.2-39.317700000112.6A257 K258 P263 K264 L270A257-A267 HydrophobicContact CB-CB 3.76Å; K258-A267 HydrophobicContact CG-CB 3.91Å; P263-A267 PolarHBondContact O-N 3.26Å; K264-A267 PolarHBondContact O-N 3.38Å; A267-L270 WeakPolarHBondContact O-CB 3.4Å; A267-L270 PolarHBondContact O-N 3.18Å
268A88.6Confident91.6Very high2 Ų250.8 Ų50.82%0.01725%0.248CC..Hα-helixtrans-68.1-38.4174.700000112V42 T166 K264 E265 L270 L271V42-A268 HydrophobicContact CG1-CB 4.35Å; T166-A268 WeakPolarHBondContact OG1-CB 3.47Å; K264-A268 PolarHBondContact O-N 3.42Å; E265-A268 PolarHBondContact O-N 2.76Å; A268-L270 PolarHBondContact O-N 2.87Å; A268-L271 WeakPolarHBondContact O-CB 3.41Å; A268-L271 PolarHBondContact O-N 3.41Å; A268-L271 VanDerWaalsContact O-N 3.08Å
269F92.4Very high91.6Very high105 Ų10551.9 Ų51.946%0.46125%0.254SS..Hα-helixtrans-60.7-25.8177.2-167.5-100.7000113.1E265 K266 L271 S272 V273 Y322E265-F269 WeakPolarHBondContact O-CB 3.38Å; E265-F269 PolarHBondContact O-N 3.21Å; K266-F269 PolarHBondContact O-N 3.12Å; F269-L271 VanDerWaalsContact C-N 3.3Å; F269-L271 PolarHBondContact O-N 3.42Å; F269-S272 WeakPolarHBondContact O-CA 3.44Å; F269-S272 WeakPolarHBondContact O-CB 3.37Å; F269-S272 PolarHBondContact O-N 2.72Å; F269-V273 HydrophobicContact CD1-CG2 3.71Å; F269-V273 HydrophobicContact CE1-CG2 3.53Å; F269-V273 HydrophobicContact CZ-CG2 4.38Å; F269-V273 WeakPolarHBondContact O-CG2 3.41Å; F269-V273 PolarHBondContact O-N 3.46Å; F269-Y322 VanDerWaalsContact CD1-OH 3.31Å; F269-Y322 WeakPolarHBondContact CD1-OH 3.27Å
270L93.8Very high91.7Very high0 Ų053 Ų530%026%0.258CS..Hα-helixtrans-60.1-38.2173.6-64172.9000112.8L253 A257 K266 A267 A268 S272 V273 L274 Y322 F325 V326 A329L253-L270 HydrophobicContact CD2-CB 4.24Å; L253-L270 HydrophobicContact CG-CB 4.38Å; A257-L270 HydrophobicContact CB-CD1 3.59Å; K266-L270 PolarHBondContact O-N 3.13Å; A267-L270 WeakPolarHBondContact O-CB 3.4Å; A267-L270 PolarHBondContact O-N 3.18Å; A268-L270 PolarHBondContact O-N 2.87Å; L270-S272 VanDerWaalsContact C-N 3.27Å; L270-S272 PolarHBondContact O-N 3.18Å; L270-V273 PolarHBondContact O-N 3.18Å; L270-L274 WeakPolarHBondContact O-CB 3.4Å; L270-L274 PolarHBondContact O-N 3.07Å; L270-Y322 HydrophobicContact CD2-CD2 4.39Å; L270-Y322 HydrophobicContact CD2-CE2 3.94Å; L270-Y322 HydrophobicContact CG-CE2 4.35Å; L270-F325 HydrophobicContact CD1-CB 3.75Å; L270-F325 HydrophobicContact CD1-CD1 4.21Å; L270-F325 HydrophobicContact CD1-CG 4.19Å; L270-F325 HydrophobicContact CD2-CB 3.88Å; L270-F325 HydrophobicContact CG-CB 4.48Å; L270-V326 HydrophobicContact CD2-CB 4.44Å; L270-V326 HydrophobicContact CD2-CG2 3.71Å; L270-A329 HydrophobicContact CD2-CB 4.43Å
271L91.5Very high91.8Very high0 Ų049.3 Ų49.30%024%0.243CC..Hα-helixtrans-65.6-34.3174.7-69170.7000110.9V42 A162 L253 A268 F269 A275V42-L271 HydrophobicContact CG1-CD1 4.04Å; A162-L271 HydrophobicContact CB-CB 4Å; A162-L271 HydrophobicContact CB-CD1 4.17Å; L253-L271 HydrophobicContact CB-CD2 4.31Å; L253-L271 HydrophobicContact CD2-CD2 4.16Å; A268-L271 WeakPolarHBondContact O-CB 3.41Å; A268-L271 PolarHBondContact O-N 3.41Å; A268-L271 VanDerWaalsContact O-N 3.08Å; F269-L271 VanDerWaalsContact C-N 3.3Å; F269-L271 PolarHBondContact O-N 3.42Å; L271-A275 VanDerWaalsContact O-CB 3.27Å; L271-A275 WeakPolarHBondContact O-CB 3.41Å; L271-A275 PolarHBondContact O-N 3.4Å
272S92.9Very high91.8Very high9 Ų942.2 Ų42.26%0.06321%0.208CC..Hα-helixtrans-68.8-42.4174.6-53.90000112.7S159 P163 F269 L270 A275 F276S159-S272 PolarHBondContact O-OG 3.46Å; P163-S272 VanDerWaalsContact CD-OG 3.3Å; P163-S272 WeakPolarHBondContact CD-OG 3.49Å; P163-S272 VanDerWaalsContact CG-OG 3.25Å; P163-S272 WeakPolarHBondContact CG-OG 3.44Å; F269-S272 WeakPolarHBondContact O-CA 3.44Å; F269-S272 WeakPolarHBondContact O-CB 3.37Å; F269-S272 PolarHBondContact O-N 2.72Å; L270-S272 VanDerWaalsContact C-N 3.27Å; L270-S272 PolarHBondContact O-N 3.18Å; S272-A275 PolarHBondContact O-N 3.02Å; S272-F276 WeakPolarHBondContact O-CB 3.37Å; S272-F276 PolarHBondContact O-N 2.94Å
273V94.9Very high91.6Very high24 Ų2445.2 Ų45.215%0.14523%0.228CC..Hα-helixtrans-59.5-49.9174173.20000110.2F269 L270 A275 F276 V277 V326 A329 I330F269-V273 HydrophobicContact CD1-CG2 3.71Å; F269-V273 HydrophobicContact CE1-CG2 3.53Å; F269-V273 HydrophobicContact CZ-CG2 4.38Å; F269-V273 WeakPolarHBondContact O-CG2 3.41Å; F269-V273 PolarHBondContact O-N 3.46Å; L270-V273 PolarHBondContact O-N 3.18Å; V273-A275 VanDerWaalsContact C-N 3.32Å; V273-A275 PolarHBondContact O-N 3.2Å; V273-F276 PolarHBondContact O-N 3.37Å; V273-V277 WeakPolarHBondContact O-CG2 3.37Å; V273-V277 PolarHBondContact O-N 3.34Å; V273-V326 HydrophobicContact CG1-CG1 4.49Å; V273-A329 HydrophobicContact CB-CB 4.44Å; V273-A329 HydrophobicContact CG1-CB 4.21Å; V273-I330 HydrophobicContact CG1-CG1 3.76Å
274L94.6Very high91.6Very high1 Ų143.8 Ų43.81%0.00522%0.22CC..Hα-helixtrans-55.2-48.4177-177.3161.7000111.2L253 L270 V277 D278 A329 F332L253-L274 HydrophobicContact CD2-CD1 3.95Å; L270-L274 WeakPolarHBondContact O-CB 3.4Å; L270-L274 PolarHBondContact O-N 3.07Å; L274-V277 PolarHBondContact O-N 3.07Å; L274-D278 WeakPolarHBondContact O-CB 3.45Å; L274-D278 PolarHBondContact O-N 2.71Å; L274-A329 HydrophobicContact CB-CB 4.41Å; L274-F332 HydrophobicContact CD1-CD1 3.27Å; L274-F332 HydrophobicContact CD1-CE1 3.55Å; L274-F332 HydrophobicContact CD1-CG 4.04Å; L274-F332 HydrophobicContact CG-CD1 4.39Å
275A93.4Very high91.8Very high1 Ų141.2 Ų41.21%0.00821%0.21CC..Hα-helixtrans-64.9-39.9-178.500000112.6P155 L158 L271 S272 V273 V277 D278 M279P155-A275 HydrophobicContact CB-CB 4.16Å; P155-A275 WeakPolarHBondContact CB-O 3.49Å; P155-A275 WeakPolarHBondContact O-CB 3.35Å; L158-A275 HydrophobicContact CB-CB 4.07Å; L158-A275 HydrophobicContact CD2-CB 4.05Å; L158-A275 HydrophobicContact CG-CB 4.06Å; L271-A275 VanDerWaalsContact O-CB 3.27Å; L271-A275 WeakPolarHBondContact O-CB 3.41Å; L271-A275 PolarHBondContact O-N 3.4Å; S272-A275 PolarHBondContact O-N 3.02Å; V273-A275 VanDerWaalsContact C-N 3.32Å; V273-A275 PolarHBondContact O-N 3.2Å; A275-V277 VanDerWaalsContact C-N 3.35Å; A275-D278 PolarHBondContact O-N 3.24Å; A275-M279 WeakPolarHBondContact O-CB 3.34Å; A275-M279 PolarHBondContact O-N 3.19Å
276F93.1Very high91.7Very high127 Ų12735.3 Ų35.356%0.55719%0.186SC*.Hα-helixtrans-64.1-41.1176.3-173.9-96.9000111.7S272 V273 M279 V280S272-F276 WeakPolarHBondContact O-CB 3.37Å; S272-F276 PolarHBondContact O-N 2.94Å; V273-F276 PolarHBondContact O-N 3.37Å; F276-M279 HydrophobicContact CD2-CE 3.62Å; F276-M279 HydrophobicContact CE2-CE 3.61Å; F276-M279 HydrophobicContact CG-CE 4.5Å; F276-M279 HydrophobicContact CZ-CE 4.47Å; F276-M279 WeakPolarHBondContact O-CB 3.38Å; F276-M279 PolarHBondContact O-N 3.25Å; F276-V280 PolarHBondContact O-N 3.22Å
277V95.7Very high91.5Very high28 Ų2836.4 Ų36.417%0.1720%0.195CC..Hα-helixtrans-68.7-42.2176.8-1790000111.4V273 L274 A275 M279 V280 A281 I330 F334V273-V277 WeakPolarHBondContact O-CG2 3.37Å; V273-V277 PolarHBondContact O-N 3.34Å; L274-V277 PolarHBondContact O-N 3.07Å; A275-V277 VanDerWaalsContact C-N 3.35Å; V277-M279 VanDerWaalsContact C-N 3.29Å; V277-M279 PolarHBondContact O-N 2.83Å; V277-V280 PolarHBondContact O-N 3.13Å; V277-V280 VanDerWaalsContact O-N 3.16Å; V277-A281 VanDerWaalsContact O-CB 3.23Å; V277-A281 WeakPolarHBondContact O-CB 3.26Å; V277-A281 PolarHBondContact O-N 3.03Å; V277-I330 HydrophobicContact CG1-CG2 4.44Å; V277-I330 WeakPolarHBondContact CG1-O 3.46Å; V277-I330 HydrophobicContact CG2-CB 4.37Å; V277-I330 HydrophobicContact CG2-CG1 4.16Å; V277-I330 HydrophobicContact CG2-CG2 4.21Å; V277-F334 HydrophobicContact CG1-CB 3.9Å
278D92.6Very high91.6Very high4 Ų438.6 Ų38.62%0.02121%0.209CC..Hα-helixtrans-55.5-44.9172.8174.617.9000111.2L274 A275 V280 A281 R282 G333 G337L274-D278 WeakPolarHBondContact O-CB 3.45Å; L274-D278 PolarHBondContact O-N 2.71Å; A275-D278 PolarHBondContact O-N 3.24Å; D278-V280 PolarHBondContact O-N 3.4Å; D278-A281 PolarHBondContact O-N 3.02Å; D278-R282 VanDerWaalsContact O-CB 3.26Å; D278-R282 WeakPolarHBondContact O-CB 3.45Å; D278-R282 PolarHBondContact O-N 2.9Å; D278-R282 IonicContact OD1-CZ 3.83Å; D278-R282 IonicContact OD1-NE 3.76Å; D278-R282 PolarHBondContact OD1-NE 3.3Å; D278-R282 IonicContact OD1-NH2 2.82Å; D278-R282 IonicContact OD2-NH2 3.92Å; D278-G333 WeakPolarHBondContact CA-O 3.4Å; D278-G337 WeakPolarHBondContact OD1-CA 3.33Å
279M89.6Confident91.5Very high57 Ų5738.6 Ų38.628%0.28121%0.209SC..Hα-helixtrans-55.3-36.8178.5-172.6179.76600113P155 V156 A275 F276 V277 P283P155-M279 HydrophobicContact CB-CB 3.97Å; P155-M279 HydrophobicContact CG-CB 3.87Å; P155-M279 HydrophobicContact CG-CG 4.16Å; V156-M279 HydrophobicContact CG2-SD 3.63Å; A275-M279 WeakPolarHBondContact O-CB 3.34Å; A275-M279 PolarHBondContact O-N 3.19Å; F276-M279 HydrophobicContact CD2-CE 3.62Å; F276-M279 HydrophobicContact CE2-CE 3.61Å; F276-M279 HydrophobicContact CG-CE 4.5Å; F276-M279 HydrophobicContact CZ-CE 4.47Å; F276-M279 WeakPolarHBondContact O-CB 3.38Å; F276-M279 PolarHBondContact O-N 3.25Å; V277-M279 VanDerWaalsContact C-N 3.29Å; V277-M279 PolarHBondContact O-N 2.83Å; M279-P283 WeakPolarHBondContact O-CD 3.32Å
280V91.6Very high91.2Very high84 Ų8437.7 Ų37.751%0.50921%0.209SC..Hα-helixtrans-86.9-39.1178.6-179.60000111.6F276 V277 D278 R282 S284F276-V280 PolarHBondContact O-N 3.22Å; V277-V280 PolarHBondContact O-N 3.13Å; V277-V280 VanDerWaalsContact O-N 3.16Å; D278-V280 PolarHBondContact O-N 3.4Å; V280-R282 VanDerWaalsContact C-N 3.29Å; V280-R282 PolarHBondContact O-N 3.49Å; V280-S284 WeakPolarHBondContact O-CB 3.43Å; V280-S284 PolarHBondContact O-N 3.04Å; V280-S284 PolarHBondContact O-OG 2.78Å
281A92.8Very high90.9Very high2 Ų240.3 Ų40.32%0.01723%0.225CC..Hα-helixtrans-64-35.4-179.600000112V277 D278 S284 M285 F334V277-A281 VanDerWaalsContact O-CB 3.23Å; V277-A281 WeakPolarHBondContact O-CB 3.26Å; V277-A281 PolarHBondContact O-N 3.03Å; D278-A281 PolarHBondContact O-N 3.02Å; A281-S284 VanDerWaalsContact CA-OG 3.29Å; A281-S284 WeakPolarHBondContact CA-OG 3.12Å; A281-S284 PolarHBondContact O-OG 3.34Å; A281-M285 VanDerWaalsContact O-CB 3.27Å; A281-M285 WeakPolarHBondContact O-CB 3.46Å; A281-M285 VanDerWaalsContact O-CG 3.29Å; A281-M285 WeakPolarHBondContact O-CG 3.16Å; A281-M285 PolarHBondContact O-N 3.33Å; A281-F334 HydrophobicContact CB-CB 4.44Å; A281-F334 HydrophobicContact CB-CD2 3.66Å; A281-F334 HydrophobicContact CB-CE2 4.24Å; A281-F334 HydrophobicContact CB-CG 4.29Å
282R89.3Confident90.6Very high38 Ų3849.4 Ų49.414%0.14326%0.264CS..Hα-helixtrans-67.1-54.8-173.8179.6-176.2-72.4-161.3-9.2112.9D278 V280 S284 G286 S340 S341D278-R282 VanDerWaalsContact O-CB 3.26Å; D278-R282 WeakPolarHBondContact O-CB 3.45Å; D278-R282 PolarHBondContact O-N 2.9Å; D278-R282 IonicContact OD1-CZ 3.83Å; D278-R282 IonicContact OD1-NE 3.76Å; D278-R282 PolarHBondContact OD1-NE 3.3Å; D278-R282 IonicContact OD1-NH2 2.82Å; D278-R282 IonicContact OD2-NH2 3.92Å; V280-R282 VanDerWaalsContact C-N 3.29Å; V280-R282 PolarHBondContact O-N 3.49Å; R282-S284 PolarHBondContact O-N 2.93Å; R282-G286 PolarHBondContact O-N 3.11Å; R282-S340 PolarHBondContact NH2-OG 3.42Å; R282-S341 WeakPolarHBondContact CA-OG 3.25Å; R282-S341 WeakPolarHBondContact CG-OG 3.23Å; R282-S341 PolarHBondContact O-OG 3.07Å
283P88.1Confident90.3Very high78 Ų7860.2 Ų60.251%0.50630%0.304SS..Hα-helixtrans-61.9-41.4173.8-22.233.6000113M279 G286 I287M279-P283 WeakPolarHBondContact O-CD 3.32Å; P283-G286 PolarHBondContact O-N 3.14Å; P283-I287 VanDerWaalsContact O-CG1 3.32Å; P283-I287 WeakPolarHBondContact O-CG1 3.39Å; P283-I287 PolarHBondContact O-N 3.17Å
284S90.7Very high90.1Very high41 Ų4161 Ų6129%0.28731%0.307SS..Hα-helixtrans-63.6-48.7-177.7560000111.9V280 A281 R282 G286 I287 V288V280-S284 WeakPolarHBondContact O-CB 3.43Å; V280-S284 PolarHBondContact O-N 3.04Å; V280-S284 PolarHBondContact O-OG 2.78Å; A281-S284 VanDerWaalsContact CA-OG 3.29Å; A281-S284 WeakPolarHBondContact CA-OG 3.12Å; A281-S284 PolarHBondContact O-OG 3.34Å; R282-S284 PolarHBondContact O-N 2.93Å; S284-G286 VanDerWaalsContact C-N 3.33Å; S284-G286 PolarHBondContact O-N 3.32Å; S284-I287 PolarHBondContact O-N 3.32Å; S284-V288 VanDerWaalsContact O-CG2 3.29Å; S284-V288 WeakPolarHBondContact O-CG2 3.27Å; S284-V288 PolarHBondContact O-N 3.12Å
285M91.8Very high89.7Confident26 Ų2664.3 Ų64.313%0.12832%0.319CS..Hα-helixtrans-69.7-30.1177.4-66-59.9103.400112.8A281 V288 A289 F301 F334 W338A281-M285 VanDerWaalsContact O-CB 3.27Å; A281-M285 WeakPolarHBondContact O-CB 3.46Å; A281-M285 VanDerWaalsContact O-CG 3.29Å; A281-M285 WeakPolarHBondContact O-CG 3.16Å; A281-M285 PolarHBondContact O-N 3.33Å; M285-V288 HydrophobicContact CE-CG2 4Å; M285-V288 PolarHBondContact O-N 3.18Å; M285-A289 WeakPolarHBondContact O-CB 3.4Å; M285-A289 PolarHBondContact O-N 2.88Å; M285-F301 HydrophobicContact SD-CZ 4.22Å; M285-F334 HydrophobicContact CE-CE2 4.07Å; M285-F334 HydrophobicContact CE-CZ 3.88Å; M285-F334 HydrophobicContact CG-CE2 4.36Å; M285-F334 HydrophobicContact CG-CZ 4.19Å; M285-F334 HydrophobicContact SD-CE2 4.37Å; M285-F334 HydrophobicContact SD-CZ 3.78Å; M285-W338 HydrophobicContact CB-CB 4.23Å; M285-W338 HydrophobicContact CB-CG 4.13Å; M285-W338 HydrophobicContact CG-CB 3.78Å; M285-W338 HydrophobicContact CG-CD2 4.4Å; M285-W338 HydrophobicContact CG-CG 3.8Å; M285-W338 HydrophobicContact SD-CD2 4.21Å; M285-W338 HydrophobicContact SD-CG 4.2Å
286G86.6Confident89.4Confident16 Ų1668.2 Ų68.217%0.16535%0.345CS..Hα-helixtrans-63.5-39.2170.400000113.3R282 P283 S284 N290R282-G286 PolarHBondContact O-N 3.11Å; P283-G286 PolarHBondContact O-N 3.14Å; S284-G286 VanDerWaalsContact C-N 3.33Å; S284-G286 PolarHBondContact O-N 3.32Å; G286-N290 PolarHBondContact O-N 3.4Å; G286-N290 PolarHBondContact O-ND2 3.31Å
287I87.8Confident89.2Confident121 Ų12170.3 Ų70.362%0.62135%0.349SS*.Hα-helixtrans-67.1-46173.9-67.8164000110.1P283 S284 A289 N290 T291P283-I287 VanDerWaalsContact O-CG1 3.32Å; P283-I287 WeakPolarHBondContact O-CG1 3.39Å; P283-I287 PolarHBondContact O-N 3.17Å; S284-I287 PolarHBondContact O-N 3.32Å; I287-A289 VanDerWaalsContact C-N 3.32Å; I287-A289 PolarHBondContact O-N 3.03Å; I287-N290 PolarHBondContact O-N 2.99Å; I287-T291 PolarHBondContact O-N 2.88Å
288V91.2Very high88.9Confident47 Ų4769 Ų6929%0.28534%0.341SS..Hα-helixtrans-58.1-44177.8171.10000111S284 M285 N290 T291 I294 F301S284-V288 VanDerWaalsContact O-CG2 3.29Å; S284-V288 WeakPolarHBondContact O-CG2 3.27Å; S284-V288 PolarHBondContact O-N 3.12Å; M285-V288 HydrophobicContact CE-CG2 4Å; M285-V288 PolarHBondContact O-N 3.18Å; V288-N290 PolarHBondContact O-N 3.35Å; V288-T291 WeakPolarHBondContact O-CB 3.4Å; V288-T291 WeakPolarHBondContact O-CG2 3.32Å; V288-T291 PolarHBondContact O-N 3.33Å; V288-T291 VanDerWaalsContact O-N 3.12Å; V288-T291 PolarHBondContact O-OG1 3.41Å; V288-I294 HydrophobicContact CG1-CD1 3.26Å; V288-I294 WeakPolarHBondContact O-CD1 3.34Å; V288-F301 HydrophobicContact CB-CZ 4.42Å; V288-F301 HydrophobicContact CG1-CE2 4.11Å; V288-F301 HydrophobicContact CG1-CZ 3.7Å
289A87.9Confident88.8Confident1 Ų169 Ų691%0.00834%0.341CS..Hα-helixtrans-60.4-25.9177.100000114M285 I287 R295 I298 F301 V342M285-A289 WeakPolarHBondContact O-CB 3.4Å; M285-A289 PolarHBondContact O-N 2.88Å; I287-A289 VanDerWaalsContact C-N 3.32Å; I287-A289 PolarHBondContact O-N 3.03Å; A289-R295 WeakPolarHBondContact O-CA 3.17Å; A289-R295 PolarHBondContact O-N 3.14Å; A289-I298 HydrophobicContact CB-CD1 4.18Å; A289-F301 HydrophobicContact CB-CD1 4.16Å; A289-F301 HydrophobicContact CB-CE1 3.94Å; A289-V342 HydrophobicContact CB-CG2 4.23Å
290N85Confident89Confident86 Ų8668.9 Ų68.946%0.4634%0.337SS..THydrogen-bonded Turntrans-91.50.4-179.7-76.9-51.7000114.2G286 I287 V288 R295G286-N290 PolarHBondContact O-N 3.4Å; G286-N290 PolarHBondContact O-ND2 3.31Å; I287-N290 PolarHBondContact O-N 2.99Å; V288-N290 PolarHBondContact O-N 3.35Å; N290-R295 PolarHBondContact OD1-NH1 2.87Å
291T88.3Confident89.1Confident56 Ų5666 Ų6634%0.34432%0.318SS..SBendtrans-68.2151.9174.461.50000111.6I287 V288 W293 I294 R295I287-T291 PolarHBondContact O-N 2.88Å; V288-T291 WeakPolarHBondContact O-CB 3.4Å; V288-T291 WeakPolarHBondContact O-CG2 3.32Å; V288-T291 PolarHBondContact O-N 3.33Å; V288-T291 VanDerWaalsContact O-N 3.12Å; V288-T291 PolarHBondContact O-OG1 3.41Å; T291-W293 PolarHBondContact O-N 3.26Å; T291-I294 PolarHBondContact O-N 2.88Å; T291-R295 VanDerWaalsContact O-CB 3.32Å; T291-R295 WeakPolarHBondContact O-CB 3.04Å; T291-R295 PolarHBondContact O-N 3.5Å
292K84.3Confident89.1Confident191 Ų19166 Ų6683%0.8332%0.318SS*.THydrogen-bonded Turntrans-57.4-23.4-178.1-65.7-176.9179.6-179.80113.9P296K292-P296 VanDerWaalsContact O-CD 3.27Å; K292-P296 WeakPolarHBondContact O-CD 3.38Å; K292-P296 WeakPolarHBondContact O-CG 3.43Å
293W87.4Confident89.4Confident236 Ų23664.2 Ų64.289%0.89431%0.311SS*.THydrogen-bonded Turntrans-88.8-33.7-176.7-56.9-10.1000112.4T291T291-W293 PolarHBondContact O-N 3.26Å
294I89.9Confident89.8Confident41 Ų4164.1 Ų64.121%0.2131%0.305CS..THydrogen-bonded Turntrans-94.7-36.7-174.6-62.5174000111V288 T291 P296 R297 I298 F301V288-I294 HydrophobicContact CG1-CD1 3.26Å; V288-I294 WeakPolarHBondContact O-CD1 3.34Å; T291-I294 PolarHBondContact O-N 2.88Å; I294-P296 VanDerWaalsContact C-CD 3.5Å; I294-R297 CarbonylContact O-C 3.51Å; I294-R297 WeakPolarHBondContact O-CA 3.49Å; I294-R297 PolarHBondContact O-N 2.9Å; I294-I298 PolarHBondContact O-N 2.82Å; I294-F301 HydrophobicContact CD1-CD2 4.45Å; I294-F301 HydrophobicContact CD1-CE2 4.17Å; I294-F301 HydrophobicContact CG2-CB 3.8Å; I294-F301 HydrophobicContact CG2-CD1 3.86Å; I294-F301 HydrophobicContact CG2-CD2 3.83Å; I294-F301 HydrophobicContact CG2-CE1 4.37Å; I294-F301 HydrophobicContact CG2-CE2 4.35Å; I294-F301 HydrophobicContact CG2-CG 3.57Å
295R86.7Confident90Very high70 Ų7062.1 Ų62.126%0.26429%0.292SS..G310 helixtrans-52.6-45.3-177.3-172.771.4-175.1-167.912.6113.5A289 N290 T291 R297 I298 E345A289-R295 WeakPolarHBondContact O-CA 3.17Å; A289-R295 PolarHBondContact O-N 3.14Å; N290-R295 PolarHBondContact OD1-NH1 2.87Å; T291-R295 VanDerWaalsContact O-CB 3.32Å; T291-R295 WeakPolarHBondContact O-CB 3.04Å; T291-R295 PolarHBondContact O-N 3.5Å; R295-R297 PolarHBondContact O-N 3.33Å; R295-R297 VanDerWaalsContact O-N 3.13Å; R295-I298 PolarHBondContact O-N 3.49Å; R295-E345 IonicContact CZ-OE2 3.79Å; R295-E345 IonicContact NH1-OE2 3.42Å; R295-E345 PolarHBondContact NH1-OE2 3.33Å; R295-E345 IonicContact NH2-OE2 3.43Å; R295-E345 PolarHBondContact NH2-OE2 3.02Å
296P86.6Confident90.2Very high83 Ų8360.9 Ų60.954%0.53929%0.286SS..G310 helixtrans-65.3-16.5178.7-21.134.4000114.3K292 I294 Y414K292-P296 VanDerWaalsContact O-CD 3.27Å; K292-P296 WeakPolarHBondContact O-CD 3.38Å; K292-P296 WeakPolarHBondContact O-CG 3.43Å; I294-P296 VanDerWaalsContact C-CD 3.5Å; P296-Y414 PolarHBondContact O-OH 2.94Å
297R89.5Confident90.7Very high171 Ų17163.4 Ų63.465%0.64530%0.295SS*.G310 helixtrans-12728.5-174.9-70.4-170.1-178.7-177.82.8111.9I294 R295 Q299 Y300 F301 Y414I294-R297 CarbonylContact O-C 3.51Å; I294-R297 WeakPolarHBondContact O-CA 3.49Å; I294-R297 PolarHBondContact O-N 2.9Å; R295-R297 PolarHBondContact O-N 3.33Å; R295-R297 VanDerWaalsContact O-N 3.13Å; R297-Q299 PolarHBondContact O-N 2.83Å; R297-Q299 VanDerWaalsContact O-N 3.14Å; R297-Y300 HydrophobicContact CB-CD2 4.07Å; R297-Y300 HydrophobicContact CG-CD2 4.34Å; R297-Y300 PolarHBondContact O-N 3.49Å; R297-F301 PolarHBondContact O-N 3.19Å; R297-Y414 WeakPolarHBondContact CA-OH 3.5Å
298I89.1Confident91.2Very high0 Ų061 Ų610%028%0.279CS..Hα-helixtrans-58.9-30.5-173.3-166.2167.6000113A289 I294 R295 Y300 F301 F302 V342 E345 D349A289-I298 HydrophobicContact CB-CD1 4.18Å; I294-I298 PolarHBondContact O-N 2.82Å; R295-I298 PolarHBondContact O-N 3.49Å; I298-Y300 VanDerWaalsContact C-N 3.33Å; I298-Y300 PolarHBondContact O-N 2.93Å; I298-F301 WeakPolarHBondContact O-CB 3.38Å; I298-F301 PolarHBondContact O-N 2.94Å; I298-F301 VanDerWaalsContact O-N 3.17Å; I298-F302 PolarHBondContact O-N 3.04Å; I298-V342 HydrophobicContact CD1-CG1 4.41Å; I298-V342 HydrophobicContact CG1-CG1 3.9Å; I298-E345 HydrophobicContact CD1-CB 3.69Å; I298-D349 HydrophobicContact CG2-CB 4Å
299Q90.4Very high91.4Very high4 Ų458.8 Ų58.82%0.01927%0.265CS..Hα-helixtrans-64.8-34.7177.6-64.3166.429.200112.5R297 F302 A303 T346 M410 Y414R297-Q299 PolarHBondContact O-N 2.83Å; R297-Q299 VanDerWaalsContact O-N 3.14Å; Q299-F302 WeakPolarHBondContact O-CB 3.5Å; Q299-A303 PolarHBondContact O-N 2.93Å; Q299-A303 VanDerWaalsContact O-N 3.12Å; Q299-T346 HydrophobicContact CB-CG2 4.36Å; Q299-T346 HydrophobicContact CG-CG2 3.75Å; Q299-M410 HydrophobicContact CB-CB 3.86Å; Q299-M410 HydrophobicContact CB-CG 3.87Å; Q299-M410 HydrophobicContact CB-SD 4.14Å; Q299-M410 HydrophobicContact CG-CG 4.45Å; Q299-M410 HydrophobicContact CG-SD 4.06Å; Q299-M410 PolarHBondContact OE1-SD 3.29Å; Q299-Y414 HydrophobicContact CB-CE2 3.85Å; Q299-Y414 HydrophobicContact CG-CE2 4.36Å
300Y93.4Very high91.8Very high54 Ų5458.7 Ų58.721%0.21227%0.265CS..Hα-helixtrans-72.8-38173-67-66.3000111.6R297 I298 F302 A303 I304 F407 G411 Y414R297-Y300 HydrophobicContact CB-CD2 4.07Å; R297-Y300 HydrophobicContact CG-CD2 4.34Å; R297-Y300 PolarHBondContact O-N 3.49Å; I298-Y300 VanDerWaalsContact C-N 3.33Å; I298-Y300 PolarHBondContact O-N 2.93Å; Y300-F302 PolarHBondContact O-N 2.91Å; Y300-A303 PolarHBondContact O-N 2.85Å; Y300-I304 VanDerWaalsContact O-CG1 3.3Å; Y300-I304 WeakPolarHBondContact O-CG1 3.24Å; Y300-I304 PolarHBondContact O-N 3.23Å; Y300-F407 AromaticContact CD1-CD2 3.69Å; Y300-F407 HydrophobicContact CD1-CD2 3.69Å; Y300-F407 HydrophobicContact CD1-CE1 4.37Å; Y300-F407 AromaticContact CD1-CE2 3.52Å; Y300-F407 HydrophobicContact CD1-CE2 3.52Å; Y300-F407 HydrophobicContact CD1-CG 4.2Å; Y300-F407 AromaticContact CD1-CZ 3.88Å; Y300-F407 HydrophobicContact CD1-CZ 3.88Å; Y300-F407 HydrophobicContact CE1-CD1 4.42Å; Y300-F407 HydrophobicContact CE1-CD2 4.38Å; Y300-F407 HydrophobicContact CE1-CE1 4.22Å; Y300-F407 HydrophobicContact CE1-CE2 4.17Å; Y300-F407 HydrophobicContact CE1-CG 4.49Å; Y300-F407 HydrophobicContact CE1-CZ 4.09Å; Y300-F407 HydrophobicContact CG-CE2 4.31Å; Y300-G411 WeakPolarHBondContact OH-CA 3.48Å; Y300-Y414 HydrophobicContact CD2-CD2 4.03Å; Y300-Y414 AromaticContact CD2-CE2 3.7Å; Y300-Y414 HydrophobicContact CD2-CE2 3.7Å; Y300-Y414 AromaticContact CE2-CD2 3.37Å; Y300-Y414 HydrophobicContact CE2-CD2 3.37Å; Y300-Y414 AromaticContact CE2-CE2 3.55Å; Y300-Y414 HydrophobicContact CE2-CE2 3.55Å; Y300-Y414 HydrophobicContact CE2-CG 4.42Å; Y300-Y414 AromaticContact CZ-CD2 3.84Å
301F94.2Very high92.4Very high25 Ų2557.7 Ų57.711%0.1126%0.261CS..Hα-helixtrans-60.3-38.4174.8-170.9-114.6000111.3M285 V288 A289 I294 R297 I298 S305 W338 V342M285-F301 HydrophobicContact SD-CZ 4.22Å; V288-F301 HydrophobicContact CB-CZ 4.42Å; V288-F301 HydrophobicContact CG1-CE2 4.11Å; V288-F301 HydrophobicContact CG1-CZ 3.7Å; A289-F301 HydrophobicContact CB-CD1 4.16Å; A289-F301 HydrophobicContact CB-CE1 3.94Å; I294-F301 HydrophobicContact CD1-CD2 4.45Å; I294-F301 HydrophobicContact CD1-CE2 4.17Å; I294-F301 HydrophobicContact CG2-CB 3.8Å; I294-F301 HydrophobicContact CG2-CD1 3.86Å; I294-F301 HydrophobicContact CG2-CD2 3.83Å; I294-F301 HydrophobicContact CG2-CE1 4.37Å; I294-F301 HydrophobicContact CG2-CE2 4.35Å; I294-F301 HydrophobicContact CG2-CG 3.57Å; R297-F301 PolarHBondContact O-N 3.19Å; I298-F301 WeakPolarHBondContact O-CB 3.38Å; I298-F301 PolarHBondContact O-N 2.94Å; I298-F301 VanDerWaalsContact O-N 3.17Å; F301-S305 PolarHBondContact O-N 2.97Å; F301-S305 VanDerWaalsContact O-N 3.15Å; F301-W338 AromaticContact CD1-NE1 3.46Å; F301-W338 AromaticContact CD2-CZ2 3.61Å; F301-W338 HydrophobicContact CD2-CZ2 3.61Å; F301-W338 AromaticContact CE1-CD1 3.76Å; F301-W338 AromaticContact CE1-CE2 3.88Å; F301-W338 HydrophobicContact CE1-CZ2 4.31Å; F301-W338 AromaticContact CE1-NE1 3Å; F301-W338 AromaticContact CE2-CE2 3.65Å; F301-W338 HydrophobicContact CE2-CH2 4.26Å; F301-W338 AromaticContact CE2-CZ2 3.26Å; F301-W338 HydrophobicContact CE2-CZ2 3.26Å; F301-W338 AromaticContact CE2-NE1 3.64Å; F301-W338 HydrophobicContact CG-CZ2 4.25Å; F301-W338 AromaticContact CG-NE1 3.96Å; F301-W338 AromaticContact CZ-CD1 3.99Å; F301-W338 AromaticContact CZ-CE2 3.5Å; F301-W338 VanDerWaalsContact CZ-CE2 3.5Å; F301-W338 AromaticContact CZ-CZ2 3.66Å; F301-W338 HydrophobicContact CZ-CZ2 3.66Å; F301-W338 AromaticContact CZ-NE1 3.09Å; F301-V342 HydrophobicContact CD1-CG1 4.11Å; F301-V342 HydrophobicContact CD1-CG2 3.66Å; F301-V342 HydrophobicContact CE1-CG2 3.62Å
302F93.8Very high92.7Very high1 Ų155.5 Ų55.50%0.00425%0.248CC..Hα-helixtrans-60.9-52.6170.4-177.8-118.3000111.8Y235 M242 I298 Q299 Y300 I304 S305 V306 L339 V342 L343 T346 L406Y235-F302 HydrophobicContact CE2-CE1 4.14Å; Y235-F302 HydrophobicContact CE2-CZ 4.49Å; M242-F302 HydrophobicContact CE-CZ 4.29Å; M242-F302 HydrophobicContact SD-CZ 4Å; I298-F302 PolarHBondContact O-N 3.04Å; Q299-F302 WeakPolarHBondContact O-CB 3.5Å; Y300-F302 PolarHBondContact O-N 2.91Å; F302-I304 VanDerWaalsContact C-N 3.31Å; F302-I304 PolarHBondContact O-N 3.43Å; F302-S305 WeakPolarHBondContact O-CB 3.5Å; F302-S305 PolarHBondContact O-N 2.82Å; F302-S305 PolarHBondContact O-OG 3.37Å; F302-V306 HydrophobicContact CE1-CG2 4.36Å; F302-V306 HydrophobicContact CE2-CG2 4.35Å; F302-V306 HydrophobicContact CZ-CG2 4.17Å; F302-V306 PolarHBondContact O-N 3.3Å; F302-V306 VanDerWaalsContact O-N 3.14Å; F302-L339 HydrophobicContact CE2-CG 4.26Å; F302-V342 HydrophobicContact CB-CG1 3.77Å; F302-V342 HydrophobicContact CD2-CB 4.33Å; F302-V342 HydrophobicContact CD2-CG1 4.14Å; F302-V342 HydrophobicContact CG-CG1 4.41Å; F302-L343 HydrophobicContact CE2-CB 4.28Å; F302-L343 HydrophobicContact CE2-CD1 3.72Å; F302-L343 HydrophobicContact CZ-CD1 3.62Å; F302-T346 HydrophobicContact CB-CG2 4.41Å; F302-L406 HydrophobicContact CD1-CD1 4.15Å; F302-L406 HydrophobicContact CE1-CD1 3.66Å
303A95.2Very high93.3Very high0 Ų046.4 Ų46.40%021%0.209CC..Hα-helixtrans-57.7-42.4179.400000112.2Q299 Y300 S305 V306 L307 S403 L406 F407Q299-A303 PolarHBondContact O-N 2.93Å; Q299-A303 VanDerWaalsContact O-N 3.12Å; Y300-A303 PolarHBondContact O-N 2.85Å; A303-S305 VanDerWaalsContact C-N 3.3Å; A303-S305 PolarHBondContact O-N 3.38Å; A303-V306 WeakPolarHBondContact O-CB 3.16Å; A303-V306 PolarHBondContact O-N 2.81Å; A303-V306 VanDerWaalsContact O-N 3.1Å; A303-L307 PolarHBondContact O-N 3.13Å; A303-S403 PolarHBondContact O-OG 3.14Å; A303-L406 HydrophobicContact CB-CB 4.18Å; A303-F407 HydrophobicContact CB-CB 3.98Å; A303-F407 HydrophobicContact CB-CD2 4.06Å
304I95.8Very high93.7Very high76 Ų7637.5 Ų37.539%0.3918%0.18SC..Hα-helixtrans-60.5-39.3175.9-66164.6000111.4Y300 F302 V306 L307 Y308 W338Y300-I304 VanDerWaalsContact O-CG1 3.3Å; Y300-I304 WeakPolarHBondContact O-CG1 3.24Å; Y300-I304 PolarHBondContact O-N 3.23Å; F302-I304 VanDerWaalsContact C-N 3.31Å; F302-I304 PolarHBondContact O-N 3.43Å; I304-V306 VanDerWaalsContact C-N 3.3Å; I304-V306 PolarHBondContact O-N 3.27Å; I304-L307 WeakPolarHBondContact O-CB 3.25Å; I304-L307 PolarHBondContact O-N 3.45Å; I304-Y308 WeakPolarHBondContact O-CB 3.49Å; I304-Y308 PolarHBondContact O-N 3.15Å; I304-W338 HydrophobicContact CB-CH2 4.42Å; I304-W338 HydrophobicContact CB-CZ2 4.44Å; I304-W338 HydrophobicContact CG2-CH2 3.6Å; I304-W338 HydrophobicContact CG2-CZ2 4.08Å; I304-W338 HydrophobicContact CG2-CZ3 4.47Å
305S95.9Very high93.9Very high0 Ų040 Ų400%019%0.194CC..Hα-helixtrans-62.4-37.8175.780.40000112.3F301 F302 A303 Y308 N309F301-S305 PolarHBondContact O-N 2.97Å; F301-S305 VanDerWaalsContact O-N 3.15Å; F302-S305 WeakPolarHBondContact O-CB 3.5Å; F302-S305 PolarHBondContact O-N 2.82Å; F302-S305 PolarHBondContact O-OG 3.37Å; A303-S305 VanDerWaalsContact C-N 3.3Å; A303-S305 PolarHBondContact O-N 3.38Å; S305-Y308 PolarHBondContact O-N 3.12Å; S305-N309 PolarHBondContact O-N 3.34Å; S305-N309 PolarHBondContact O-ND2 3.39Å
306V96.2Very high94.1Very high0 Ų036.7 Ų36.70%018%0.181CC..Hα-helixtrans-68.9-43176.4-176.80000110.6M242 F302 A303 I304 Y308 N309 G310 L339 L399 L406M242-V306 HydrophobicContact CG-CG1 3.99Å; M242-V306 HydrophobicContact CG-CG2 4.47Å; M242-V306 HydrophobicContact SD-CG1 4.18Å; M242-V306 HydrophobicContact SD-CG2 3.58Å; M242-V306 VanDerWaalsContact SD-CG2 3.58Å; F302-V306 HydrophobicContact CE1-CG2 4.36Å; F302-V306 HydrophobicContact CE2-CG2 4.35Å; F302-V306 HydrophobicContact CZ-CG2 4.17Å; F302-V306 PolarHBondContact O-N 3.3Å; F302-V306 VanDerWaalsContact O-N 3.14Å; A303-V306 WeakPolarHBondContact O-CB 3.16Å; A303-V306 PolarHBondContact O-N 2.81Å; A303-V306 VanDerWaalsContact O-N 3.1Å; I304-V306 VanDerWaalsContact C-N 3.3Å; I304-V306 PolarHBondContact O-N 3.27Å; V306-Y308 VanDerWaalsContact C-N 3.3Å; V306-Y308 PolarHBondContact O-N 3.43Å; V306-N309 PolarHBondContact O-N 3.23Å; V306-G310 PolarHBondContact O-N 3.12Å; V306-L339 HydrophobicContact CG2-CD1 4.03Å; V306-L399 HydrophobicContact CG1-CB 4.42Å; V306-L399 HydrophobicContact CG1-CD2 4.35Å; V306-L399 WeakPolarHBondContact CG1-O 3.43Å; V306-L406 HydrophobicContact CG2-CD1 4.33Å
307L97Very high94.4Very high69 Ų6933.8 Ų33.836%0.36116%0.163SC..Hα-helixtrans-57-47.1174.5-171.260.9000111.1A303 I304 N309 G310 V311 I400 S403A303-L307 PolarHBondContact O-N 3.13Å; I304-L307 WeakPolarHBondContact O-CB 3.25Å; I304-L307 PolarHBondContact O-N 3.45Å; L307-N309 PolarHBondContact O-N 2.91Å; L307-G310 PolarHBondContact O-N 3.4Å; L307-G310 VanDerWaalsContact O-N 3.12Å; L307-V311 WeakPolarHBondContact O-CG2 3.39Å; L307-V311 PolarHBondContact O-N 2.97Å; L307-I400 HydrophobicContact CD1-CB 4.46Å; L307-I400 HydrophobicContact CD1-CG1 4.15Å; L307-I400 HydrophobicContact CD1-CG2 4.11Å; L307-S403 VanDerWaalsContact CB-OG 3.32Å; L307-S403 WeakPolarHBondContact CB-OG 3.36Å; L307-S403 PolarHBondContact N-OG 3.37Å
308Y97Very high94.4Very high70 Ų7032.1 Ų32.128%0.27517%0.165SC..Hα-helixtrans-61.6-43.2-179.2-174.6-98.2000111.7I304 S305 V306 G310 V311 C312 F331 F334 A335I304-Y308 WeakPolarHBondContact O-CB 3.49Å; I304-Y308 PolarHBondContact O-N 3.15Å; S305-Y308 PolarHBondContact O-N 3.12Å; V306-Y308 VanDerWaalsContact C-N 3.3Å; V306-Y308 PolarHBondContact O-N 3.43Å; Y308-G310 PolarHBondContact O-N 3.22Å; Y308-V311 PolarHBondContact O-N 3.27Å; Y308-C312 PolarHBondContact O-N 2.75Å; Y308-C312 PolarHBondContact O-SG 3.42Å; Y308-F331 WeakPolarHBondContact OH-CD1 3.29Å; Y308-F334 AromaticContact CE1-CD1 3.9Å; Y308-F334 HydrophobicContact CE1-CD1 3.9Å; Y308-A335 HydrophobicContact CD1-CB 3.4Å; Y308-A335 HydrophobicContact CE1-CB 3.67Å
309N96.1Very high94.5Very high0 Ų032.6 Ų32.60%017%0.169CC..Hα-helixtrans-58.4-46.4171.2-82.7-92000111.5S305 V306 L307 V311 C312 H313 A335 L399S305-N309 PolarHBondContact O-N 3.34Å; S305-N309 PolarHBondContact O-ND2 3.39Å; V306-N309 PolarHBondContact O-N 3.23Å; L307-N309 PolarHBondContact O-N 2.91Å; N309-V311 PolarHBondContact O-N 2.94Å; N309-C312 WeakPolarHBondContact O-CB 3.44Å; N309-C312 PolarHBondContact O-N 3.36Å; N309-H313 PolarHBondContact O-CD2 3.18Å; N309-H313 PolarHBondContact O-N 3.38Å; N309-A335 HydrophobicContact CB-CB 4.25Å; N309-A335 VanDerWaalsContact ND2-CB 3.34Å; N309-A335 WeakPolarHBondContact ND2-CB 3.39Å; N309-A335 PolarHBondContact ND2-O 2.81Å; N309-A335 VanDerWaalsContact OD1-CB 3.31Å; N309-A335 WeakPolarHBondContact OD1-CB 3.47Å; N309-L399 HydrophobicContact CB-CD1 3.7Å
310G96.4Very high94.4Very high0 Ų037.1 Ų37.10%020%0.196CC..Hα-helixtrans-59.8-46.9179.800000113V306 L307 Y308 C312 H313 V314 G396V306-G310 PolarHBondContact O-N 3.12Å; L307-G310 PolarHBondContact O-N 3.4Å; L307-G310 VanDerWaalsContact O-N 3.12Å; Y308-G310 PolarHBondContact O-N 3.22Å; G310-C312 VanDerWaalsContact C-N 3.35Å; G310-C312 PolarHBondContact O-N 3.13Å; G310-H313 PolarHBondContact O-N 3.32Å; G310-V314 WeakPolarHBondContact O-CG2 3.2Å; G310-V314 PolarHBondContact O-N 3.34Å; G310-G396 WeakPolarHBondContact O-CA 3.48Å
311V96.7Very high94.3Very high64 Ų6439.1 Ų39.139%0.38821%0.211SC..Hα-helixtrans-61.2-43.5175.8173.80000111L307 Y308 N309 H313 V314 L315L307-V311 WeakPolarHBondContact O-CG2 3.39Å; L307-V311 PolarHBondContact O-N 2.97Å; Y308-V311 PolarHBondContact O-N 3.27Å; N309-V311 PolarHBondContact O-N 2.94Å; V311-H313 VanDerWaalsContact C-N 3.28Å; V311-H313 PolarHBondContact O-N 2.9Å; V311-V314 PolarHBondContact O-N 3.16Å; V311-L315 HydrophobicContact CG1-CD1 3.78Å; V311-L315 HydrophobicContact CG1-CG 4.32Å; V311-L315 WeakPolarHBondContact O-CB 3.3Å; V311-L315 VanDerWaalsContact O-CG 3.32Å; V311-L315 WeakPolarHBondContact O-CG 3.12Å; V311-L315 PolarHBondContact O-N 3.38Å
312C95.9Very high94.3Very high11 Ų1141 Ų417%0.07422%0.218CC..Hα-helixtrans-56.8-41.7175.6-68.30000111.8Y308 N309 G310 L315 A316 Y328Y308-C312 PolarHBondContact O-N 2.75Å; Y308-C312 PolarHBondContact O-SG 3.42Å; N309-C312 WeakPolarHBondContact O-CB 3.44Å; N309-C312 PolarHBondContact O-N 3.36Å; G310-C312 VanDerWaalsContact C-N 3.35Å; G310-C312 PolarHBondContact O-N 3.13Å; C312-L315 PolarHBondContact O-N 2.89Å; C312-A316 PolarHBondContact O-N 2.81Å; C312-Y328 HydrophobicContact CB-CE2 4.46Å; C312-Y328 WeakPolarHBondContact O-CE2 3.27Å
313H95.2Very high94.3Very high0 Ų048.7 Ų48.70%025%0.251CS..Hα-helixtrans-72.3-37.2178.8-65.1-44.2000113.8P249 N309 G310 V311 L315 A316 Y328 F332 L399P249-H313 WeakPolarHBondContact CB-CE1 3.43Å; P249-H313 WeakPolarHBondContact CB-ND1 3.32Å; N309-H313 PolarHBondContact O-CD2 3.18Å; N309-H313 PolarHBondContact O-N 3.38Å; G310-H313 PolarHBondContact O-N 3.32Å; V311-H313 VanDerWaalsContact C-N 3.28Å; V311-H313 PolarHBondContact O-N 2.9Å; H313-L315 PolarHBondContact O-N 3.22Å; H313-A316 VanDerWaalsContact O-CB 3.31Å; H313-A316 WeakPolarHBondContact O-CB 3.41Å; H313-A316 PolarHBondContact O-N 3.4Å; H313-Y328 PolarHBondContact CE1-OH 2.85Å; H313-Y328 AromaticContact ND1-CZ 3.93Å; H313-Y328 PolarHBondContact ND1-OH 3.38Å; H313-F332 AromaticContact CE1-CD2 3.53Å; H313-F332 AromaticContact CE1-CE1 3.98Å; H313-F332 AromaticContact CE1-CE2 3.31Å; H313-F332 WeakPolarHBondContact CE1-CE2 3.29Å; H313-F332 AromaticContact CE1-CG 3.99Å; H313-F332 AromaticContact CE1-CZ 3.56Å; H313-F332 AromaticContact NE2-CD2 3.99Å; H313-F332 AromaticContact NE2-CE2 3.56Å; H313-L399 VanDerWaalsContact CD2-CD1 3.5Å; H313-L399 WeakPolarHBondContact CD2-CD1 3.03Å
314V95.9Very high94.3Very high49 Ų4949.5 Ų49.530%0.29726%0.26SS..Hα-helixtrans-63.3-35.1174.2173.90000111.2G310 V311 P317 I400G310-V314 WeakPolarHBondContact O-CG2 3.2Å; G310-V314 PolarHBondContact O-N 3.34Å; V311-V314 PolarHBondContact O-N 3.16Å; V314-P317 WeakPolarHBondContact O-CD 3.43Å; V314-I400 HydrophobicContact CG2-CD1 3.86Å
315L93.9Very high94.3Very high93 Ų9346 Ų4649%0.48724%0.241SC..Hα-helixtrans-84.8-12.7178.9-63178.2000113.8V311 C312 H313 P317 L318V311-L315 HydrophobicContact CG1-CD1 3.78Å; V311-L315 HydrophobicContact CG1-CG 4.32Å; V311-L315 WeakPolarHBondContact O-CB 3.3Å; V311-L315 VanDerWaalsContact O-CG 3.32Å; V311-L315 WeakPolarHBondContact O-CG 3.12Å; V311-L315 PolarHBondContact O-N 3.38Å; C312-L315 PolarHBondContact O-N 2.89Å; H313-L315 PolarHBondContact O-N 3.22Å; L315-P317 VanDerWaalsContact C-N 3.29Å; L315-L318 HydrophobicContact CB-CD1 4.32Å; L315-L318 HydrophobicContact CD2-CD1 3.88Å; L315-L318 WeakPolarHBondContact O-CB 3.39Å; L315-L318 WeakPolarHBondContact O-CG 3.44Å; L315-L318 PolarHBondContact O-N 2.79Å
316A92.4Very high94.3Very high1 Ų147.6 Ų47.61%0.00825%0.251CS..G310 helixtrans-50.9-38.317900000114.5C312 H313 L318 S319 Y328 Y392C312-A316 PolarHBondContact O-N 2.81Å; H313-A316 VanDerWaalsContact O-CB 3.31Å; H313-A316 WeakPolarHBondContact O-CB 3.41Å; H313-A316 PolarHBondContact O-N 3.4Å; A316-L318 PolarHBondContact O-N 2.88Å; A316-L318 VanDerWaalsContact O-N 3.12Å; A316-S319 VanDerWaalsContact O-CB 3.27Å; A316-S319 WeakPolarHBondContact O-CB 3Å; A316-S319 PolarHBondContact O-N 3.47Å; A316-S319 PolarHBondContact O-OG 2.95Å; A316-S319 VanDerWaalsContact O-OG 3.06Å; A316-Y328 HydrophobicContact CB-CD2 3.79Å; A316-Y328 HydrophobicContact CB-CE1 4.47Å; A316-Y328 HydrophobicContact CB-CE2 3.54Å; A316-Y328 HydrophobicContact CB-CG 4.4Å; A316-Y392 HydrophobicContact CB-CD1 3.55Å; A316-Y392 HydrophobicContact CB-CE1 4.3Å; A316-Y392 HydrophobicContact CB-CG 4.1Å
317P91.9Very high94.3Very high22 Ų2252.1 Ų52.114%0.14327%0.274CS..G310 helixtrans-64.2-12.1178.1-22.434.9000116.2V314 L315 S319 K389 Q393V314-P317 WeakPolarHBondContact O-CD 3.43Å; L315-P317 VanDerWaalsContact C-N 3.29Å; P317-S319 PolarHBondContact O-N 3.02Å; P317-K389 HydrophobicContact CB-CB 4.2Å; P317-K389 HydrophobicContact CB-CD 3.8Å; P317-K389 HydrophobicContact CB-CG 3.62Å; P317-K389 HydrophobicContact CG-CB 4.29Å; P317-K389 HydrophobicContact CG-CD 4.38Å; P317-K389 HydrophobicContact CG-CG 3.7Å; P317-Q393 HydrophobicContact CG-CG 3.88Å
318L90.8Very high94.3Very high135 Ų13549.3 Ų49.371%0.70726%0.259SS*.G310 helixtrans-71.5-12.9171.9-61.7173000112.1L315 A316 V320L315-L318 HydrophobicContact CB-CD1 4.32Å; L315-L318 HydrophobicContact CD2-CD1 3.88Å; L315-L318 WeakPolarHBondContact O-CB 3.39Å; L315-L318 WeakPolarHBondContact O-CG 3.44Å; L315-L318 PolarHBondContact O-N 2.79Å; A316-L318 PolarHBondContact O-N 2.88Å; A316-L318 VanDerWaalsContact O-N 3.12Å; L318-V320 PolarHBondContact O-N 2.94Å
319S89.7Confident94.3Very high10 Ų1046 Ų467%0.0725%0.246CC..  trans-80.3104.4177.3-50.10000110.2A316 P317 G324 F325A316-S319 VanDerWaalsContact O-CB 3.27Å; A316-S319 WeakPolarHBondContact O-CB 3Å; A316-S319 PolarHBondContact O-N 3.47Å; A316-S319 PolarHBondContact O-OG 2.95Å; A316-S319 VanDerWaalsContact O-OG 3.06Å; P317-S319 PolarHBondContact O-N 3.02Å; S319-G324 PolarHBondContact OG-O 3.19Å; S319-F325 WeakPolarHBondContact O-CE2 3.43Å
320V88.3Confident94.3Very high99 Ų9949.4 Ų49.460%0.626%0.264SS*.  trans-99.5-42.3178.4-175.80000110.8L318L318-V320 PolarHBondContact O-N 2.94Å
321D92.4Very high94.3Very high96 Ų9654.2 Ų54.251%0.51329%0.285SS..SBendtrans-112.2166.3-175.343.8-66.3000112.4K323 G324 F325D321-K323 PolarHBondContact O-N 3.05Å; D321-K323 VanDerWaalsContact O-N 3.15Å; D321-G324 WeakPolarHBondContact O-CA 3.35Å; D321-G324 PolarHBondContact O-N 3.25Å; D321-F325 PolarHBondContact O-N 2.92Å; D321-F325 VanDerWaalsContact O-N 3.12Å
322Y93.2Very high94.3Very high66 Ų6651.2 Ų51.226%0.25927%0.266SS..Hα-helixtrans-54.5-37.7-174.3178.1-114.1000113.2I262 K266 F269 L270 F325 V326I262-Y322 HydrophobicContact CG2-CD2 4.05Å; K266-Y322 HydrophobicContact CB-CD2 3.9Å; K266-Y322 HydrophobicContact CB-CE2 3.62Å; K266-Y322 HydrophobicContact CD-CD1 4.38Å; K266-Y322 HydrophobicContact CD-CD2 4.31Å; K266-Y322 HydrophobicContact CD-CE1 4.48Å; K266-Y322 HydrophobicContact CD-CE2 4.43Å; K266-Y322 HydrophobicContact CD-CG 4.28Å; K266-Y322 HydrophobicContact CG-CE2 4.21Å; K266-Y322 WeakPolarHBondContact O-CE2 3.36Å; F269-Y322 VanDerWaalsContact CD1-OH 3.31Å; F269-Y322 WeakPolarHBondContact CD1-OH 3.27Å; L270-Y322 HydrophobicContact CD2-CD2 4.39Å; L270-Y322 HydrophobicContact CD2-CE2 3.94Å; L270-Y322 HydrophobicContact CG-CE2 4.35Å; Y322-F325 PolarHBondContact O-N 3.23Å; Y322-V326 HydrophobicContact CD1-CG2 4.26Å; Y322-V326 HydrophobicContact CD2-CG2 4.28Å; Y322-V326 HydrophobicContact CE1-CG2 3.83Å; Y322-V326 HydrophobicContact CE2-CG2 3.84Å; Y322-V326 HydrophobicContact CG-CG2 4.47Å; Y322-V326 WeakPolarHBondContact O-CG2 3.26Å; Y322-V326 PolarHBondContact O-N 3.4Å
323K94.8Very high94.3Very high162 Ų16250.7 Ų50.770%0.70426%0.263SS*.Hα-helixtrans-62.8-43.4177-68.1-177.7-179.6177.90111.5D321 F325 V326 I327D321-K323 PolarHBondContact O-N 3.05Å; D321-K323 VanDerWaalsContact O-N 3.15Å; K323-F325 PolarHBondContact O-N 3.42Å; K323-V326 PolarHBondContact O-N 2.97Å; K323-I327 WeakPolarHBondContact O-CG1 3.48Å; K323-I327 PolarHBondContact O-N 2.91Å
324G95.3Very high94.3Very high17 Ų1753.6 Ų53.618%0.17528%0.276CS..Hα-helixtrans-58.6-45.9174.600000112.1S319 D321 V326 I327 Y328S319-G324 PolarHBondContact OG-O 3.19Å; D321-G324 WeakPolarHBondContact O-CA 3.35Å; D321-G324 PolarHBondContact O-N 3.25Å; G324-V326 PolarHBondContact O-N 3.36Å; G324-I327 PolarHBondContact O-N 3.39Å; G324-Y328 WeakPolarHBondContact O-CB 3.29Å; G324-Y328 PolarHBondContact O-N 3.48Å
325F95.4Very high94.3Very high1 Ų151.3 Ų51.30%0.00426%0.261CS..Hα-helixtrans-64.7-36.2177-84.3-78.1000113.7L253 Y256 A257 K260 I262 L270 S319 D321 Y322 K323 Y328 A329L253-F325 HydrophobicContact CD1-CD1 4.27Å; Y256-F325 AromaticContact CD1-CE1 3.45Å; Y256-F325 HydrophobicContact CD1-CE1 3.45Å; Y256-F325 VanDerWaalsContact CD1-CE1 3.45Å; Y256-F325 AromaticContact CD1-CZ 3.75Å; Y256-F325 HydrophobicContact CD1-CZ 3.75Å; Y256-F325 HydrophobicContact CD2-CZ 4.27Å; Y256-F325 AromaticContact CE1-CE1 3.71Å; Y256-F325 HydrophobicContact CE1-CE1 3.71Å; Y256-F325 AromaticContact CE1-CZ 3.73Å; Y256-F325 HydrophobicContact CE1-CZ 3.73Å; Y256-F325 HydrophobicContact CE2-CZ 4.31Å; Y256-F325 AromaticContact CG-CE1 3.96Å; Y256-F325 HydrophobicContact CG-CE1 3.96Å; Y256-F325 HydrophobicContact CG-CZ 4.01Å; A257-F325 HydrophobicContact CB-CD1 4.45Å; A257-F325 HydrophobicContact CB-CE1 4.49Å; K260-F325 HydrophobicContact CB-CE2 4.36Å; K260-F325 HydrophobicContact CG-CE2 4.14Å; K260-F325 HydrophobicContact CG-CZ 4.26Å; I262-F325 HydrophobicContact CD1-CD2 3.46Å; I262-F325 VanDerWaalsContact CD1-CD2 3.46Å; I262-F325 HydrophobicContact CD1-CE2 3.86Å; I262-F325 HydrophobicContact CD1-CG 4.24Å; L270-F325 HydrophobicContact CD1-CB 3.75Å; L270-F325 HydrophobicContact CD1-CD1 4.21Å; L270-F325 HydrophobicContact CD1-CG 4.19Å; L270-F325 HydrophobicContact CD2-CB 3.88Å; L270-F325 HydrophobicContact CG-CB 4.48Å; S319-F325 WeakPolarHBondContact O-CE2 3.43Å; D321-F325 PolarHBondContact O-N 2.92Å; D321-F325 VanDerWaalsContact O-N 3.12Å; Y322-F325 PolarHBondContact O-N 3.23Å; K323-F325 PolarHBondContact O-N 3.42Å; F325-Y328 PolarHBondContact O-N 3.03Å; F325-A329 VanDerWaalsContact O-CB 3.32Å; F325-A329 WeakPolarHBondContact O-CB 3.29Å; F325-A329 PolarHBondContact O-N 3.3Å
326V96.5Very high94.3Very high34 Ų3447.3 Ų47.321%0.20624%0.24CC..Hα-helixtrans-64.6-45.5174.2169.70000110.6L270 V273 Y322 K323 G324 Y328 A329 I330L270-V326 HydrophobicContact CD2-CB 4.44Å; L270-V326 HydrophobicContact CD2-CG2 3.71Å; V273-V326 HydrophobicContact CG1-CG1 4.49Å; Y322-V326 HydrophobicContact CD1-CG2 4.26Å; Y322-V326 HydrophobicContact CD2-CG2 4.28Å; Y322-V326 HydrophobicContact CE1-CG2 3.83Å; Y322-V326 HydrophobicContact CE2-CG2 3.84Å; Y322-V326 HydrophobicContact CG-CG2 4.47Å; Y322-V326 WeakPolarHBondContact O-CG2 3.26Å; Y322-V326 PolarHBondContact O-N 3.4Å; K323-V326 PolarHBondContact O-N 2.97Å; G324-V326 PolarHBondContact O-N 3.36Å; V326-Y328 VanDerWaalsContact C-N 3.33Å; V326-Y328 PolarHBondContact O-N 3.49Å; V326-A329 PolarHBondContact O-N 2.83Å; V326-I330 HydrophobicContact CG1-CD1 4.13Å; V326-I330 WeakPolarHBondContact O-CG1 3.23Å; V326-I330 PolarHBondContact O-N 3.43Å
327I96.5Very high94.2Very high95 Ų9547.2 Ų47.249%0.48724%0.24SC..Hα-helixtrans-59.9-46176.3-67.2166.3000110.3K323 G324 A329 I330 F331K323-I327 WeakPolarHBondContact O-CG1 3.48Å; K323-I327 PolarHBondContact O-N 2.91Å; G324-I327 PolarHBondContact O-N 3.39Å; I327-A329 PolarHBondContact O-N 3.01Å; I327-I330 PolarHBondContact O-N 3.17Å; I327-F331 HydrophobicContact CG2-CD2 3.75Å; I327-F331 HydrophobicContact CG2-CE2 3.48Å; I327-F331 VanDerWaalsContact CG2-CE2 3.48Å; I327-F331 VanDerWaalsContact O-CD2 3.24Å; I327-F331 WeakPolarHBondContact O-CD2 3.49Å; I327-F331 PolarHBondContact O-N 3.27Å; I327-F331 VanDerWaalsContact O-N 3.13Å
328Y96.3Very high94.4Very high11 Ų1147.5 Ų47.54%0.04324%0.238CC..Hα-helixtrans-59-45.3174.7168.5-104.3000112.3L253 C312 H313 A316 G324 F325 V326 I330 F331 F332 Y392L253-Y328 HydrophobicContact CD1-CD1 3.99Å; L253-Y328 HydrophobicContact CD1-CE1 3.72Å; C312-Y328 HydrophobicContact CB-CE2 4.46Å; C312-Y328 WeakPolarHBondContact O-CE2 3.27Å; H313-Y328 PolarHBondContact CE1-OH 2.85Å; H313-Y328 AromaticContact ND1-CZ 3.93Å; H313-Y328 PolarHBondContact ND1-OH 3.38Å; A316-Y328 HydrophobicContact CB-CD2 3.79Å; A316-Y328 HydrophobicContact CB-CE1 4.47Å; A316-Y328 HydrophobicContact CB-CE2 3.54Å; A316-Y328 HydrophobicContact CB-CG 4.4Å; G324-Y328 WeakPolarHBondContact O-CB 3.29Å; G324-Y328 PolarHBondContact O-N 3.48Å; F325-Y328 PolarHBondContact O-N 3.03Å; V326-Y328 VanDerWaalsContact C-N 3.33Å; V326-Y328 PolarHBondContact O-N 3.49Å; Y328-I330 VanDerWaalsContact C-N 3.29Å; Y328-I330 PolarHBondContact O-N 2.97Å; Y328-F331 PolarHBondContact O-N 3.02Å; Y328-F332 HydrophobicContact CE1-CB 4.42Å; Y328-F332 HydrophobicContact CE1-CD1 4.18Å; Y328-F332 HydrophobicContact CE2-CB 4.16Å; Y328-F332 AromaticContact CZ-CD1 3.97Å; Y328-F332 VanDerWaalsContact O-CB 3.29Å; Y328-F332 WeakPolarHBondContact O-CB 3.32Å; Y328-F332 PolarHBondContact O-N 3.14Å; Y328-F332 WeakPolarHBondContact OH-CD1 3.48Å; Y328-Y392 HydrophobicContact CE1-CE1 4.1Å; Y328-Y392 AromaticContact CZ-CE1 3.93Å; Y328-Y392 WeakPolarHBondContact OH-CE1 3.44Å
329A95.8Very high94.5Very high0 Ų041.2 Ų41.20%021%0.205CC..Hα-helixtrans-62.6-34.9178.900000112.6L270 V273 L274 F325 V326 I327 G333L270-A329 HydrophobicContact CD2-CB 4.43Å; V273-A329 HydrophobicContact CB-CB 4.44Å; V273-A329 HydrophobicContact CG1-CB 4.21Å; L274-A329 HydrophobicContact CB-CB 4.41Å; F325-A329 VanDerWaalsContact O-CB 3.32Å; F325-A329 WeakPolarHBondContact O-CB 3.29Å; F325-A329 PolarHBondContact O-N 3.3Å; V326-A329 PolarHBondContact O-N 2.83Å; I327-A329 PolarHBondContact O-N 3.01Å; A329-G333 PolarHBondContact O-N 3.27Å
330I97.2Very high94.5Very high72 Ų7242 Ų4237%0.36921%0.21SC..Hα-helixtrans-64.7-52.7174.2-67.8164.7000110.4V273 V277 V326 I327 Y328 F332 G333 F334V273-I330 HydrophobicContact CG1-CG1 3.76Å; V277-I330 HydrophobicContact CG1-CG2 4.44Å; V277-I330 WeakPolarHBondContact CG1-O 3.46Å; V277-I330 HydrophobicContact CG2-CB 4.37Å; V277-I330 HydrophobicContact CG2-CG1 4.16Å; V277-I330 HydrophobicContact CG2-CG2 4.21Å; V326-I330 HydrophobicContact CG1-CD1 4.13Å; V326-I330 WeakPolarHBondContact O-CG1 3.23Å; V326-I330 PolarHBondContact O-N 3.43Å; I327-I330 PolarHBondContact O-N 3.17Å; Y328-I330 VanDerWaalsContact C-N 3.29Å; Y328-I330 PolarHBondContact O-N 2.97Å; I330-F332 VanDerWaalsContact C-N 3.34Å; I330-F332 PolarHBondContact O-N 2.94Å; I330-G333 PolarHBondContact O-N 2.88Å; I330-F334 PolarHBondContact O-N 2.82Å
331F97.2Very high94.4Very high101 Ų10138.1 Ų38.144%0.44319%0.188SC..Hα-helixtrans-63.3-41.9-179.8-73-56.6000112.2Y308 I327 Y328 F334 A335Y308-F331 WeakPolarHBondContact OH-CD1 3.29Å; I327-F331 HydrophobicContact CG2-CD2 3.75Å; I327-F331 HydrophobicContact CG2-CE2 3.48Å; I327-F331 VanDerWaalsContact CG2-CE2 3.48Å; I327-F331 VanDerWaalsContact O-CD2 3.24Å; I327-F331 WeakPolarHBondContact O-CD2 3.49Å; I327-F331 PolarHBondContact O-N 3.27Å; I327-F331 VanDerWaalsContact O-N 3.13Å; Y328-F331 PolarHBondContact O-N 3.02Å; F331-F334 PolarHBondContact O-N 2.63Å; F331-A335 VanDerWaalsContact O-CB 3.28Å; F331-A335 WeakPolarHBondContact O-CB 3.44Å; F331-A335 PolarHBondContact O-N 3.44Å
332F95.8Very high94.3Very high0 Ų033.5 Ų33.50%016%0.163CC..Hα-helixtrans-65.9-42.6176.6-178.3-151.2000112.1P249 L250 L274 H313 Y328 I330 F334 A335 F336P249-F332 HydrophobicContact CB-CE1 4.4Å; P249-F332 HydrophobicContact CB-CZ 4.39Å; L250-F332 HydrophobicContact CB-CE1 4Å; L250-F332 HydrophobicContact CB-CZ 3.95Å; L250-F332 HydrophobicContact CD1-CZ 4.49Å; L250-F332 HydrophobicContact CG-CE1 4.49Å; L274-F332 HydrophobicContact CD1-CD1 3.27Å; L274-F332 HydrophobicContact CD1-CE1 3.55Å; L274-F332 HydrophobicContact CD1-CG 4.04Å; L274-F332 HydrophobicContact CG-CD1 4.39Å; H313-F332 AromaticContact CE1-CD2 3.53Å; H313-F332 AromaticContact CE1-CE1 3.98Å; H313-F332 AromaticContact CE1-CE2 3.31Å; H313-F332 WeakPolarHBondContact CE1-CE2 3.29Å; H313-F332 AromaticContact CE1-CG 3.99Å; H313-F332 AromaticContact CE1-CZ 3.56Å; H313-F332 AromaticContact NE2-CD2 3.99Å; H313-F332 AromaticContact NE2-CE2 3.56Å; Y328-F332 HydrophobicContact CE1-CB 4.42Å; Y328-F332 HydrophobicContact CE1-CD1 4.18Å; Y328-F332 HydrophobicContact CE2-CB 4.16Å; Y328-F332 AromaticContact CZ-CD1 3.97Å; Y328-F332 VanDerWaalsContact O-CB 3.29Å; Y328-F332 WeakPolarHBondContact O-CB 3.32Å; Y328-F332 PolarHBondContact O-N 3.14Å; Y328-F332 WeakPolarHBondContact OH-CD1 3.48Å; I330-F332 VanDerWaalsContact C-N 3.34Å; I330-F332 PolarHBondContact O-N 2.94Å; F332-F334 VanDerWaalsContact C-N 3.33Å; F332-F334 PolarHBondContact O-N 3.11Å; F332-A335 WeakPolarHBondContact O-CB 3.38Å; F332-A335 PolarHBondContact O-N 3.14Å; F332-F336 HydrophobicContact CD2-CB 4.47Å; F332-F336 HydrophobicContact CE2-CB 4.29Å; F332-F336 HydrophobicContact CE2-CD2 4.27Å; F332-F336 VanDerWaalsContact O-CB 3.27Å; F332-F336 WeakPolarHBondContact O-CB 3.44Å; F332-F336 PolarHBondContact O-N 3.46Å
333G95.3Very high94.2Very high0 Ų031.3 Ų31.30%016%0.156CC..Hα-helixtrans-60.5-41.8175.400000112.6D278 A329 I330 F336 G337D278-G333 WeakPolarHBondContact CA-O 3.4Å; A329-G333 PolarHBondContact O-N 3.27Å; I330-G333 PolarHBondContact O-N 2.88Å; G333-F336 PolarHBondContact O-N 3.39Å; G333-G337 PolarHBondContact O-N 3.06Å
334F96.8Very high93.7Very high62 Ų6226.8 Ų26.827%0.27214%0.136SC..Hα-helixtrans-63.5-47.8174.7-178.6-95.8000111.7V277 A281 M285 Y308 I330 F331 F332 F336 G337 W338V277-F334 HydrophobicContact CG1-CB 3.9Å; A281-F334 HydrophobicContact CB-CB 4.44Å; A281-F334 HydrophobicContact CB-CD2 3.66Å; A281-F334 HydrophobicContact CB-CE2 4.24Å; A281-F334 HydrophobicContact CB-CG 4.29Å; M285-F334 HydrophobicContact CE-CE2 4.07Å; M285-F334 HydrophobicContact CE-CZ 3.88Å; M285-F334 HydrophobicContact CG-CE2 4.36Å; M285-F334 HydrophobicContact CG-CZ 4.19Å; M285-F334 HydrophobicContact SD-CE2 4.37Å; M285-F334 HydrophobicContact SD-CZ 3.78Å; Y308-F334 AromaticContact CE1-CD1 3.9Å; Y308-F334 HydrophobicContact CE1-CD1 3.9Å; I330-F334 PolarHBondContact O-N 2.82Å; F331-F334 PolarHBondContact O-N 2.63Å; F332-F334 VanDerWaalsContact C-N 3.33Å; F332-F334 PolarHBondContact O-N 3.11Å; F334-F336 VanDerWaalsContact C-N 3.33Å; F334-F336 PolarHBondContact O-N 2.72Å; F334-G337 PolarHBondContact O-N 2.76Å; F334-W338 AromaticContact CE1-CE3 3.83Å; F334-W338 HydrophobicContact CE1-CE3 3.83Å; F334-W338 HydrophobicContact CE1-CZ3 4.34Å; F334-W338 WeakPolarHBondContact O-CB 3.35Å; F334-W338 PolarHBondContact O-N 3.49Å
335A95.9Very high93.1Very high0 Ų028.6 Ų28.60%014%0.14CC..Hα-helixtrans-58.6-44.817800000112Y308 N309 F331 F332 L339Y308-A335 HydrophobicContact CD1-CB 3.4Å; Y308-A335 HydrophobicContact CE1-CB 3.67Å; N309-A335 HydrophobicContact CB-CB 4.25Å; N309-A335 VanDerWaalsContact ND2-CB 3.34Å; N309-A335 WeakPolarHBondContact ND2-CB 3.39Å; N309-A335 PolarHBondContact ND2-O 2.81Å; N309-A335 VanDerWaalsContact OD1-CB 3.31Å; N309-A335 WeakPolarHBondContact OD1-CB 3.47Å; F331-A335 VanDerWaalsContact O-CB 3.28Å; F331-A335 WeakPolarHBondContact O-CB 3.44Å; F331-A335 PolarHBondContact O-N 3.44Å; F332-A335 WeakPolarHBondContact O-CB 3.38Å; F332-A335 PolarHBondContact O-N 3.14Å; A335-L339 WeakPolarHBondContact O-CB 3.4Å; A335-L339 PolarHBondContact O-N 2.97Å
336F92.8Very high92.8Very high9 Ų928.5 Ų28.54%0.03914%0.14CC..Hα-helixtrans-68.4-40.8-179.1-169.5-95.7000111.8L246 L250 F332 G333 F334 S340L246-F336 HydrophobicContact CD1-CD2 4.17Å; L246-F336 HydrophobicContact CD1-CE2 4.31Å; L246-F336 HydrophobicContact CD2-CE2 4.25Å; L246-F336 HydrophobicContact CG-CE2 4.16Å; L250-F336 HydrophobicContact CD1-CE2 4.25Å; L250-F336 HydrophobicContact CD1-CZ 4.3Å; F332-F336 HydrophobicContact CD2-CB 4.47Å; F332-F336 HydrophobicContact CE2-CB 4.29Å; F332-F336 HydrophobicContact CE2-CD2 4.27Å; F332-F336 VanDerWaalsContact O-CB 3.27Å; F332-F336 WeakPolarHBondContact O-CB 3.44Å; F332-F336 PolarHBondContact O-N 3.46Å; G333-F336 PolarHBondContact O-N 3.39Å; F334-F336 VanDerWaalsContact C-N 3.33Å; F334-F336 PolarHBondContact O-N 2.72Å; F336-S340 VanDerWaalsContact O-CB 3.3Å; F336-S340 WeakPolarHBondContact O-CB 3.35Å; F336-S340 PolarHBondContact O-N 3.4Å; F336-S340 PolarHBondContact O-OG 3.31Å
337G91.5Very high92.4Very high0 Ų026.9 Ų26.90%013%0.13CC..Hα-helixtrans-68.1-3917600000113.2D278 G333 F334 S341D278-G337 WeakPolarHBondContact OD1-CA 3.33Å; G333-G337 PolarHBondContact O-N 3.06Å; F334-G337 PolarHBondContact O-N 2.76Å; G337-S341 PolarHBondContact O-N 2.93Å; G337-S341 VanDerWaalsContact O-N 3.13Å; G337-S341 PolarHBondContact O-OG 3.1Å
338W95Very high91.6Very high27 Ų2725.6 Ų25.610%0.10212%0.122CC..Hα-helixtrans-58.1-55.8171.2-175.4-2.5000110.9M285 F301 I304 F334 S340 S341 V342M285-W338 HydrophobicContact CB-CB 4.23Å; M285-W338 HydrophobicContact CB-CG 4.13Å; M285-W338 HydrophobicContact CG-CB 3.78Å; M285-W338 HydrophobicContact CG-CD2 4.4Å; M285-W338 HydrophobicContact CG-CG 3.8Å; M285-W338 HydrophobicContact SD-CD2 4.21Å; M285-W338 HydrophobicContact SD-CG 4.2Å; F301-W338 AromaticContact CD1-NE1 3.46Å; F301-W338 AromaticContact CD2-CZ2 3.61Å; F301-W338 HydrophobicContact CD2-CZ2 3.61Å; F301-W338 AromaticContact CE1-CD1 3.76Å; F301-W338 AromaticContact CE1-CE2 3.88Å; F301-W338 HydrophobicContact CE1-CZ2 4.31Å; F301-W338 AromaticContact CE1-NE1 3Å; F301-W338 AromaticContact CE2-CE2 3.65Å; F301-W338 HydrophobicContact CE2-CH2 4.26Å; F301-W338 AromaticContact CE2-CZ2 3.26Å; F301-W338 HydrophobicContact CE2-CZ2 3.26Å; F301-W338 AromaticContact CE2-NE1 3.64Å; F301-W338 HydrophobicContact CG-CZ2 4.25Å; F301-W338 AromaticContact CG-NE1 3.96Å; F301-W338 AromaticContact CZ-CD1 3.99Å; F301-W338 AromaticContact CZ-CE2 3.5Å; F301-W338 VanDerWaalsContact CZ-CE2 3.5Å; F301-W338 AromaticContact CZ-CZ2 3.66Å; F301-W338 HydrophobicContact CZ-CZ2 3.66Å; F301-W338 AromaticContact CZ-NE1 3.09Å; I304-W338 HydrophobicContact CB-CH2 4.42Å; I304-W338 HydrophobicContact CB-CZ2 4.44Å; I304-W338 HydrophobicContact CG2-CH2 3.6Å; I304-W338 HydrophobicContact CG2-CZ2 4.08Å; I304-W338 HydrophobicContact CG2-CZ3 4.47Å; F334-W338 AromaticContact CE1-CE3 3.83Å; F334-W338 HydrophobicContact CE1-CE3 3.83Å; F334-W338 HydrophobicContact CE1-CZ3 4.34Å; F334-W338 WeakPolarHBondContact O-CB 3.35Å; F334-W338 PolarHBondContact O-N 3.49Å; W338-S340 VanDerWaalsContact C-N 3.34Å; W338-S340 PolarHBondContact O-N 3.31Å; W338-S341 PolarHBondContact O-N 3.4Å; W338-V342 WeakPolarHBondContact O-CG2 3.27Å; W338-V342 PolarHBondContact O-N 3.46Å
339L93.6Very high91.1Very high4 Ų428.3 Ų28.32%0.02114%0.138CC..Hα-helixtrans-56.1-48.6-179.8-178.3154.9000111.5M242 L246 F302 V306 A335 S341 V342 L343M242-L339 HydrophobicContact SD-CD1 3.8Å; M242-L339 HydrophobicContact SD-CG 4.46Å; L246-L339 HydrophobicContact CD1-CD1 3.91Å; L246-L339 HydrophobicContact CD2-CD1 4.4Å; L246-L339 HydrophobicContact CD2-CD2 3.98Å; F302-L339 HydrophobicContact CE2-CG 4.26Å; V306-L339 HydrophobicContact CG2-CD1 4.03Å; A335-L339 WeakPolarHBondContact O-CB 3.4Å; A335-L339 PolarHBondContact O-N 2.97Å; L339-S341 VanDerWaalsContact C-N 3.25Å; L339-S341 PolarHBondContact O-N 3.42Å; L339-V342 PolarHBondContact O-N 3.07Å; L339-L343 WeakPolarHBondContact O-CB 3.18Å; L339-L343 PolarHBondContact O-N 2.91Å
340S88.4Confident90.6Very high25 Ų2528.9 Ų28.918%0.17514%0.141CC..Hα-helixtrans-60.9-33.1-178.5-61.30000113.3R282 F336 W338R282-S340 PolarHBondContact NH2-OG 3.42Å; F336-S340 VanDerWaalsContact O-CB 3.3Å; F336-S340 WeakPolarHBondContact O-CB 3.35Å; F336-S340 PolarHBondContact O-N 3.4Å; F336-S340 PolarHBondContact O-OG 3.31Å; W338-S340 VanDerWaalsContact C-N 3.34Å; W338-S340 PolarHBondContact O-N 3.31Å
341S87.4Confident90Very high18 Ų1826.5 Ų26.513%0.12613%0.13CC..Hα-helixtrans-72.7-40.6179.8-54.10000112.1R282 G337 W338 L339R282-S341 WeakPolarHBondContact CA-OG 3.25Å; R282-S341 WeakPolarHBondContact CG-OG 3.23Å; R282-S341 PolarHBondContact O-OG 3.07Å; G337-S341 PolarHBondContact O-N 2.93Å; G337-S341 VanDerWaalsContact O-N 3.13Å; G337-S341 PolarHBondContact O-OG 3.1Å; W338-S341 PolarHBondContact O-N 3.4Å; L339-S341 VanDerWaalsContact C-N 3.25Å; L339-S341 PolarHBondContact O-N 3.42Å
342V90.2Very high89Confident0 Ų023.2 Ų23.20%012%0.124CC..Hα-helixtrans-89.1-20.1-171-177.10000111.3A289 I298 F301 F302 W338 L339 F344 E345 T346A289-V342 HydrophobicContact CB-CG2 4.23Å; I298-V342 HydrophobicContact CD1-CG1 4.41Å; I298-V342 HydrophobicContact CG1-CG1 3.9Å; F301-V342 HydrophobicContact CD1-CG1 4.11Å; F301-V342 HydrophobicContact CD1-CG2 3.66Å; F301-V342 HydrophobicContact CE1-CG2 3.62Å; F302-V342 HydrophobicContact CB-CG1 3.77Å; F302-V342 HydrophobicContact CD2-CB 4.33Å; F302-V342 HydrophobicContact CD2-CG1 4.14Å; F302-V342 HydrophobicContact CG-CG1 4.41Å; W338-V342 WeakPolarHBondContact O-CG2 3.27Å; W338-V342 PolarHBondContact O-N 3.46Å; L339-V342 PolarHBondContact O-N 3.07Å; V342-F344 PolarHBondContact O-N 3.16Å; V342-E345 PolarHBondContact O-N 2.72Å; V342-T346 WeakPolarHBondContact CG1-OG1 3.42Å; V342-T346 VanDerWaalsContact O-CB 3.31Å; V342-T346 WeakPolarHBondContact O-CB 3.41Å; V342-T346 PolarHBondContact O-N 3.36Å; V342-T346 PolarHBondContact O-OG1 3.15Å
343L90.3Very high87.8Confident19 Ų1927.2 Ų27.210%0.09916%0.157CC..Hα-helixtrans-52.3-57.4-178.7-174.972.4000112.6Y235 M242 F302 L339 L347Y235-L343 VanDerWaalsContact OH-CD1 3.25Å; Y235-L343 WeakPolarHBondContact OH-CD1 3.31Å; Y235-L343 PolarHBondContact OH-O 2.85Å; M242-L343 HydrophobicContact CE-CD1 4.23Å; F302-L343 HydrophobicContact CE2-CB 4.28Å; F302-L343 HydrophobicContact CE2-CD1 3.72Å; F302-L343 HydrophobicContact CZ-CD1 3.62Å; L339-L343 WeakPolarHBondContact O-CB 3.18Å; L339-L343 PolarHBondContact O-N 2.91Å; L343-L347 PolarHBondContact O-N 2.91Å
344F84.1Confident86.6Confident67 Ų6736.3 Ų36.329%0.29420%0.199SC..Hα-helixtrans-78.2-30.8-177.2-68.5-61.4000113.1V342 L347 M348 F356 V360V342-F344 PolarHBondContact O-N 3.16Å; F344-L347 HydrophobicContact CD1-CD2 4.49Å; F344-L347 PolarHBondContact O-N 3.32Å; F344-M348 WeakPolarHBondContact O-CB 3.31Å; F344-M348 PolarHBondContact O-N 3.33Å; F344-F356 HydrophobicContact CB-CZ 4.16Å; F344-F356 HydrophobicContact CD1-CZ 4.32Å; F344-F356 WeakPolarHBondContact O-CE2 3.32Å; F344-V360 HydrophobicContact CD1-CG2 4.16Å; F344-V360 HydrophobicContact CE1-CG1 4.22Å; F344-V360 HydrophobicContact CE1-CG2 4.27Å
345E84.1Confident85.6Confident55 Ų5538.9 Ų38.926%0.25721%0.207SC..Hα-helixtrans-63-43.3172.8-72.7-67.2159.500111.3R295 I298 V342 L347 M348 D349R295-E345 IonicContact CZ-OE2 3.79Å; R295-E345 IonicContact NH1-OE2 3.42Å; R295-E345 PolarHBondContact NH1-OE2 3.33Å; R295-E345 IonicContact NH2-OE2 3.43Å; R295-E345 PolarHBondContact NH2-OE2 3.02Å; I298-E345 HydrophobicContact CD1-CB 3.69Å; V342-E345 PolarHBondContact O-N 2.72Å; E345-L347 VanDerWaalsContact C-N 3.34Å; E345-L347 PolarHBondContact O-N 2.98Å; E345-M348 PolarHBondContact O-N 3.33Å; E345-D349 WeakPolarHBondContact O-CB 3.34Å; E345-D349 PolarHBondContact O-N 2.82Å
346T88.6Confident84.5Confident0 Ų041 Ų410%022%0.217CC..Hα-helixtrans-61.8-43.3174.8-53.30000111.3Y235 Q299 F302 V342 M348 D349 L350Y235-T346 HydrophobicContact CD2-CG2 4.11Å; Y235-T346 HydrophobicContact CE2-CG2 3.97Å; Q299-T346 HydrophobicContact CB-CG2 4.36Å; Q299-T346 HydrophobicContact CG-CG2 3.75Å; F302-T346 HydrophobicContact CB-CG2 4.41Å; V342-T346 WeakPolarHBondContact CG1-OG1 3.42Å; V342-T346 VanDerWaalsContact O-CB 3.31Å; V342-T346 WeakPolarHBondContact O-CB 3.41Å; V342-T346 PolarHBondContact O-N 3.36Å; V342-T346 PolarHBondContact O-OG1 3.15Å; T346-M348 VanDerWaalsContact C-N 3.33Å; T346-M348 PolarHBondContact O-N 3.4Å; T346-D349 PolarHBondContact O-N 3.36Å; T346-L350 VanDerWaalsContact O-CB 3.27Å; T346-L350 WeakPolarHBondContact O-CB 3.45Å; T346-L350 PolarHBondContact O-N 3.46Å
347L87.1Confident83.5Confident0 Ų045.4 Ų45.40%025%0.248CC..Hα-helixtrans-62.7-40.7176.4-179.161.2000112F232 Y235 L343 F344 E345 L350 V351 F356 A359 V360 V363F232-L347 HydrophobicContact CD2-CD1 3.89Å; F232-L347 HydrophobicContact CE2-CD1 3.88Å; Y235-L347 HydrophobicContact CD1-CD1 4.09Å; Y235-L347 HydrophobicContact CE1-CB 4.25Å; Y235-L347 HydrophobicContact CE1-CD1 3.86Å; Y235-L347 HydrophobicContact CE1-CG 4.47Å; L343-L347 PolarHBondContact O-N 2.91Å; F344-L347 HydrophobicContact CD1-CD2 4.49Å; F344-L347 PolarHBondContact O-N 3.32Å; E345-L347 VanDerWaalsContact C-N 3.34Å; E345-L347 PolarHBondContact O-N 2.98Å; L347-L350 PolarHBondContact O-N 2.92Å; L347-V351 HydrophobicContact CD1-CG2 3.99Å; L347-V351 WeakPolarHBondContact O-CB 3.16Å; L347-V351 PolarHBondContact O-N 2.94Å; L347-F356 HydrophobicContact CB-CE2 4.22Å; L347-F356 HydrophobicContact CD2-CE2 4.12Å; L347-F356 HydrophobicContact CG-CD2 4.29Å; L347-F356 HydrophobicContact CG-CE2 4.11Å; L347-A359 HydrophobicContact CD1-CB 4.1Å; L347-A359 HydrophobicContact CD2-CB 4.41Å; L347-A359 HydrophobicContact CG-CB 4.42Å; L347-V360 HydrophobicContact CD2-CG2 3.72Å; L347-V363 HydrophobicContact CD1-CG2 4.34Å; L347-V363 HydrophobicContact CD2-CG2 4.23Å
348M81.4Confident82.8Confident67 Ų6746.8 Ų46.833%0.3326%0.258SS..Hα-helixtrans-66.4-40.8177.9-169.8-179.6-71.600112.3F344 E345 T346 L350 G352 F356F344-M348 WeakPolarHBondContact O-CB 3.31Å; F344-M348 PolarHBondContact O-N 3.33Å; E345-M348 PolarHBondContact O-N 3.33Å; T346-M348 VanDerWaalsContact C-N 3.33Å; T346-M348 PolarHBondContact O-N 3.4Å; M348-L350 VanDerWaalsContact C-N 3.31Å; M348-G352 WeakPolarHBondContact O-CA 3.4Å; M348-G352 PolarHBondContact O-N 3.17Å; M348-F356 HydrophobicContact CB-CD2 3.73Å; M348-F356 HydrophobicContact CB-CE2 3.76Å; M348-F356 HydrophobicContact CE-CD1 4.11Å; M348-F356 HydrophobicContact CE-CD2 4.28Å; M348-F356 HydrophobicContact CE-CE1 4Å; M348-F356 HydrophobicContact CE-CE2 4.16Å; M348-F356 HydrophobicContact CE-CG 4.25Å; M348-F356 HydrophobicContact CE-CZ 4.02Å; M348-F356 HydrophobicContact CG-CD2 4.11Å; M348-F356 HydrophobicContact CG-CE2 4.46Å
349D85.3Confident82.1Confident68 Ų6845.5 Ų45.536%0.36425%0.253SS..Hα-helixtrans-62.3-39.6175-17470.3000111.8I298 E345 T346I298-D349 HydrophobicContact CG2-CB 4Å; E345-D349 WeakPolarHBondContact O-CB 3.34Å; E345-D349 PolarHBondContact O-N 2.82Å; T346-D349 PolarHBondContact O-N 3.36Å
350L85.5Confident81.5Confident13 Ų1347 Ų477%0.06826%0.263CS..Hα-helixtrans-76.9-38-174.4-163.173.3000113.8H229 G231 Y235 T346 L347 M348H229-L350 PolarHBondContact CE1-O 3.35Å; G231-L350 VanDerWaalsContact C-CD2 3.41Å; G231-L350 WeakPolarHBondContact O-CD2 3.17Å; Y235-L350 HydrophobicContact CD2-CD2 4.38Å; Y235-L350 HydrophobicContact CG-CD2 4Å; T346-L350 VanDerWaalsContact O-CB 3.27Å; T346-L350 WeakPolarHBondContact O-CB 3.45Å; T346-L350 PolarHBondContact O-N 3.46Å; L347-L350 PolarHBondContact O-N 2.92Å; M348-L350 VanDerWaalsContact C-N 3.31Å
351V84.3Confident81.1Confident22 Ų2246.7 Ų46.713%0.13326%0.264CS..Hα-helixtrans-106.7-20.6-172.51730000112.4L226 F232 L347 R355 A359L226-V351 HydrophobicContact CD2-CB 4.38Å; L226-V351 HydrophobicContact CD2-CG1 3.47Å; L226-V351 VanDerWaalsContact CD2-CG1 3.47Å; L226-V351 HydrophobicContact CD2-CG2 3.97Å; F232-V351 HydrophobicContact CB-CG2 4.2Å; F232-V351 HydrophobicContact CD2-CG2 3.67Å; F232-V351 HydrophobicContact CG-CG2 4.28Å; L347-V351 HydrophobicContact CD1-CG2 3.99Å; L347-V351 WeakPolarHBondContact O-CB 3.16Å; L347-V351 PolarHBondContact O-N 2.94Å; V351-R355 HydrophobicContact CG1-CB 3.42Å; V351-R355 VanDerWaalsContact CG1-CB 3.42Å; V351-A359 HydrophobicContact CB-CB 4.39Å; V351-A359 HydrophobicContact CG1-CB 3.95Å; V351-A359 HydrophobicContact CG2-CB 4.17Å
352G76.3Confident80.9Confident31 Ų3146.2 Ų46.232%0.3226%0.26SS..  trans80161-175.300000113.7M348 Q354 R355 F356M348-G352 WeakPolarHBondContact O-CA 3.4Å; M348-G352 PolarHBondContact O-N 3.17Å; G352-Q354 VanDerWaalsContact C-N 3.33Å; G352-Q354 PolarHBondContact O-N 3.45Å; G352-R355 PolarHBondContact O-N 3.39Å; G352-F356 PolarHBondContact O-N 3.28Å
353A70.8Confident80.7Confident84 Ų8446.3 Ų46.369%0.69426%0.26SS*.THydrogen-bonded Turntrans-63-33.2-172.100000114.2
354Q70.3Confident80.4Confident191 Ų19146.7 Ų46.789%0.89326%0.263SS*.THydrogen-bonded Turntrans-68.7-37.6-176.1-68.7-169.8-13.900112.9G352G352-Q354 VanDerWaalsContact C-N 3.33Å; G352-Q354 PolarHBondContact O-N 3.45Å
355R75.6Confident80.4Confident117 Ų11746.5 Ų46.544%0.44227%0.265SS..THydrogen-bonded Turntrans-100.1-0.5-177.1-65.6-175.4-173.9-155.61.4113.4D223 T225 L226 V351 G352 S357 S358 A359D223-R355 IonicContact OD2-NH1 2.72Å; T225-R355 PolarHBondContact OG1-NH1 2.86Å; L226-R355 HydrophobicContact CD2-CB 4.48Å; V351-R355 HydrophobicContact CG1-CB 3.42Å; V351-R355 VanDerWaalsContact CG1-CB 3.42Å; G352-R355 PolarHBondContact O-N 3.39Å; R355-S357 PolarHBondContact O-N 3.39Å; R355-S358 PolarHBondContact O-N 3.24Å; R355-A359 WeakPolarHBondContact O-CB 3.47Å; R355-A359 PolarHBondContact O-N 2.95Å
356F72.8Confident80.5Confident45 Ų4547.2 Ų47.220%0.19727%0.269CS..Hα-helixtrans-56.9-44.6-175.9-178.5-105.9000113.4F344 L347 M348 G352 S358 A359 V360F344-F356 HydrophobicContact CB-CZ 4.16Å; F344-F356 HydrophobicContact CD1-CZ 4.32Å; F344-F356 WeakPolarHBondContact O-CE2 3.32Å; L347-F356 HydrophobicContact CB-CE2 4.22Å; L347-F356 HydrophobicContact CD2-CE2 4.12Å; L347-F356 HydrophobicContact CG-CD2 4.29Å; L347-F356 HydrophobicContact CG-CE2 4.11Å; M348-F356 HydrophobicContact CB-CD2 3.73Å; M348-F356 HydrophobicContact CB-CE2 3.76Å; M348-F356 HydrophobicContact CE-CD1 4.11Å; M348-F356 HydrophobicContact CE-CD2 4.28Å; M348-F356 HydrophobicContact CE-CE1 4Å; M348-F356 HydrophobicContact CE-CE2 4.16Å; M348-F356 HydrophobicContact CE-CG 4.25Å; M348-F356 HydrophobicContact CE-CZ 4.02Å; M348-F356 HydrophobicContact CG-CD2 4.11Å; M348-F356 HydrophobicContact CG-CE2 4.46Å; G352-F356 PolarHBondContact O-N 3.28Å; F356-S358 PolarHBondContact O-N 3.41Å; F356-A359 PolarHBondContact O-N 2.92Å; F356-V360 HydrophobicContact CD1-CG2 4.17Å; F356-V360 HydrophobicContact CD2-CG2 4.26Å; F356-V360 HydrophobicContact CE1-CG2 3.73Å; F356-V360 HydrophobicContact CE2-CG2 3.84Å; F356-V360 HydrophobicContact CG-CG2 4.42Å; F356-V360 HydrophobicContact CZ-CG2 3.56Å; F356-V360 WeakPolarHBondContact O-CG2 3.47Å; F356-V360 PolarHBondContact O-N 3.14Å
357S70.4Confident80.4Confident100 Ų10047.7 Ų47.770%0.69927%0.271SS*.Hα-helixtrans-61.9-42.9-178.4-168.90000112.4R355 G361R355-S357 PolarHBondContact O-N 3.39Å; S357-G361 PolarHBondContact O-N 3.5Å
358S76.8Confident80.4Confident30 Ų3048.7 Ų48.721%0.2128%0.278CS..Hα-helixtrans-68.4-38.1177.6-51.10000111.3R355 F356 G361 L362R355-S358 PolarHBondContact O-N 3.24Å; F356-S358 PolarHBondContact O-N 3.41Å; S358-G361 PolarHBondContact O-N 2.92Å; S358-L362 PolarHBondContact O-N 2.82Å
359A82.1Confident80.8Confident0 Ų048.1 Ų48.10%028%0.283CS..Hα-helixtrans-66-41.7177.700000112.8L226 F232 L347 V351 R355 F356 G361 L362 V363L226-A359 HydrophobicContact CD1-CB 3.94Å; L226-A359 HydrophobicContact CD2-CB 4.29Å; F232-A359 HydrophobicContact CD2-CB 4.47Å; F232-A359 HydrophobicContact CE2-CB 3.89Å; L347-A359 HydrophobicContact CD1-CB 4.1Å; L347-A359 HydrophobicContact CD2-CB 4.41Å; L347-A359 HydrophobicContact CG-CB 4.42Å; V351-A359 HydrophobicContact CB-CB 4.39Å; V351-A359 HydrophobicContact CG1-CB 3.95Å; V351-A359 HydrophobicContact CG2-CB 4.17Å; R355-A359 WeakPolarHBondContact O-CB 3.47Å; R355-A359 PolarHBondContact O-N 2.95Å; F356-A359 PolarHBondContact O-N 2.92Å; A359-G361 VanDerWaalsContact C-N 3.32Å; A359-G361 PolarHBondContact O-N 3.34Å; A359-L362 PolarHBondContact O-N 2.83Å; A359-V363 WeakPolarHBondContact O-CB 3.44Å; A359-V363 VanDerWaalsContact O-CG2 3.25Å; A359-V363 WeakPolarHBondContact O-CG2 3.48Å; A359-V363 PolarHBondContact O-N 2.98Å
360V81.1Confident81.1Confident35 Ų3545 Ų4521%0.21227%0.267CS..Hα-helixtrans-60.5-42.8173.5171.50000110.8F344 L347 F356 V363 T364F344-V360 HydrophobicContact CD1-CG2 4.16Å; F344-V360 HydrophobicContact CE1-CG1 4.22Å; F344-V360 HydrophobicContact CE1-CG2 4.27Å; L347-V360 HydrophobicContact CD2-CG2 3.72Å; F356-V360 HydrophobicContact CD1-CG2 4.17Å; F356-V360 HydrophobicContact CD2-CG2 4.26Å; F356-V360 HydrophobicContact CE1-CG2 3.73Å; F356-V360 HydrophobicContact CE2-CG2 3.84Å; F356-V360 HydrophobicContact CG-CG2 4.42Å; F356-V360 HydrophobicContact CZ-CG2 3.56Å; F356-V360 WeakPolarHBondContact O-CG2 3.47Å; F356-V360 PolarHBondContact O-N 3.14Å; V360-V363 PolarHBondContact O-N 3.02Å; V360-T364 HydrophobicContact CG1-CG2 4.28Å; V360-T364 WeakPolarHBondContact O-CB 3.17Å; V360-T364 VanDerWaalsContact O-CG2 3.3Å; V360-T364 WeakPolarHBondContact O-CG2 3.5Å; V360-T364 PolarHBondContact O-N 2.98Å; V360-T364 PolarHBondContact O-OG1 3.2Å
361G78.9Confident81.3Confident19 Ų1944.4 Ų44.420%0.19626%0.264CS..Hα-helixtrans-60.2-45.6175.900000112.9S357 S358 A359 T364 I365S357-G361 PolarHBondContact O-N 3.5Å; S358-G361 PolarHBondContact O-N 2.92Å; A359-G361 VanDerWaalsContact C-N 3.32Å; A359-G361 PolarHBondContact O-N 3.34Å; G361-T364 PolarHBondContact O-OG1 3.08Å; G361-I365 WeakPolarHBondContact O-CD1 3.26Å; G361-I365 VanDerWaalsContact O-CG1 3.29Å; G361-I365 WeakPolarHBondContact O-CG1 3.3Å; G361-I365 PolarHBondContact O-N 2.93Å
362L83.2Confident81.7Confident8 Ų845.9 Ų45.94%0.04227%0.27CS..Hα-helixtrans-64.6-45.3176.6-80.5171.1000112.8L222 L224 L226 F227 F232 S358 A359 I365 M366L222-L362 HydrophobicContact CB-CD2 3.88Å; L222-L362 HydrophobicContact CB-CG 4.24Å; L222-L362 HydrophobicContact CD1-CD2 4.22Å; L222-L362 HydrophobicContact CD2-CD2 3.89Å; L222-L362 HydrophobicContact CD2-CG 3.92Å; L222-L362 HydrophobicContact CG-CD2 4.21Å; L224-L362 HydrophobicContact CD2-CD2 4.2Å; L226-L362 HydrophobicContact CB-CD1 4.02Å; L226-L362 HydrophobicContact CD1-CD1 3.75Å; F227-L362 HydrophobicContact CE2-CD1 4.27Å; F227-L362 HydrophobicContact CE2-CD2 3.83Å; F227-L362 HydrophobicContact CZ-CD2 4.13Å; F232-L362 HydrophobicContact CZ-CB 4.12Å; F232-L362 HydrophobicContact CZ-CD1 4.45Å; S358-L362 PolarHBondContact O-N 2.82Å; A359-L362 PolarHBondContact O-N 2.83Å; L362-I365 PolarHBondContact O-N 3.43Å; L362-M366 PolarHBondContact O-N 2.8Å; L362-M366 VanDerWaalsContact O-N 3.14Å
363V85.9Confident82.4Confident1 Ų147.5 Ų47.51%0.00627%0.272CS..Hα-helixtrans-58.9-56.3178.1168.10000109.4F232 Y235 I236 L347 A359 V360 I365 M366 E367F232-V363 HydrophobicContact CE2-CG2 3.73Å; F232-V363 HydrophobicContact CZ-CG2 4.02Å; Y235-V363 HydrophobicContact CE1-CG2 4.15Å; I236-V363 HydrophobicContact CD1-CG2 3.93Å; I236-V363 HydrophobicContact CG1-CG2 4.45Å; L347-V363 HydrophobicContact CD1-CG2 4.34Å; L347-V363 HydrophobicContact CD2-CG2 4.23Å; A359-V363 WeakPolarHBondContact O-CB 3.44Å; A359-V363 VanDerWaalsContact O-CG2 3.25Å; A359-V363 WeakPolarHBondContact O-CG2 3.48Å; A359-V363 PolarHBondContact O-N 2.98Å; V360-V363 PolarHBondContact O-N 3.02Å; V363-I365 VanDerWaalsContact C-N 3.27Å; V363-I365 PolarHBondContact O-N 3.47Å; V363-I365 VanDerWaalsContact O-N 3.16Å; V363-M366 CarbonylContact O-C 3.49Å; V363-M366 WeakPolarHBondContact O-CA 3.49Å; V363-M366 PolarHBondContact O-N 3.31Å; V363-E367 VanDerWaalsContact CG1-CD 3.47Å; V363-E367 HydrophobicContact CG1-CG 3.84Å; V363-E367 WeakPolarHBondContact CG1-OE1 3.47Å; V363-E367 WeakPolarHBondContact O-CG 3.49Å; V363-E367 PolarHBondContact O-N 3.39Å
364T84Confident83.3Confident27 Ų2743.5 Ų43.517%0.16624%0.239CC..Hα-helixtrans-56-36.9-177.749.90000114V360 G361 E367 C368V360-T364 HydrophobicContact CG1-CG2 4.28Å; V360-T364 WeakPolarHBondContact O-CB 3.17Å; V360-T364 VanDerWaalsContact O-CG2 3.3Å; V360-T364 WeakPolarHBondContact O-CG2 3.5Å; V360-T364 PolarHBondContact O-N 2.98Å; V360-T364 PolarHBondContact O-OG1 3.2Å; G361-T364 PolarHBondContact O-OG1 3.08Å; T364-E367 PolarHBondContact O-N 2.98Å; T364-C368 PolarHBondContact O-N 2.9Å; T364-C368 PolarHBondContact O-SG 3.41Å
365I84.4Confident84.1Confident64 Ų6434.5 Ų34.533%0.32820%0.196SC..Hα-helixtrans-65.1-46.6173.9-66.8167.7000111.1P74 L222 G361 L362 V363 E367 C368P74-I365 HydrophobicContact CG-CD1 3.78Å; P74-I365 HydrophobicContact CG-CG1 4.15Å; L222-I365 HydrophobicContact CD1-CD1 3.74Å; L222-I365 HydrophobicContact CD2-CD1 3.77Å; L222-I365 HydrophobicContact CG-CD1 4.4Å; G361-I365 WeakPolarHBondContact O-CD1 3.26Å; G361-I365 VanDerWaalsContact O-CG1 3.29Å; G361-I365 WeakPolarHBondContact O-CG1 3.3Å; G361-I365 PolarHBondContact O-N 2.93Å; L362-I365 PolarHBondContact O-N 3.43Å; V363-I365 VanDerWaalsContact C-N 3.27Å; V363-I365 PolarHBondContact O-N 3.47Å; V363-I365 VanDerWaalsContact O-N 3.16Å; I365-E367 VanDerWaalsContact C-N 3.29Å; I365-E367 PolarHBondContact O-N 3.04Å; I365-C368 VanDerWaalsContact O-CB 3.28Å; I365-C368 WeakPolarHBondContact O-CB 3.45Å; I365-C368 PolarHBondContact O-N 3.04Å
366M85.7Confident84.7Confident69 Ų6929.1 Ų29.134%0.3418%0.177SC..Hα-helixtrans-68.1-30.3179.1-70.3-170.963.600112.7F227 I236 V240 L362 V363 C368 P370F227-M366 HydrophobicContact CE1-SD 3.67Å; F227-M366 HydrophobicContact CZ-SD 3.69Å; I236-M366 HydrophobicContact CD1-CB 4.16Å; I236-M366 HydrophobicContact CD1-CE 4.14Å; I236-M366 HydrophobicContact CD1-CG 4.1Å; I236-M366 HydrophobicContact CD1-SD 3.21Å; I236-M366 WeakPolarHBondContact CD1-SD 3.21Å; I236-M366 HydrophobicContact CG1-CB 4.32Å; I236-M366 HydrophobicContact CG1-CE 4.01Å; I236-M366 HydrophobicContact CG1-SD 3.76Å; I236-M366 HydrophobicContact CG2-CE 4.39Å; V240-M366 HydrophobicContact CG2-CB 4.38Å; V240-M366 HydrophobicContact CG2-CE 4.32Å; L362-M366 PolarHBondContact O-N 2.8Å; L362-M366 VanDerWaalsContact O-N 3.14Å; V363-M366 CarbonylContact O-C 3.49Å; V363-M366 WeakPolarHBondContact O-CA 3.49Å; V363-M366 PolarHBondContact O-N 3.31Å; M366-C368 PolarHBondContact O-N 2.92Å; M366-P370 WeakPolarHBondContact O-CD 3.49Å
367E86.5Confident85.5Confident11 Ų1131.5 Ų31.55%0.05119%0.191CC..Hα-helixtrans-67.2-20.6174.9-68.6-171.6163.900112.9L243 V363 T364 I365 A369 P370 V371L243-E367 HydrophobicContact CD1-CB 3.3Å; L243-E367 HydrophobicContact CD1-CG 3.19Å; V363-E367 VanDerWaalsContact CG1-CD 3.47Å; V363-E367 HydrophobicContact CG1-CG 3.84Å; V363-E367 WeakPolarHBondContact CG1-OE1 3.47Å; V363-E367 WeakPolarHBondContact O-CG 3.49Å; V363-E367 PolarHBondContact O-N 3.39Å; T364-E367 PolarHBondContact O-N 2.98Å; I365-E367 VanDerWaalsContact C-N 3.29Å; I365-E367 PolarHBondContact O-N 3.04Å; E367-A369 PolarHBondContact O-N 3.38Å; E367-P370 WeakPolarHBondContact O-CD 3.34Å; E367-V371 WeakPolarHBondContact O-CB 3.33Å; E367-V371 WeakPolarHBondContact O-CG2 3.4Å; E367-V371 PolarHBondContact O-N 3.3Å
368C88.4Confident86.1Confident21 Ų2127.4 Ų27.414%0.14216%0.161CC..Hα-helixtrans-62.5-40.9-178.3-67.50000113.2A67 G71 T364 I365 M366 V371 L372A67-C368 PolarHBondContact O-SG 3.29Å; G71-C368 WeakPolarHBondContact CA-SG 3.3Å; G71-C368 PolarHBondContact N-SG 3.14Å; T364-C368 PolarHBondContact O-N 2.9Å; T364-C368 PolarHBondContact O-SG 3.41Å; I365-C368 VanDerWaalsContact O-CB 3.28Å; I365-C368 WeakPolarHBondContact O-CB 3.45Å; I365-C368 PolarHBondContact O-N 3.04Å; M366-C368 PolarHBondContact O-N 2.92Å; C368-V371 PolarHBondContact O-N 3.38Å; C368-L372 WeakPolarHBondContact O-CB 3.43Å; C368-L372 PolarHBondContact O-N 3.18Å
369A89.4Confident86.3Confident54 Ų5426 Ų2645%0.44615%0.151SC..Hα-helixtrans-66.4-48.9-176.700000112.5E367 V371 L372 L373E367-A369 PolarHBondContact O-N 3.38Å; A369-V371 VanDerWaalsContact C-N 3.34Å; A369-V371 PolarHBondContact O-N 3.45Å; A369-L372 PolarHBondContact O-N 3.41Å; A369-L373 WeakPolarHBondContact O-CB 3.35Å; A369-L373 WeakPolarHBondContact O-CG 3.12Å; A369-L373 PolarHBondContact O-N 2.85Å
370P90.9Very high86.5Confident2 Ų231.9 Ų31.91%0.01318%0.177CC..Hα-helixtrans-59.2-40.6172.3-26.834.8000113.8V240 L243 F244 M366 E367 G374V240-P370 HydrophobicContact CB-CG 4.31Å; V240-P370 HydrophobicContact CG1-CG 3.79Å; V240-P370 WeakPolarHBondContact O-CG 3.13Å; L243-P370 HydrophobicContact CB-CB 3.63Å; L243-P370 HydrophobicContact CB-CG 4.36Å; F244-P370 HydrophobicContact CD1-CB 4.49Å; F244-P370 HydrophobicContact CD2-CB 3.72Å; F244-P370 HydrophobicContact CD2-CG 4.04Å; F244-P370 HydrophobicContact CE2-CB 3.79Å; F244-P370 HydrophobicContact CE2-CG 3.72Å; F244-P370 HydrophobicContact CG-CB 4.08Å; F244-P370 HydrophobicContact CZ-CB 4.23Å; F244-P370 HydrophobicContact CZ-CG 4.29Å; M366-P370 WeakPolarHBondContact O-CD 3.49Å; E367-P370 WeakPolarHBondContact O-CD 3.34Å; P370-G374 VanDerWaalsContact O-CA 3.32Å; P370-G374 WeakPolarHBondContact O-CA 3.4Å; P370-G374 PolarHBondContact O-N 3.24Å
371V89.6Confident86.7Confident1 Ų134.1 Ų34.11%0.00618%0.184CC..Hα-helixtrans-67.5-37.7-179.8171.20000111.7L66 L243 F247 E367 C368 A369 P375L66-V371 HydrophobicContact CB-CG1 3.51Å; L66-V371 HydrophobicContact CD1-CG1 4.34Å; L243-V371 HydrophobicContact CD1-CG2 4.23Å; F247-V371 HydrophobicContact CD2-CG2 3.71Å; F247-V371 HydrophobicContact CE2-CG2 3.57Å; E367-V371 WeakPolarHBondContact O-CB 3.33Å; E367-V371 WeakPolarHBondContact O-CG2 3.4Å; E367-V371 PolarHBondContact O-N 3.3Å; C368-V371 PolarHBondContact O-N 3.38Å; A369-V371 VanDerWaalsContact C-N 3.34Å; A369-V371 PolarHBondContact O-N 3.45Å; V371-P375 WeakPolarHBondContact O-CD 3.23Å
372L92.1Very high86.9Confident53 Ų5334.3 Ų34.328%0.27718%0.18SC..Hα-helixtrans-68.9-43.8177.4-177.561.6000112W60 S63 I64 A67 C368 A369 P376W60-L372 HydrophobicContact CE3-CD1 3.95Å; W60-L372 HydrophobicContact CE3-CG 4.48Å; W60-L372 HydrophobicContact CZ3-CD1 3.65Å; W60-L372 HydrophobicContact CZ3-CD2 4.37Å; W60-L372 HydrophobicContact CZ3-CG 3.72Å; S63-L372 WeakPolarHBondContact CB-O 3.36Å; I64-L372 HydrophobicContact CB-CD1 4.36Å; I64-L372 HydrophobicContact CG1-CD1 3.69Å; A67-L372 HydrophobicContact CB-CB 3.8Å; A67-L372 HydrophobicContact CB-CD1 4.03Å; A67-L372 HydrophobicContact CB-CG 4.41Å; C368-L372 WeakPolarHBondContact O-CB 3.43Å; C368-L372 PolarHBondContact O-N 3.18Å; A369-L372 PolarHBondContact O-N 3.41Å; L372-P376 WeakPolarHBondContact O-CD 3.32Å; L372-P376 WeakPolarHBondContact O-CG 3.24Å
373L91.2Very high87Confident66 Ų6635.8 Ų35.835%0.34619%0.187SC..Hα-helixtrans-91.2-27.2-171.8-63.4176.7000113.7W60 F244 A369 P376 L377W60-L373 HydrophobicContact CH2-CD2 3.85Å; F244-L373 HydrophobicContact CE1-CB 3.98Å; A369-L373 WeakPolarHBondContact O-CB 3.35Å; A369-L373 WeakPolarHBondContact O-CG 3.12Å; A369-L373 PolarHBondContact O-N 2.85Å; L373-P376 WeakPolarHBondContact O-CD 3.41Å; L373-L377 HydrophobicContact CB-CD1 3.93Å; L373-L377 VanDerWaalsContact O-CB 3.25Å; L373-L377 WeakPolarHBondContact O-CB 3.46Å; L373-L377 WeakPolarHBondContact O-CD1 3.32Å; L373-L377 WeakPolarHBondContact O-CG 3.47Å; L373-L377 PolarHBondContact O-N 3.27Å
374G89.3Confident87Confident0 Ų040.3 Ų40.30%021%0.211CC..Hα-helixtrans-57.1-65-172.800000113.1P370 L377 L378P370-G374 VanDerWaalsContact O-CA 3.32Å; P370-G374 WeakPolarHBondContact O-CA 3.4Å; P370-G374 PolarHBondContact O-N 3.24Å; G374-L377 PolarHBondContact O-N 2.97Å; G374-L378 WeakPolarHBondContact O-CB 3.41Å; G374-L378 WeakPolarHBondContact O-CD1 3.25Å; G374-L378 WeakPolarHBondContact O-CG 3.47Å; G374-L378 PolarHBondContact O-N 3.32Å
375P88.6Confident87.2Confident1 Ų145.2 Ų45.21%0.00623%0.227CC..Hα-helixtrans-59.6-40.5-178.6-20.631.6000114.1S63 A248 V251 F252 V371 L378 G379S63-P375 WeakPolarHBondContact OG-CB 3.33Å; S63-P375 WeakPolarHBondContact OG-CG 3.39Å; A248-P375 HydrophobicContact CB-CB 4.31Å; A248-P375 HydrophobicContact CB-CG 4.39Å; V251-P375 HydrophobicContact CG2-CG 4.5Å; F252-P375 HydrophobicContact CE2-CB 4.4Å; F252-P375 WeakPolarHBondContact CE2-O 3.44Å; F252-P375 HydrophobicContact CZ-CB 4.45Å; F252-P375 WeakPolarHBondContact CZ-O 3.47Å; V371-P375 WeakPolarHBondContact O-CD 3.23Å; P375-L378 PolarHBondContact O-N 2.92Å; P375-G379 WeakPolarHBondContact O-CA 3.27Å; P375-G379 PolarHBondContact O-N 3.43Å
376P88.4Confident87.2Confident4 Ų449.9 Ų49.93%0.02625%0.247CC..Hα-helixtrans-65.8-42175.7-25.936.3000114.8S56 S59 W60 S63 L372 L373 L378 K380S56-P376 WeakPolarHBondContact CB-O 3.46Å; S56-P376 PolarHBondContact OG-O 3.41Å; S59-P376 VanDerWaalsContact OG-CA 3.26Å; S59-P376 WeakPolarHBondContact OG-CA 3.4Å; W60-P376 HydrophobicContact CD2-CB 4.01Å; W60-P376 HydrophobicContact CD2-CG 3.57Å; W60-P376 VanDerWaalsContact CE2-CB 3.49Å; W60-P376 HydrophobicContact CE3-CG 4.07Å; W60-P376 HydrophobicContact CG-CB 4.22Å; W60-P376 HydrophobicContact CG-CG 3.8Å; W60-P376 HydrophobicContact CZ2-CB 3.88Å; W60-P376 HydrophobicContact CZ2-CG 4.09Å; S63-P376 WeakPolarHBondContact OG-CD 3.42Å; L372-P376 WeakPolarHBondContact O-CD 3.32Å; L372-P376 WeakPolarHBondContact O-CG 3.24Å; L373-P376 WeakPolarHBondContact O-CD 3.41Å; P376-L378 VanDerWaalsContact C-N 3.35Å; P376-K380 PolarHBondContact O-N 3.45Å; P376-K380 VanDerWaalsContact O-N 3.16Å
377L87.8Confident87.2Confident96 Ų9648.8 Ų48.850%0.50324%0.243SC..Hα-helixtrans-63.1-44.2176.7-74.8171.4000111F244 L373 G374 K380F244-L377 HydrophobicContact CE1-CD1 4.17Å; L373-L377 HydrophobicContact CB-CD1 3.93Å; L373-L377 VanDerWaalsContact O-CB 3.25Å; L373-L377 WeakPolarHBondContact O-CB 3.46Å; L373-L377 WeakPolarHBondContact O-CD1 3.32Å; L373-L377 WeakPolarHBondContact O-CG 3.47Å; L373-L377 PolarHBondContact O-N 3.27Å; G374-L377 PolarHBondContact O-N 2.97Å; L377-K380 VanDerWaalsContact O-CB 3.26Å; L377-K380 WeakPolarHBondContact O-CB 3.48Å; L377-K380 PolarHBondContact O-N 2.83Å
378L83.3Confident87.3Confident14 Ų1448.5 Ų48.57%0.07324%0.241CC..Hα-helixtrans-75.5-33-178.5-71.7162.9000111.9F244 A248 G374 P375 P376 K380 F381 T391 C395F244-L378 WeakPolarHBondContact O-CD1 3.42Å; A248-L378 HydrophobicContact CB-CB 4.05Å; A248-L378 HydrophobicContact CB-CD1 3.55Å; A248-L378 HydrophobicContact CB-CG 4.46Å; G374-L378 WeakPolarHBondContact O-CB 3.41Å; G374-L378 WeakPolarHBondContact O-CD1 3.25Å; G374-L378 WeakPolarHBondContact O-CG 3.47Å; G374-L378 PolarHBondContact O-N 3.32Å; P375-L378 PolarHBondContact O-N 2.92Å; P376-L378 VanDerWaalsContact C-N 3.35Å; L378-K380 PolarHBondContact O-N 3.09Å; L378-F381 HydrophobicContact CD2-CD2 3.8Å; L378-F381 HydrophobicContact CD2-CE2 3.79Å; L378-F381 WeakPolarHBondContact O-CB 3.15Å; L378-F381 PolarHBondContact O-N 3.1Å; L378-T391 HydrophobicContact CB-CG2 3.95Å; L378-T391 PolarHBondContact O-OG1 3.31Å; L378-C395 WeakPolarHBondContact CD1-SG 3.39Å
379G82Confident87.4Confident0 Ų051.4 Ų51.40%025%0.251CS..Hα-helixtrans-60.8-31170.700000112.6P375 F381 K382 D383P375-G379 WeakPolarHBondContact O-CA 3.27Å; P375-G379 PolarHBondContact O-N 3.43Å; G379-F381 PolarHBondContact O-N 3.27Å; G379-K382 PolarHBondContact O-N 3.37Å; G379-K382 VanDerWaalsContact O-N 3.14Å; G379-D383 PolarHBondContact O-N 2.81Å
380K86.1Confident87.4Confident123 Ų12354.1 Ų54.154%0.53525%0.251SS..Hα-helixtrans-62.5-30.2173.4-164.3-179.9179.5179.50112.4P376 L377 L378 D383 I384P376-K380 PolarHBondContact O-N 3.45Å; P376-K380 VanDerWaalsContact O-N 3.16Å; L377-K380 VanDerWaalsContact O-CB 3.26Å; L377-K380 WeakPolarHBondContact O-CB 3.48Å; L377-K380 PolarHBondContact O-N 2.83Å; L378-K380 PolarHBondContact O-N 3.09Å; K380-D383 PolarHBondContact O-N 3.16Å; K380-I384 HydrophobicContact CG-CD1 4.06Å; K380-I384 HydrophobicContact CG-CG1 4.46Å; K380-I384 WeakPolarHBondContact O-CG1 3.41Å; K380-I384 PolarHBondContact O-N 3.19Å
381F85.4Confident87.5Confident83 Ų8354 Ų5436%0.36425%0.25SS..Hα-helixtrans-64.2-41.9173.6-71.1-47.4000111.8L378 G379 D383 I384 Y385L378-F381 HydrophobicContact CD2-CD2 3.8Å; L378-F381 HydrophobicContact CD2-CE2 3.79Å; L378-F381 WeakPolarHBondContact O-CB 3.15Å; L378-F381 PolarHBondContact O-N 3.1Å; G379-F381 PolarHBondContact O-N 3.27Å; F381-D383 VanDerWaalsContact C-N 3.29Å; F381-D383 PolarHBondContact O-N 3.26Å; F381-I384 PolarHBondContact O-N 2.86Å; F381-Y385 HydrophobicContact CB-CD2 4.35Å; F381-Y385 HydrophobicContact CD1-CD2 4.34Å; F381-Y385 AromaticContact CD1-CE2 3.95Å; F381-Y385 HydrophobicContact CD1-CE2 3.95Å; F381-Y385 WeakPolarHBondContact O-CB 3.28Å; F381-Y385 VanDerWaalsContact O-CD2 3.31Å; F381-Y385 WeakPolarHBondContact O-CD2 3.47Å; F381-Y385 PolarHBondContact O-N 3.05Å
382K81.8Confident87.7Confident23 Ų2354 Ų5410%0.125%0.25CC..Hα-helixtrans-64.7-36.1172.9-178.1-121.7178.3167.80111.3E48 S55 G379 H386 Y388E48-K382 IonicContact OE1-NZ 3.37Å; E48-K382 PolarHBondContact OE1-NZ 3.48Å; E48-K382 IonicContact OE2-NZ 3.27Å; E48-K382 PolarHBondContact OE2-NZ 3.46Å; S55-K382 WeakPolarHBondContact OG-CD 3.29Å; S55-K382 VanDerWaalsContact OG-CE 3.31Å; S55-K382 WeakPolarHBondContact OG-CE 3.32Å; S55-K382 PolarHBondContact OG-NZ 3.41Å; G379-K382 PolarHBondContact O-N 3.37Å; G379-K382 VanDerWaalsContact O-N 3.14Å; K382-H386 WeakPolarHBondContact O-CA 3.25Å; K382-H386 PolarHBondContact O-N 2.63Å; K382-Y388 HydrophobicContact CB-CD1 4.13Å; K382-Y388 HydrophobicContact CB-CE1 4.19Å; K382-Y388 HydrophobicContact CD-CD1 4.23Å; K382-Y388 HydrophobicContact CD-CD2 4.36Å; K382-Y388 HydrophobicContact CD-CE1 3.63Å; K382-Y388 HydrophobicContact CD-CE2 3.81Å; K382-Y388 VanDerWaalsContact CD-CZ 3.4Å; K382-Y388 VanDerWaalsContact CE-OH 3.25Å; K382-Y388 WeakPolarHBondContact CE-OH 3.27Å; K382-Y388 HydrophobicContact CG-CD1 3.84Å; K382-Y388 HydrophobicContact CG-CD2 4.04Å; K382-Y388 HydrophobicContact CG-CE1 3.78Å; K382-Y388 HydrophobicContact CG-CE2 4Å; K382-Y388 HydrophobicContact CG-CG 3.97Å; K382-Y388 PolarHBondContact NZ-OH 2.9Å
383D85.6Confident87.7Confident38 Ų3854.2 Ų54.220%0.20325%0.249CC..Hα-helixtrans-67.3-33.6177.6-63-21.8000112.6T54 S55 S56 G379 K380 F381 H386T54-D383 WeakPolarHBondContact CB-OD2 3.39Å; T54-D383 PolarHBondContact OG1-OD2 3.29Å; S55-D383 WeakPolarHBondContact CB-OD1 3.49Å; S55-D383 PolarHBondContact N-OD1 2.79Å; S55-D383 PolarHBondContact OG-OD1 2.75Å; S56-D383 WeakPolarHBondContact CB-OD2 3.45Å; S56-D383 PolarHBondContact N-OD2 3.36Å; G379-D383 PolarHBondContact O-N 2.81Å; K380-D383 PolarHBondContact O-N 3.16Å; F381-D383 VanDerWaalsContact C-N 3.29Å; F381-D383 PolarHBondContact O-N 3.26Å; D383-H386 PolarHBondContact O-CE1 2.75Å
384I87.6Confident87.8Confident97 Ų9752 Ų5250%0.49724%0.242SC..Hα-helixtrans-82.9-47.6178.9-66166.5000112.3K380 F381K380-I384 HydrophobicContact CG-CD1 4.06Å; K380-I384 HydrophobicContact CG-CG1 4.46Å; K380-I384 WeakPolarHBondContact O-CG1 3.41Å; K380-I384 PolarHBondContact O-N 3.19Å; F381-I384 PolarHBondContact O-N 2.86Å
385Y87.3Confident88Confident129 Ų12952 Ų5251%0.50624%0.242SC..Hα-helixtrans-94.7-4.8-172.5-64.8-72.2000113.4F381 D387 Y390F381-Y385 HydrophobicContact CB-CD2 4.35Å; F381-Y385 HydrophobicContact CD1-CD2 4.34Å; F381-Y385 AromaticContact CD1-CE2 3.95Å; F381-Y385 HydrophobicContact CD1-CE2 3.95Å; F381-Y385 WeakPolarHBondContact O-CB 3.28Å; F381-Y385 VanDerWaalsContact O-CD2 3.31Å; F381-Y385 WeakPolarHBondContact O-CD2 3.47Å; F381-Y385 PolarHBondContact O-N 3.05Å; Y385-D387 PolarHBondContact O-N 3.32Å; Y385-Y390 HydrophobicContact CD2-CD2 4.43Å; Y385-Y390 HydrophobicContact CD2-CG 4.39Å; Y385-Y390 AromaticContact CG-CD2 3.97Å; Y385-Y390 HydrophobicContact CG-CD2 3.97Å; Y385-Y390 HydrophobicContact CG-CE2 4.35Å; Y385-Y390 HydrophobicContact CG-CG 4.31Å
386H84.1Confident88.3Confident163 Ų16351.9 Ų51.976%0.75524%0.242SC*.SBendtrans56.813.4-177.9-56.7-61000115.7K382 D383K382-H386 WeakPolarHBondContact O-CA 3.25Å; K382-H386 PolarHBondContact O-N 2.63Å; D383-H386 PolarHBondContact O-CE1 2.75Å
387D86.9Confident88.7Confident46 Ų4656 Ų5625%0.24626%0.263CS..  trans-136135.9176.4-161.8-30.9000111K260 Y385 K389 Y390K260-D387 IonicContact NZ-OD2 3.95Å; Y385-D387 PolarHBondContact O-N 3.32Å; D387-K389 PolarHBondContact O-N 3.33Å; D387-K389 WeakPolarHBondContact OD1-CB 3.25Å; D387-K389 PolarHBondContact OD1-N 3.05Å; D387-Y390 HydrophobicContact CB-CD2 4.25Å; D387-Y390 HydrophobicContact CB-CE2 4.31Å
388Y87.7Confident89Confident4 Ų453.6 Ų53.62%0.01625%0.252CS..Hα-helixtrans-68.7-20.2174.4-80.2-72.9000112.9F252 N255 Y256 K382 Y390 T391 Y392F252-Y388 HydrophobicContact CB-CD1 4.08Å; F252-Y388 HydrophobicContact CB-CE1 3.74Å; F252-Y388 AromaticContact CD1-CE1 3.86Å; F252-Y388 HydrophobicContact CD1-CE1 3.86Å; F252-Y388 HydrophobicContact CG-CD1 4.39Å; F252-Y388 AromaticContact CG-CE1 3.8Å; F252-Y388 HydrophobicContact CG-CE1 3.8Å; N255-Y388 HydrophobicContact CB-CE2 4.2Å; N255-Y388 VanDerWaalsContact CB-OH 3.27Å; N255-Y388 WeakPolarHBondContact CB-OH 3.25Å; Y256-Y388 AromaticContact CD2-CD2 3.92Å; Y256-Y388 HydrophobicContact CD2-CD2 3.92Å; Y256-Y388 AromaticContact CD2-CG 3.91Å; Y256-Y388 HydrophobicContact CD2-CG 3.91Å; Y256-Y388 HydrophobicContact CG-CD2 4.37Å; Y256-Y388 HydrophobicContact CG-CG 4.15Å; K382-Y388 HydrophobicContact CB-CD1 4.13Å; K382-Y388 HydrophobicContact CB-CE1 4.19Å; K382-Y388 HydrophobicContact CD-CD1 4.23Å; K382-Y388 HydrophobicContact CD-CD2 4.36Å; K382-Y388 HydrophobicContact CD-CE1 3.63Å; K382-Y388 HydrophobicContact CD-CE2 3.81Å; K382-Y388 VanDerWaalsContact CD-CZ 3.4Å; K382-Y388 VanDerWaalsContact CE-OH 3.25Å; K382-Y388 WeakPolarHBondContact CE-OH 3.27Å; K382-Y388 HydrophobicContact CG-CD1 3.84Å; K382-Y388 HydrophobicContact CG-CD2 4.04Å; K382-Y388 HydrophobicContact CG-CE1 3.78Å; K382-Y388 HydrophobicContact CG-CE2 4Å; K382-Y388 HydrophobicContact CG-CG 3.97Å; K382-Y388 PolarHBondContact NZ-OH 2.9Å; Y388-Y390 VanDerWaalsContact C-N 3.27Å; Y388-Y390 PolarHBondContact O-N 3.06Å; Y388-T391 WeakPolarHBondContact O-CA 3.39Å; Y388-T391 WeakPolarHBondContact O-CB 3.43Å; Y388-T391 PolarHBondContact O-N 3.34Å; Y388-Y392 WeakPolarHBondContact O-CD2 3.32Å; Y388-Y392 PolarHBondContact O-N 3.18Å
389K90.4Very high89.6Confident82 Ų8252.9 Ų52.936%0.35725%0.248SC..Hα-helixtrans-47.3-48.5177.5169.3165.8-174.4-175.40112.8P317 D387 T391 Y392 Q393P317-K389 HydrophobicContact CB-CB 4.2Å; P317-K389 HydrophobicContact CB-CD 3.8Å; P317-K389 HydrophobicContact CB-CG 3.62Å; P317-K389 HydrophobicContact CG-CB 4.29Å; P317-K389 HydrophobicContact CG-CD 4.38Å; P317-K389 HydrophobicContact CG-CG 3.7Å; D387-K389 PolarHBondContact O-N 3.33Å; D387-K389 WeakPolarHBondContact OD1-CB 3.25Å; D387-K389 PolarHBondContact OD1-N 3.05Å; K389-T391 VanDerWaalsContact C-N 3.3Å; K389-T391 PolarHBondContact O-N 3.16Å; K389-Y392 PolarHBondContact O-N 3.05Å; K389-Q393 WeakPolarHBondContact O-CG 3.45Å; K389-Q393 PolarHBondContact O-N 3.47Å
390Y90.3Very high90.3Very high111 Ų11155.3 Ų55.344%0.43526%0.261SS..Hα-helixtrans-67.6-32.4-179.8-59.9-73.9000112.6Y385 D387 Y388 G394Y385-Y390 HydrophobicContact CD2-CD2 4.43Å; Y385-Y390 HydrophobicContact CD2-CG 4.39Å; Y385-Y390 AromaticContact CG-CD2 3.97Å; Y385-Y390 HydrophobicContact CG-CD2 3.97Å; Y385-Y390 HydrophobicContact CG-CE2 4.35Å; Y385-Y390 HydrophobicContact CG-CG 4.31Å; D387-Y390 HydrophobicContact CB-CD2 4.25Å; D387-Y390 HydrophobicContact CB-CE2 4.31Å; Y388-Y390 VanDerWaalsContact C-N 3.27Å; Y388-Y390 PolarHBondContact O-N 3.06Å; Y390-G394 PolarHBondContact O-N 2.99Å
391T91.6Very high90.8Very high0 Ų054.3 Ų54.30%026%0.26CS..Hα-helixtrans-62.6-49.7174.7-55.20000110.1F252 L378 Y388 K389 G394 C395F252-T391 HydrophobicContact CD2-CG2 4.08Å; F252-T391 HydrophobicContact CE2-CG2 4.38Å; L378-T391 HydrophobicContact CB-CG2 3.95Å; L378-T391 PolarHBondContact O-OG1 3.31Å; Y388-T391 WeakPolarHBondContact O-CA 3.39Å; Y388-T391 WeakPolarHBondContact O-CB 3.43Å; Y388-T391 PolarHBondContact O-N 3.34Å; K389-T391 VanDerWaalsContact C-N 3.3Å; K389-T391 PolarHBondContact O-N 3.16Å; T391-G394 PolarHBondContact O-N 3.48Å; T391-C395 PolarHBondContact O-N 3.12Å; T391-C395 PolarHBondContact O-SG 3.25Å
392Y93.8Very high91.2Very high0 Ų050.4 Ų50.40%024%0.243CC..Hα-helixtrans-67.1-41.5179.9-82.5-101.2000112.7P249 F252 L253 Y256 A316 Y328 Y388 K389 C395 G396P249-Y392 HydrophobicContact CB-CD1 3.97Å; P249-Y392 HydrophobicContact CB-CE1 3.55Å; P249-Y392 PolarHBondContact O-OH 2.89Å; F252-Y392 HydrophobicContact CB-CE2 4.48Å; L253-Y392 WeakPolarHBondContact CA-OH 3.33Å; L253-Y392 PolarHBondContact N-OH 2.93Å; L253-Y392 VanDerWaalsContact N-OH 3.16Å; Y256-Y392 AromaticContact CD1-CD2 3.93Å; Y256-Y392 HydrophobicContact CD1-CD2 3.93Å; Y256-Y392 AromaticContact CD1-CE2 3.53Å; Y256-Y392 HydrophobicContact CD1-CE2 3.53Å; Y256-Y392 AromaticContact CD1-CZ 3.89Å; Y256-Y392 HydrophobicContact CE1-CD2 4.26Å; Y256-Y392 HydrophobicContact CE1-CE2 4.3Å; Y256-Y392 AromaticContact CG-CE2 3.99Å; Y256-Y392 HydrophobicContact CG-CE2 3.99Å; A316-Y392 HydrophobicContact CB-CD1 3.55Å; A316-Y392 HydrophobicContact CB-CE1 4.3Å; A316-Y392 HydrophobicContact CB-CG 4.1Å; Y328-Y392 HydrophobicContact CE1-CE1 4.1Å; Y328-Y392 AromaticContact CZ-CE1 3.93Å; Y328-Y392 WeakPolarHBondContact OH-CE1 3.44Å; Y388-Y392 WeakPolarHBondContact O-CD2 3.32Å; Y388-Y392 PolarHBondContact O-N 3.18Å; K389-Y392 PolarHBondContact O-N 3.05Å; Y392-C395 PolarHBondContact O-N 3.48Å; Y392-G396 PolarHBondContact O-N 3.47Å
393Q93.7Very high91.9Very high58 Ų5849.5 Ų49.527%0.27124%0.239SC..Hα-helixtrans-62.9-43.3175.2-71.5-180-38.200111.7P317 K389 G396 I397P317-Q393 HydrophobicContact CG-CG 3.88Å; K389-Q393 WeakPolarHBondContact O-CG 3.45Å; K389-Q393 PolarHBondContact O-N 3.47Å; Q393-G396 PolarHBondContact O-N 3.48Å; Q393-I397 VanDerWaalsContact O-CG1 3.28Å; Q393-I397 WeakPolarHBondContact O-CG1 3.27Å; Q393-I397 PolarHBondContact O-N 2.96Å
394G92.5Very high92.4Very high19 Ų1951.6 Ų51.620%0.19625%0.253CS..Hα-helixtrans-58.8-46.9174.300000112.4Y390 T391 G396 I397 V398Y390-G394 PolarHBondContact O-N 2.99Å; T391-G394 PolarHBondContact O-N 3.48Å; G394-G396 VanDerWaalsContact C-N 3.34Å; G394-G396 PolarHBondContact O-N 3.01Å; G394-I397 PolarHBondContact O-N 3.36Å; G394-V398 WeakPolarHBondContact O-CG2 3.44Å; G394-V398 PolarHBondContact O-N 3.21Å
395C93.8Very high92.7Very high0 Ų051 Ų510%025%0.248CC..Hα-helixtrans-58.2-46.8174.8-63.40000111.8P249 L378 T391 Y392 V398 L399P249-C395 HydrophobicContact CG-CB 3.54Å; P249-C395 VanDerWaalsContact CG-SG 3.59Å; L378-C395 WeakPolarHBondContact CD1-SG 3.39Å; T391-C395 PolarHBondContact O-N 3.12Å; T391-C395 PolarHBondContact O-SG 3.25Å; Y392-C395 PolarHBondContact O-N 3.48Å; C395-V398 PolarHBondContact O-N 3.04Å; C395-L399 WeakPolarHBondContact O-CG 3.21Å; C395-L399 PolarHBondContact O-N 3.33Å
396G95.1Very high93Very high0 Ų045 Ų450%022%0.224CC..Hα-helixtrans-62.3-43.4-179.100000112.9G310 Y392 Q393 G394 L399 I400G310-G396 WeakPolarHBondContact O-CA 3.48Å; Y392-G396 PolarHBondContact O-N 3.47Å; Q393-G396 PolarHBondContact O-N 3.48Å; G394-G396 VanDerWaalsContact C-N 3.34Å; G394-G396 PolarHBondContact O-N 3.01Å; G396-L399 PolarHBondContact O-N 3.04Å; G396-I400 VanDerWaalsContact O-CG1 3.26Å; G396-I400 WeakPolarHBondContact O-CG1 3.48Å; G396-I400 PolarHBondContact O-N 2.91Å
397I95.1Very high93.5Very high91 Ų9141.8 Ų41.847%0.46721%0.208SC..Hα-helixtrans-62.5-45.4176.2-67.9164.3000110.9Q393 G394 L399 I400 I401Q393-I397 VanDerWaalsContact O-CG1 3.28Å; Q393-I397 WeakPolarHBondContact O-CG1 3.27Å; Q393-I397 PolarHBondContact O-N 2.96Å; G394-I397 PolarHBondContact O-N 3.36Å; I397-L399 VanDerWaalsContact C-N 3.32Å; I397-L399 PolarHBondContact O-N 2.99Å; I397-I400 PolarHBondContact O-N 3.33Å; I397-I401 HydrophobicContact CG2-CD1 3.77Å; I397-I401 HydrophobicContact CG2-CG1 4.39Å; I397-I401 VanDerWaalsContact O-CG1 3.32Å; I397-I401 WeakPolarHBondContact O-CG1 3.47Å; I397-I401 PolarHBondContact O-N 2.93Å
398V94.8Very high93.7Very high44 Ų4443.4 Ų43.427%0.26722%0.22SC..Hα-helixtrans-58.8-43.5177.2170.40000111.2V241 F244 G394 C395 I401 S402V241-V398 HydrophobicContact CG1-CG1 4.15Å; V241-V398 VanDerWaalsContact O-CG1 3.27Å; V241-V398 WeakPolarHBondContact O-CG1 3.33Å; F244-V398 HydrophobicContact CB-CG1 4.31Å; G394-V398 WeakPolarHBondContact O-CG2 3.44Å; G394-V398 PolarHBondContact O-N 3.21Å; C395-V398 PolarHBondContact O-N 3.04Å; V398-I401 PolarHBondContact O-N 3.48Å; V398-S402 WeakPolarHBondContact O-CB 3.34Å; V398-S402 PolarHBondContact O-N 3.14Å
399L96Very high93.7Very high0 Ų043.6 Ų43.60%022%0.222CC..Hα-helixtrans-66.3-40176.3-70.4-170.5000112.8M242 L246 V306 N309 H313 C395 G396 I397 S402 S403M242-L399 HydrophobicContact CB-CD2 4.31Å; M242-L399 HydrophobicContact CG-CD2 3.65Å; M242-L399 WeakPolarHBondContact O-CD2 3.18Å; L246-L399 HydrophobicContact CB-CD2 4.47Å; V306-L399 HydrophobicContact CG1-CB 4.42Å; V306-L399 HydrophobicContact CG1-CD2 4.35Å; V306-L399 WeakPolarHBondContact CG1-O 3.43Å; N309-L399 HydrophobicContact CB-CD1 3.7Å; H313-L399 VanDerWaalsContact CD2-CD1 3.5Å; H313-L399 WeakPolarHBondContact CD2-CD1 3.03Å; C395-L399 WeakPolarHBondContact O-CG 3.21Å; C395-L399 PolarHBondContact O-N 3.33Å; G396-L399 PolarHBondContact O-N 3.04Å; I397-L399 VanDerWaalsContact C-N 3.32Å; I397-L399 PolarHBondContact O-N 2.99Å; L399-S402 PolarHBondContact O-N 3.41Å; L399-S403 WeakPolarHBondContact O-CB 3.36Å; L399-S403 PolarHBondContact O-N 3.05Å
400I96.9Very high93.6Very high51 Ų5139.8 Ų39.826%0.26221%0.206SC..Hα-helixtrans-62.9-45.8176.4-68.6164.9000110.2L307 V314 G396 I397 S402 S403 V404L307-I400 HydrophobicContact CD1-CB 4.46Å; L307-I400 HydrophobicContact CD1-CG1 4.15Å; L307-I400 HydrophobicContact CD1-CG2 4.11Å; V314-I400 HydrophobicContact CG2-CD1 3.86Å; G396-I400 VanDerWaalsContact O-CG1 3.26Å; G396-I400 WeakPolarHBondContact O-CG1 3.48Å; G396-I400 PolarHBondContact O-N 2.91Å; I397-I400 PolarHBondContact O-N 3.33Å; I400-S402 VanDerWaalsContact C-N 3.34Å; I400-S402 PolarHBondContact O-N 3.07Å; I400-S403 WeakPolarHBondContact O-CB 3.31Å; I400-S403 PolarHBondContact O-N 3.49Å; I400-S403 VanDerWaalsContact O-N 3.17Å; I400-V404 WeakPolarHBondContact O-CG2 3.21Å; I400-V404 PolarHBondContact O-N 3.41Å
401I96Very high93.4Very high101 Ų10135 Ų3552%0.51819%0.19SC..Hα-helixtrans-59.2-48176.2-68.3167.8000110.3I397 V398 S403 V404 F405I397-I401 HydrophobicContact CG2-CD1 3.77Å; I397-I401 HydrophobicContact CG2-CG1 4.39Å; I397-I401 VanDerWaalsContact O-CG1 3.32Å; I397-I401 WeakPolarHBondContact O-CG1 3.47Å; I397-I401 PolarHBondContact O-N 2.93Å; V398-I401 PolarHBondContact O-N 3.48Å; I401-S403 VanDerWaalsContact C-N 3.27Å; I401-S403 PolarHBondContact O-N 2.98Å; I401-V404 PolarHBondContact O-N 3.45Å; I401-F405 WeakPolarHBondContact O-CB 3.36Å; I401-F405 PolarHBondContact O-N 3.26Å
402S95.3Very high93.1Very high1 Ų139.3 Ų39.31%0.00721%0.212CC..Hα-helixtrans-59.3-39.7176.6-173.10000112.3G238 M242 V398 L399 I400 F405 L406G238-S402 PolarHBondContact O-OG 3.25Å; M242-S402 WeakPolarHBondContact CB-OG 3.4Å; M242-S402 PolarHBondContact N-OG 3.37Å; V398-S402 WeakPolarHBondContact O-CB 3.34Å; V398-S402 PolarHBondContact O-N 3.14Å; L399-S402 PolarHBondContact O-N 3.41Å; I400-S402 VanDerWaalsContact C-N 3.34Å; I400-S402 PolarHBondContact O-N 3.07Å; S402-F405 PolarHBondContact O-N 2.94Å; S402-L406 WeakPolarHBondContact O-CB 3.26Å; S402-L406 WeakPolarHBondContact O-CG 3.48Å; S402-L406 PolarHBondContact O-N 3.21Å
403S95.7Very high92.8Very high4 Ų439.9 Ų39.93%0.02822%0.215CC..Hα-helixtrans-66.5-44.3178.1176.50000111.8A303 L307 L399 I400 I401 F405 L406 F407A303-S403 PolarHBondContact O-OG 3.14Å; L307-S403 VanDerWaalsContact CB-OG 3.32Å; L307-S403 WeakPolarHBondContact CB-OG 3.36Å; L307-S403 PolarHBondContact N-OG 3.37Å; L399-S403 WeakPolarHBondContact O-CB 3.36Å; L399-S403 PolarHBondContact O-N 3.05Å; I400-S403 WeakPolarHBondContact O-CB 3.31Å; I400-S403 PolarHBondContact O-N 3.49Å; I400-S403 VanDerWaalsContact O-N 3.17Å; I401-S403 VanDerWaalsContact C-N 3.27Å; I401-S403 PolarHBondContact O-N 2.98Å; S403-F405 VanDerWaalsContact C-N 3.3Å; S403-L406 PolarHBondContact O-N 3.35Å; S403-F407 VanDerWaalsContact O-CB 3.24Å; S403-F407 WeakPolarHBondContact O-CB 3.32Å; S403-F407 PolarHBondContact O-N 3.33Å
404V95.4Very high92.4Very high82 Ų8238.8 Ų38.850%0.49721%0.209SC..Hα-helixtrans-63.5-43178.2172.50000109.6I400 I401 F407 V408I400-V404 WeakPolarHBondContact O-CG2 3.21Å; I400-V404 PolarHBondContact O-N 3.41Å; I401-V404 PolarHBondContact O-N 3.45Å; V404-F407 PolarHBondContact O-N 2.99Å; V404-V408 HydrophobicContact CG1-CG2 4.38Å; V404-V408 WeakPolarHBondContact O-CB 3.31Å; V404-V408 WeakPolarHBondContact O-CG2 3.34Å; V404-V408 PolarHBondContact O-N 2.95Å
405F95Very high92.1Very high86 Ų8646.8 Ų46.838%0.37723%0.233SC..Hα-helixtrans-58.5-50174.7179.5-95.7000112.1L234 M237 I401 S402 S403 F407 G409L234-F405 HydrophobicContact CD2-CZ 4.38Å; M237-F405 HydrophobicContact CB-CE1 3.84Å; M237-F405 HydrophobicContact CB-CZ 4.07Å; M237-F405 HydrophobicContact CE-CZ 3.99Å; M237-F405 HydrophobicContact SD-CZ 4.48Å; I401-F405 WeakPolarHBondContact O-CB 3.36Å; I401-F405 PolarHBondContact O-N 3.26Å; S402-F405 PolarHBondContact O-N 2.94Å; S403-F405 VanDerWaalsContact C-N 3.3Å; F405-F407 PolarHBondContact O-N 3.21Å; F405-G409 WeakPolarHBondContact O-CA 3.28Å; F405-G409 PolarHBondContact O-N 3.27Å
406L93.3Very high91.6Very high2 Ų249.8 Ų49.81%0.0125%0.249CC..Hα-helixtrans-62.5-42.5176.9-77.2168.7000111.7F302 A303 V306 S402 S403 M410F302-L406 HydrophobicContact CD1-CD1 4.15Å; F302-L406 HydrophobicContact CE1-CD1 3.66Å; A303-L406 HydrophobicContact CB-CB 4.18Å; V306-L406 HydrophobicContact CG2-CD1 4.33Å; S402-L406 WeakPolarHBondContact O-CB 3.26Å; S402-L406 WeakPolarHBondContact O-CG 3.48Å; S402-L406 PolarHBondContact O-N 3.21Å; S403-L406 PolarHBondContact O-N 3.35Å; L406-M410 HydrophobicContact CD2-CE 4.02Å; L406-M410 WeakPolarHBondContact O-CB 3.34Å; L406-M410 WeakPolarHBondContact O-CG 3.33Å; L406-M410 PolarHBondContact O-N 2.94Å
407F93.7Very high91.1Very high95 Ų9553 Ų5342%0.41727%0.266SS..Hα-helixtrans-63.3-48.2-179.2-168.3-87.5000111.7Y300 A303 S403 V404 F405 G411Y300-F407 AromaticContact CD1-CD2 3.69Å; Y300-F407 HydrophobicContact CD1-CD2 3.69Å; Y300-F407 HydrophobicContact CD1-CE1 4.37Å; Y300-F407 AromaticContact CD1-CE2 3.52Å; Y300-F407 HydrophobicContact CD1-CE2 3.52Å; Y300-F407 HydrophobicContact CD1-CG 4.2Å; Y300-F407 AromaticContact CD1-CZ 3.88Å; Y300-F407 HydrophobicContact CD1-CZ 3.88Å; Y300-F407 HydrophobicContact CE1-CD1 4.42Å; Y300-F407 HydrophobicContact CE1-CD2 4.38Å; Y300-F407 HydrophobicContact CE1-CE1 4.22Å; Y300-F407 HydrophobicContact CE1-CE2 4.17Å; Y300-F407 HydrophobicContact CE1-CG 4.49Å; Y300-F407 HydrophobicContact CE1-CZ 4.09Å; Y300-F407 HydrophobicContact CG-CE2 4.31Å; A303-F407 HydrophobicContact CB-CB 3.98Å; A303-F407 HydrophobicContact CB-CD2 4.06Å; S403-F407 VanDerWaalsContact O-CB 3.24Å; S403-F407 WeakPolarHBondContact O-CB 3.32Å; S403-F407 PolarHBondContact O-N 3.33Å; V404-F407 PolarHBondContact O-N 2.99Å; F405-F407 PolarHBondContact O-N 3.21Å; F407-G411 PolarHBondContact O-N 3.46Å
408V92.3Very high90.7Very high81 Ų8152.8 Ų52.849%0.49127%0.265SS..Hα-helixtrans-68.7-46.9178.4175.20000110.7V404 M410 G411 I412V404-V408 HydrophobicContact CG1-CG2 4.38Å; V404-V408 WeakPolarHBondContact O-CB 3.31Å; V404-V408 WeakPolarHBondContact O-CG2 3.34Å; V404-V408 PolarHBondContact O-N 2.95Å; V408-M410 PolarHBondContact O-N 3.38Å; V408-G411 PolarHBondContact O-N 3.48Å; V408-I412 HydrophobicContact CG1-CD1 3.99Å; V408-I412 WeakPolarHBondContact O-CG1 3.49Å; V408-I412 PolarHBondContact O-N 3.44Å
409G87.9Confident90.2Very high7 Ų756.9 Ų56.97%0.07228%0.28CS..Hα-helixtrans-59.9-47.9-179.600000112.3L234 F405 G411 I412 N413L234-G409 WeakPolarHBondContact CD1-O 3.47Å; F405-G409 WeakPolarHBondContact O-CA 3.28Å; F405-G409 PolarHBondContact O-N 3.27Å; G409-G411 VanDerWaalsContact C-N 3.3Å; G409-G411 PolarHBondContact O-N 3.42Å; G409-I412 PolarHBondContact O-N 3.08Å; G409-N413 PolarHBondContact O-N 3.32Å
410M87.4Confident89.8Confident3 Ų360.7 Ų60.72%0.01530%0.297CS..Hα-helixtrans-68.2-32.3177.4-62.9-62.4160.800111.7L234 Y235 Q299 L406 V408 N413 Y414L234-M410 HydrophobicContact CB-CE 4Å; Y235-M410 HydrophobicContact CD2-CE 4.44Å; Q299-M410 HydrophobicContact CB-CB 3.86Å; Q299-M410 HydrophobicContact CB-CG 3.87Å; Q299-M410 HydrophobicContact CB-SD 4.14Å; Q299-M410 HydrophobicContact CG-CG 4.45Å; Q299-M410 HydrophobicContact CG-SD 4.06Å; Q299-M410 PolarHBondContact OE1-SD 3.29Å; L406-M410 HydrophobicContact CD2-CE 4.02Å; L406-M410 WeakPolarHBondContact O-CB 3.34Å; L406-M410 WeakPolarHBondContact O-CG 3.33Å; L406-M410 PolarHBondContact O-N 2.94Å; V408-M410 PolarHBondContact O-N 3.38Å; M410-N413 WeakPolarHBondContact O-CB 3.24Å; M410-N413 PolarHBondContact O-N 3.29Å; M410-Y414 VanDerWaalsContact O-CD2 3.24Å; M410-Y414 WeakPolarHBondContact O-CD2 3.02Å; M410-Y414 PolarHBondContact O-N 3.13Å
411G85.3Confident89.2Confident9 Ų964.2 Ų64.29%0.09331%0.311CS..Hα-helixtrans-67.6-36.8173.800000114.4Y300 F407 V408 G409 R415Y300-G411 WeakPolarHBondContact OH-CA 3.48Å; F407-G411 PolarHBondContact O-N 3.46Å; V408-G411 PolarHBondContact O-N 3.48Å; G409-G411 VanDerWaalsContact C-N 3.3Å; G409-G411 PolarHBondContact O-N 3.42Å; G411-R415 WeakPolarHBondContact O-CG 3.32Å; G411-R415 PolarHBondContact O-N 3.15Å; G411-R415 VanDerWaalsContact O-N 3.14Å
412I85.8Confident88.8Confident92 Ų9266.3 Ų66.347%0.47232%0.316SS..Hα-helixtrans-64.5-44170.3-66.2165.9000109.8V408 G409 Y414 R415 L416V408-I412 HydrophobicContact CG1-CD1 3.99Å; V408-I412 WeakPolarHBondContact O-CG1 3.49Å; V408-I412 PolarHBondContact O-N 3.44Å; G409-I412 PolarHBondContact O-N 3.08Å; I412-Y414 PolarHBondContact O-N 2.64Å; I412-R415 PolarHBondContact O-N 2.85Å; I412-L416 HydrophobicContact CG2-CD1 3.84Å; I412-L416 HydrophobicContact CG2-CG 4.33Å; I412-L416 WeakPolarHBondContact O-CG 3.48Å; I412-L416 PolarHBondContact O-N 3.48Å
413N86.9Confident88.3Confident12 Ų1271.2 Ų71.26%0.06434%0.339CS..Hα-helixtrans-58.6-47.4178.4-171.352000112L234 G409 M410 R415 L416 L417L234-N413 HydrophobicContact CD1-CB 4.24Å; G409-N413 PolarHBondContact O-N 3.32Å; M410-N413 WeakPolarHBondContact O-CB 3.24Å; M410-N413 PolarHBondContact O-N 3.29Å; N413-R415 PolarHBondContact O-N 3.45Å; N413-L416 PolarHBondContact O-N 2.9Å; N413-L417 WeakPolarHBondContact O-CG 3.42Å; N413-L417 PolarHBondContact O-N 3.12Å
414Y85.6Confident87.8Confident34 Ų3477.3 Ų77.313%0.13337%0.367CS..Hα-helixtrans-60-45175.3-79.9-57.7000112.6P296 R297 Q299 Y300 M410 I412 L416 L417 D418P296-Y414 PolarHBondContact O-OH 2.94Å; R297-Y414 WeakPolarHBondContact CA-OH 3.5Å; Q299-Y414 HydrophobicContact CB-CE2 3.85Å; Q299-Y414 HydrophobicContact CG-CE2 4.36Å; Y300-Y414 HydrophobicContact CD2-CD2 4.03Å; Y300-Y414 AromaticContact CD2-CE2 3.7Å; Y300-Y414 HydrophobicContact CD2-CE2 3.7Å; Y300-Y414 AromaticContact CE2-CD2 3.37Å; Y300-Y414 HydrophobicContact CE2-CD2 3.37Å; Y300-Y414 AromaticContact CE2-CE2 3.55Å; Y300-Y414 HydrophobicContact CE2-CE2 3.55Å; Y300-Y414 HydrophobicContact CE2-CG 4.42Å; Y300-Y414 AromaticContact CZ-CD2 3.84Å; M410-Y414 VanDerWaalsContact O-CD2 3.24Å; M410-Y414 WeakPolarHBondContact O-CD2 3.02Å; M410-Y414 PolarHBondContact O-N 3.13Å; I412-Y414 PolarHBondContact O-N 2.64Å; Y414-L416 VanDerWaalsContact C-N 3.3Å; Y414-L416 PolarHBondContact O-N 3.35Å; Y414-L417 PolarHBondContact O-N 2.88Å; Y414-D418 WeakPolarHBondContact O-CB 3.41Å; Y414-D418 PolarHBondContact O-N 2.93Å
415R86Confident87.3Confident187 Ų18778.6 Ų78.671%0.70637%0.368SS*.Hα-helixtrans-62.8-36.3179-74.6178.9178.9-171.20.9112.7G411 I412 N413 K419G411-R415 WeakPolarHBondContact O-CG 3.32Å; G411-R415 PolarHBondContact O-N 3.15Å; G411-R415 VanDerWaalsContact O-N 3.14Å; I412-R415 PolarHBondContact O-N 2.85Å; N413-R415 PolarHBondContact O-N 3.45Å; R415-K419 WeakPolarHBondContact O-CG 3.36Å; R415-K419 PolarHBondContact O-N 3.27Å; R415-K419 VanDerWaalsContact O-N 3.15Å
416L84.7Confident86.8Confident64 Ų6482.1 Ų82.134%0.33538%0.379SS..Hα-helixtrans-71-44.9177.3-71.3171.7000111.3I412 N413 Y414 D418 K419 E420I412-L416 HydrophobicContact CG2-CD1 3.84Å; I412-L416 HydrophobicContact CG2-CG 4.33Å; I412-L416 WeakPolarHBondContact O-CG 3.48Å; I412-L416 PolarHBondContact O-N 3.48Å; N413-L416 PolarHBondContact O-N 2.9Å; Y414-L416 VanDerWaalsContact C-N 3.3Å; Y414-L416 PolarHBondContact O-N 3.35Å; L416-D418 VanDerWaalsContact C-N 3.28Å; L416-D418 PolarHBondContact O-N 3.2Å; L416-K419 WeakPolarHBondContact O-CB 3.31Å; L416-K419 PolarHBondContact O-N 3Å; L416-E420 WeakPolarHBondContact O-CG 3.19Å; L416-E420 PolarHBondContact O-N 3.46Å
417L84.8Confident86.4Confident67 Ų6788.1 Ų88.135%0.35140%0.404SS..Hα-helixtrans-59.4-40175.3-72.6167.2000111.9N413 Y414 K419 E420 K421N413-L417 WeakPolarHBondContact O-CG 3.42Å; N413-L417 PolarHBondContact O-N 3.12Å; Y414-L417 PolarHBondContact O-N 2.88Å; L417-K419 VanDerWaalsContact C-N 3.33Å; L417-K419 PolarHBondContact O-N 3.4Å; L417-E420 PolarHBondContact O-N 3.03Å; L417-K421 WeakPolarHBondContact O-CG 3.32Å; L417-K421 PolarHBondContact O-N 3.41Å
418D85.1Confident85.8Confident86 Ų8687.4 Ų87.446%0.4642%0.416SS..Hα-helixtrans-66.2-34.9175.5-73.5-17.4000112.3Y414 L416 K422Y414-D418 WeakPolarHBondContact O-CB 3.41Å; Y414-D418 PolarHBondContact O-N 2.93Å; L416-D418 VanDerWaalsContact C-N 3.28Å; L416-D418 PolarHBondContact O-N 3.2Å; D418-K422 WeakPolarHBondContact O-CB 3.48Å; D418-K422 VanDerWaalsContact O-CG 3.24Å; D418-K422 WeakPolarHBondContact O-CG 3.43Å; D418-K422 PolarHBondContact O-N 2.98Å; D418-K422 VanDerWaalsContact O-N 3.12Å
419K85.8Confident85.1Confident131 Ų13193.5 Ų93.557%0.5743%0.43SS*.Hα-helixtrans-68.3-46.3174.4-77.2178.6177.7-171.60111.5R415 L416 L417 K421 K422 E423R415-K419 WeakPolarHBondContact O-CG 3.36Å; R415-K419 PolarHBondContact O-N 3.27Å; R415-K419 VanDerWaalsContact O-N 3.15Å; L416-K419 WeakPolarHBondContact O-CB 3.31Å; L416-K419 PolarHBondContact O-N 3Å; L417-K419 VanDerWaalsContact C-N 3.33Å; L417-K419 PolarHBondContact O-N 3.4Å; K419-K421 VanDerWaalsContact C-N 3.35Å; K419-K421 PolarHBondContact O-N 2.9Å; K419-K422 PolarHBondContact O-N 3.15Å; K419-E423 WeakPolarHBondContact O-CG 3.31Å; K419-E423 PolarHBondContact O-N 3.3Å
420E86.6Confident84.6Confident79 Ų7998.1 Ų98.137%0.36945%0.451SS..Hα-helixtrans-59.7-45.1178.4-71.4171.1179.300110.7R230 L416 L417 K422 E423 E424R230-E420 IonicContact NH1-OE1 3.54Å; R230-E420 PolarHBondContact NH1-OE1 3Å; L416-E420 WeakPolarHBondContact O-CG 3.19Å; L416-E420 PolarHBondContact O-N 3.46Å; L417-E420 PolarHBondContact O-N 3.03Å; E420-K422 PolarHBondContact O-N 3.27Å; E420-E423 PolarHBondContact O-N 3.42Å; E420-E424 WeakPolarHBondContact O-CG 3.37Å; E420-E424 PolarHBondContact O-N 3.11Å
421K84.9Confident83.1Confident126 Ų126100.8 Ų100.855%0.54848%0.479SS..Hα-helixtrans-59.7-45.3173.7-76.1179.3179.8178.90113L417 K419 E423 E424 E425L417-K421 WeakPolarHBondContact O-CG 3.32Å; L417-K421 PolarHBondContact O-N 3.41Å; K419-K421 VanDerWaalsContact C-N 3.35Å; K419-K421 PolarHBondContact O-N 2.9Å; K421-E423 VanDerWaalsContact C-N 3.29Å; K421-E423 PolarHBondContact O-N 2.9Å; K421-E424 PolarHBondContact O-N 3.27Å; K421-E425 WeakPolarHBondContact O-CG 3.36Å; K421-E425 PolarHBondContact O-N 3.43Å
422K86.8Confident81.6Confident144 Ų144105.4 Ų105.463%0.62651%0.506SS*.Hα-helixtrans-63.1-36.4177.2-75.7173.6-178.6-1790112D418 K419 E420 R426D418-K422 WeakPolarHBondContact O-CB 3.48Å; D418-K422 VanDerWaalsContact O-CG 3.24Å; D418-K422 WeakPolarHBondContact O-CG 3.43Å; D418-K422 PolarHBondContact O-N 2.98Å; D418-K422 VanDerWaalsContact O-N 3.12Å; K419-K422 PolarHBondContact O-N 3.15Å; E420-K422 PolarHBondContact O-N 3.27Å; K422-R426 WeakPolarHBondContact O-CB 3.14Å; K422-R426 PolarHBondContact O-N 3.36Å
423E85.7Confident79.6Confident104 Ų104112 Ų11249%0.48653%0.525SS..Hα-helixtrans-68.9-40.2175.1-76-177.7-168.900112.4K419 E420 K421 R426 K427K419-E423 WeakPolarHBondContact O-CG 3.31Å; K419-E423 PolarHBondContact O-N 3.3Å; E420-E423 PolarHBondContact O-N 3.42Å; K421-E423 VanDerWaalsContact C-N 3.29Å; K421-E423 PolarHBondContact O-N 2.9Å; E423-R426 PolarHBondContact O-N 3.04Å; E423-K427 WeakPolarHBondContact O-CB 3.33Å; E423-K427 VanDerWaalsContact O-CG 3.32Å; E423-K427 WeakPolarHBondContact O-CG 3.27Å; E423-K427 PolarHBondContact O-N 2.95Å
424E85Confident77.4Confident133 Ų133119.4 Ų119.462%0.62156%0.559SS**Hα-helixtrans-63.5-46.8173.7-74.1-178.8169.500111.7E420 K421 R426 K427 A428E420-E424 WeakPolarHBondContact O-CG 3.37Å; E420-E424 PolarHBondContact O-N 3.11Å; K421-E424 PolarHBondContact O-N 3.27Å; E424-R426 VanDerWaalsContact C-N 3.29Å; E424-R426 PolarHBondContact O-N 3.28Å; E424-K427 PolarHBondContact O-N 3.16Å; E424-A428 WeakPolarHBondContact O-CB 3.43Å; E424-A428 PolarHBondContact O-N 3.48Å
425E85.1Confident75.1Confident108 Ų108123.8 Ų123.851%0.50559%0.591SS.*Hα-helixtrans-60.2-40.3174.4-74.5179.7-169.900111.5K421 A428 R429K421-E425 WeakPolarHBondContact O-CG 3.36Å; K421-E425 PolarHBondContact O-N 3.43Å; E425-A428 PolarHBondContact O-N 2.97Å; E425-R429 WeakPolarHBondContact O-CB 3.33Å; E425-R429 VanDerWaalsContact O-CG 3.24Å; E425-R429 WeakPolarHBondContact O-CG 3.32Å; E425-R429 PolarHBondContact O-N 3.02Å
426R85.1Confident72.6Confident161 Ų161120.8 Ų120.861%0.60859%0.589SS**Hα-helixtrans-64.2-44.7175.1-174.6-176.1142.4-164.5-5.4111.1K422 E423 E424 R429 M430K422-R426 WeakPolarHBondContact O-CB 3.14Å; K422-R426 PolarHBondContact O-N 3.36Å; E423-R426 PolarHBondContact O-N 3.04Å; E424-R426 VanDerWaalsContact C-N 3.29Å; E424-R426 PolarHBondContact O-N 3.28Å; R426-R429 PolarHBondContact O-N 3.44Å; R426-M430 HydrophobicContact CG-CE 3.81Å; R426-M430 HydrophobicContact CG-SD 4.08Å; R426-M430 WeakPolarHBondContact O-CB 3.47Å; R426-M430 VanDerWaalsContact O-CG 3.24Å; R426-M430 WeakPolarHBondContact O-CG 3.48Å; R426-M430 PolarHBondContact O-N 3.38Å
427K84.1Confident70.4Confident127 Ų127123.3 Ų123.355%0.55262%0.619SS**Hα-helixtrans-62.9-40.2176.1-75.9173.7-177.9172.90112E423 E424 M430E423-K427 WeakPolarHBondContact O-CB 3.33Å; E423-K427 VanDerWaalsContact O-CG 3.32Å; E423-K427 WeakPolarHBondContact O-CG 3.27Å; E423-K427 PolarHBondContact O-N 2.95Å; E424-K427 PolarHBondContact O-N 3.16Å; K427-M430 HydrophobicContact CG-CE 4.48Å; K427-M430 PolarHBondContact O-N 3.12Å
428A80.9Confident68.3Low80 Ų80124 Ų12466%0.66163%0.63SS**Hα-helixtrans-66.2-43175.600000112E424 E425 G431E424-A428 WeakPolarHBondContact O-CB 3.43Å; E424-A428 PolarHBondContact O-N 3.48Å; E425-A428 PolarHBondContact O-N 2.97Å; A428-G431 PolarHBondContact O-N 3.27Å
429R77.6Confident66Low209 Ų209130.1 Ų130.179%0.78965%0.647SS**Hα-helixtrans-66.8-32.8175.6-74.3178.4-170.6-148.85.2113.2E425 R426 G431E425-R429 WeakPolarHBondContact O-CB 3.33Å; E425-R429 VanDerWaalsContact O-CG 3.24Å; E425-R429 WeakPolarHBondContact O-CG 3.32Å; E425-R429 PolarHBondContact O-N 3.02Å; R426-R429 PolarHBondContact O-N 3.44Å; R429-G431 PolarHBondContact O-N 3.28Å
430M77.3Confident63.6Low104 Ų104130.3 Ų130.351%0.51265%0.654SS.*THydrogen-bonded Turntrans-75.84.2177-70.8-177.1-50.700113.3R426 K427 V432R426-M430 HydrophobicContact CG-CE 3.81Å; R426-M430 HydrophobicContact CG-SD 4.08Å; R426-M430 WeakPolarHBondContact O-CB 3.47Å; R426-M430 VanDerWaalsContact O-CG 3.24Å; R426-M430 WeakPolarHBondContact O-CG 3.48Å; R426-M430 PolarHBondContact O-N 3.38Å; K427-M430 HydrophobicContact CG-CE 4.48Å; K427-M430 PolarHBondContact O-N 3.12Å; M430-V432 HydrophobicContact CB-CG2 4.4Å; M430-V432 PolarHBondContact O-N 3.01Å; M430-V432 VanDerWaalsContact O-N 3.09Å
431G55.8Low61.2Low59 Ų59133.4 Ų133.461%0.60867%0.673SS**THydrogen-bonded Turntrans60.626.2170.400000114.2A428 R429 R433A428-G431 PolarHBondContact O-N 3.27Å; R429-G431 PolarHBondContact O-N 3.28Å; G431-R433 PolarHBondContact O-N 3.39Å
432V54.8Low58.8Low106 Ų106131.3 Ų131.364%0.64267%0.674SS**  trans-71.983.5174.1-173.90000107.5M430 Q434M430-V432 HydrophobicContact CB-CG2 4.4Å; M430-V432 PolarHBondContact O-N 3.01Å; M430-V432 VanDerWaalsContact O-N 3.09Å; V432-Q434 PolarHBondContact O-N 3.12Å; V432-Q434 VanDerWaalsContact O-N 3.16Å
433R43.1Very low56.4Low232 Ų232128 Ų12888%0.87567%0.674SS**  trans-47.9121.1153.1-97.6179.2169.6170.5-3.2105.6G431G431-R433 PolarHBondContact O-N 3.39Å
434Q39.9Very low54.1Low167 Ų167130.9 Ų130.978%0.7869%0.685SS**  trans-44.3130.1161.6-77.3173.3-1500107.6V432 N436V432-Q434 PolarHBondContact O-N 3.12Å; V432-Q434 VanDerWaalsContact O-N 3.16Å; Q434-N436 PolarHBondContact O-N 3.06Å
435P37.3Very low51.8Low125 Ų125132.2 Ų132.281%0.81269%0.691SS**  trans-59.2115.4164.323.8-27.9000106A437P435-A437 PolarHBondContact O-N 3.02Å
436N35Very low49.6Very low125 Ų125132.4 Ų132.467%0.66870%0.699SS**  trans-30.7111.5175-81-13000111.9Q434 S438Q434-N436 PolarHBondContact O-N 3.06Å; N436-S438 WeakPolarHBondContact CB-OG 3.33Å; N436-S438 PolarHBondContact O-N 3.32Å
437A38.2Very low47.3Very low116 Ų116127.3 Ų127.396%0.95970%0.697SS**SBendtrans-72.942.8155.800000110.4P435P435-A437 PolarHBondContact O-N 3.02Å
438S40.5Very low45.1Very low82 Ų82129.3 Ų129.357%0.57371%0.708SS**  trans-137.349179.171.30000109.9N436N436-S438 WeakPolarHBondContact CB-OG 3.33Å; N436-S438 PolarHBondContact O-N 3.32Å
439R36Very low43.1Very low215 Ų215131.1 Ų131.181%0.81171%0.711SS**SBendtrans-142.624.5170.9-114.4-174-177-172.8-0.4114.1
440D36.1Very low41.3Very low135 Ų135131.8 Ų131.872%0.72271%0.713SS**SBendtrans-123.87.1176.3-142.715.3000114.8
441N36.8Very low39.5Very low143 Ų143134.5 Ų134.577%0.76573%0.73SS**SBendtrans-114.2-5.1171.5-86.23000114.6
442S34.3Very low38.8Very low83 Ų83136.4 Ų136.458%0.5873%0.734SS**SBendtrans-100.6-0176.647.70000114.4
443A35.1Very low38.3Very low75 Ų75139.9 Ų139.962%0.6274%0.743SS**SBendtrans-98.6-4.5171.700000113.4
444K37.6Very low38.4Very low164 Ų164136.4 Ų136.471%0.71374%0.742SS**SBendtrans-95.3-18.6175.2-81.8-174.7175179.10114.7
445E38.2Very low38.4Very low160 Ų160135.1 Ų135.175%0.74875%0.746SS**SBendtrans-90.5-6.1176.3-90.1-179.3156.800114.9
446V37.1Very low38.4Very low112 Ų112139.6 Ų139.668%0.67977%0.77SS**SBendtrans-100-9.4176.4-172.10000112.1
447G36.8Very low38.6Very low55 Ų55140.3 Ų140.357%0.56778%0.775SS**SBendtrans-92-17.8179.600000115.6
448E37.9Very low38.6Very low169 Ų169141.6 Ų141.679%0.7977%0.766SS**SBendtrans-100.8-6.5-177.5-85.8-178.2156.800114.6
449V40.7Very low38.5Very low118 Ų118144.9 Ų144.972%0.71578%0.776SS**SBendtrans-96.80.3179.4-171.80000112.9
450R38Very low38.7Very low222 Ų222140.8 Ų140.884%0.83877%0.774SS**SBendtrans-110.96.5-175.9-107.3-178.9179.4-178-0.8116.4
451N39.9Very low38.8Very low162 Ų162141.1 Ų141.187%0.86678%0.777SS**SBendtrans-123.519.9-177.8-98.98.4000114.3
452S42.4Very low39Very low98 Ų98141 Ų14169%0.68578%0.778SS**SBendtrans-13015.1179.3480000115.4
453E44.5Very low39.3Very low180 Ų180145.1 Ų145.184%0.84179%0.792SS**SBendtrans-133.776.2166.3-76.1-175160.400108.9
454D43.2Very low39.6Very low158 Ų158150.5 Ų150.585%0.84581%0.806SS**SBendtrans175.583.8151.6-92.3-22.5000108.1
455T40.2Very low39.8Very low141 Ų141149.4 Ų149.487%0.86581%0.813SS**  trans178.9110.4141.521.50000111.8
456V38.8Very low39.9Very low218 Ų218148.5 Ų148.5100%1.32182%0.819SS**  trans76.10159.2-165.90000118.4

Retrieved 456 of 456 residues in 949 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).