A0A077Z969_TRITR Loading...

Glt symporter domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z969, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 372 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
1M77.5Confident91.8Very high169 Ų16981.2 Ų81.283%0.83342%0.424SS*.  0113.40-172.5177.7168.900106.8E59 N61M1-E59 CarbonylContact C-O 3.59Å; M1-E59 WeakPolarHBondContact CA-O 3.47Å; M1-N61 WeakPolarHBondContact CE-ND2 3.47Å; M1-N61 WeakPolarHBondContact CG-ND2 3.29Å
2F87.5Confident92.1Very high113 Ų11376.1 Ų76.150%0.49640%0.403SS..EExtended strand (participates in β ladder)trans-99.1131.7176.6-64.9-82.4000108W58 E59 V60 N61F2-W58 HydrophobicContact CE2-CD2 4.08Å; F2-W58 HydrophobicContact CE2-CE3 4.22Å; F2-W58 HydrophobicContact CE2-CG 4.22Å; F2-E59 PolarHBondContact N-O 3.25Å; F2-V60 HydrophobicContact CB-CG2 4.49Å; F2-V60 CarbonylContact O-C 3.47Å; F2-V60 WeakPolarHBondContact O-CA 3.09Å; F2-N61 PolarHBondContact O-N 3.46Å
3H89.8Confident92.4Very high126 Ų12670.2 Ų70.258%0.58337%0.372SS*.EExtended strand (participates in β ladder)trans-112116.8176.6-175.1-71.1000108.5
4L90.2Very high92.7Very high53 Ų5369.2 Ų69.228%0.27737%0.37SS..EExtended strand (participates in β ladder)trans-87.9122.6172.6-61.3-172.4000108.6A8 T9 A12 V60 N61 F62 D63L4-A8 HydrophobicContact CB-CB 3.93Å; L4-A8 HydrophobicContact CD2-CB 4.1Å; L4-A8 HydrophobicContact CG-CB 4.44Å; L4-T9 PolarHBondContact O-OG1 2.97Å; L4-A12 HydrophobicContact CD1-CB 4.3Å; L4-V60 HydrophobicContact CD1-CG1 4.18Å; L4-V60 HydrophobicContact CG-CG1 4.18Å; L4-N61 PolarHBondContact N-O 3.34Å; L4-F62 HydrophobicContact CB-CD1 4.35Å; L4-F62 HydrophobicContact CD1-CD1 3.86Å; L4-F62 HydrophobicContact CD1-CE1 3.65Å; L4-F62 HydrophobicContact CG-CD1 4.49Å; L4-D63 WeakPolarHBondContact O-CB 3.3Å; L4-D63 PolarHBondContact O-N 2.68Å
5D94.2Very high93Very high89 Ų8971.5 Ų71.548%0.47638%0.381SS..  trans-64.1178.1172.668.321.1000111.9L7 A8 T9D5-L7 VanDerWaalsContact C-N 3.29Å; D5-L7 PolarHBondContact O-N 2.88Å; D5-L7 PolarHBondContact OD1-N 3.5Å; D5-L7 VanDerWaalsContact OD1-N 3.11Å; D5-A8 PolarHBondContact O-N 3.02Å; D5-A8 WeakPolarHBondContact OD1-CB 3.38Å; D5-A8 PolarHBondContact OD1-N 3.48Å; D5-T9 VanDerWaalsContact O-CB 3.26Å; D5-T9 WeakPolarHBondContact O-CB 3.35Å; D5-T9 PolarHBondContact O-N 3.32Å; D5-T9 PolarHBondContact O-OG1 3.42Å
6T93.5Very high93.2Very high41 Ų4167.5 Ų67.525%0.25236%0.36SS..Hα-helixtrans-54.4-42.8-178.4-63.10000112.5L10 D63 L66T6-L10 WeakPolarHBondContact O-CB 3.31Å; T6-L10 PolarHBondContact O-N 2.9Å; T6-D63 PolarHBondContact N-OD2 3.48Å; T6-D63 VanDerWaalsContact OG1-CG 3.25Å; T6-D63 PolarHBondContact OG1-OD2 2.89Å; T6-L66 HydrophobicContact CG2-CD1 3.61Å; T6-L66 HydrophobicContact CG2-CD2 4.4Å; T6-L66 HydrophobicContact CG2-CG 3.65Å
7L94.5Very high93.4Very high129 Ų12964.9 Ų64.968%0.67535%0.347SS*.Hα-helixtrans-73.6-44.6-176.1-65.3179.4000111.4D5 T9 L10 V11D5-L7 VanDerWaalsContact C-N 3.29Å; D5-L7 PolarHBondContact O-N 2.88Å; D5-L7 PolarHBondContact OD1-N 3.5Å; D5-L7 VanDerWaalsContact OD1-N 3.11Å; L7-T9 VanDerWaalsContact C-N 3.28Å; L7-T9 PolarHBondContact O-N 3.34Å; L7-L10 WeakPolarHBondContact O-CB 3.18Å; L7-L10 PolarHBondContact O-N 2.95Å; L7-V11 WeakPolarHBondContact O-CG2 3.32Å; L7-V11 PolarHBondContact O-N 2.89Å
8A95.4Very high93.6Very high34 Ų3467.6 Ų67.628%0.28136%0.36SS..Hα-helixtrans-63.6-36.5175.400000111.5L4 D5 V11 A12L4-A8 HydrophobicContact CB-CB 3.93Å; L4-A8 HydrophobicContact CD2-CB 4.1Å; L4-A8 HydrophobicContact CG-CB 4.44Å; D5-A8 PolarHBondContact O-N 3.02Å; D5-A8 WeakPolarHBondContact OD1-CB 3.38Å; D5-A8 PolarHBondContact OD1-N 3.48Å; A8-V11 PolarHBondContact O-N 3.28Å; A8-A12 WeakPolarHBondContact O-CB 3.38Å; A8-A12 PolarHBondContact O-N 3.37Å
9T95.3Very high93.8Very high0 Ų067.7 Ų67.70%036%0.36CS..Hα-helixtrans-64.9-41.2173.2-61.20000111.5L4 D5 L7 A12 A13 F62 D63 M289L4-T9 PolarHBondContact O-OG1 2.97Å; D5-T9 VanDerWaalsContact O-CB 3.26Å; D5-T9 WeakPolarHBondContact O-CB 3.35Å; D5-T9 PolarHBondContact O-N 3.32Å; D5-T9 PolarHBondContact O-OG1 3.42Å; L7-T9 VanDerWaalsContact C-N 3.28Å; L7-T9 PolarHBondContact O-N 3.34Å; T9-A12 PolarHBondContact O-N 3.35Å; T9-A13 WeakPolarHBondContact O-CB 3.38Å; T9-A13 PolarHBondContact O-N 3.45Å; T9-F62 HydrophobicContact CG2-CB 3.82Å; T9-F62 HydrophobicContact CG2-CD1 4.11Å; T9-F62 HydrophobicContact CG2-CG 4.38Å; T9-D63 WeakPolarHBondContact CG2-O 3.46Å; T9-D63 PolarHBondContact OG1-N 3.28Å; T9-D63 VanDerWaalsContact OG1-N 3.16Å; T9-M289 HydrophobicContact CG2-CG 4.48Å
10L95.3Very high93.9Very high56 Ų5664.3 Ų64.329%0.29334%0.342SS..Hα-helixtrans-64.2-40.4175.1-177.561.9000112.1T6 L7 A13 T14 L66 L285 M289T6-L10 WeakPolarHBondContact O-CB 3.31Å; T6-L10 PolarHBondContact O-N 2.9Å; L7-L10 WeakPolarHBondContact O-CB 3.18Å; L7-L10 PolarHBondContact O-N 2.95Å; L10-A13 PolarHBondContact O-N 2.95Å; L10-T14 HydrophobicContact CD1-CG2 4.39Å; L10-T14 WeakPolarHBondContact O-CG2 3.37Å; L10-T14 PolarHBondContact O-N 3.45Å; L10-T14 PolarHBondContact O-OG1 3.42Å; L10-L66 HydrophobicContact CB-CD1 4.19Å; L10-L66 HydrophobicContact CD1-CD1 4.24Å; L10-L66 HydrophobicContact CD2-CD1 4.17Å; L10-L66 HydrophobicContact CG-CD1 4.44Å; L10-L285 HydrophobicContact CD1-CD1 4.39Å; L10-L285 HydrophobicContact CD1-CD2 4.03Å; L10-M289 HydrophobicContact CD1-CE 3.87Å
11V96.2Very high93.9Very high83 Ų8367.8 Ų67.850%0.50335%0.351SS..Hα-helixtrans-60.8-47.8172.3171.80000110.2L7 A8 A13 T14 L15L7-V11 WeakPolarHBondContact O-CG2 3.32Å; L7-V11 PolarHBondContact O-N 2.89Å; A8-V11 PolarHBondContact O-N 3.28Å; V11-A13 VanDerWaalsContact C-N 3.34Å; V11-A13 PolarHBondContact O-N 2.84Å; V11-T14 WeakPolarHBondContact CA-OG1 3.14Å; V11-T14 PolarHBondContact O-N 3.36Å; V11-T14 PolarHBondContact O-OG1 2.99Å; V11-L15 HydrophobicContact CG1-CD1 3.87Å; V11-L15 HydrophobicContact CG1-CG 4.3Å; V11-L15 WeakPolarHBondContact O-CB 3.26Å; V11-L15 VanDerWaalsContact O-CG 3.29Å; V11-L15 WeakPolarHBondContact O-CG 3.43Å; V11-L15 PolarHBondContact O-N 3.27Å
12A96Very high94.8Very high20 Ų2066.9 Ų66.917%0.16534%0.342CS..Hα-helixtrans-61-41.9177.900000111.9L4 A8 T9 T16 F62 M292L4-A12 HydrophobicContact CD1-CB 4.3Å; A8-A12 WeakPolarHBondContact O-CB 3.38Å; A8-A12 PolarHBondContact O-N 3.37Å; T9-A12 PolarHBondContact O-N 3.35Å; A12-T16 VanDerWaalsContact O-CB 3.24Å; A12-T16 WeakPolarHBondContact O-CB 3.38Å; A12-T16 PolarHBondContact O-N 3.11Å; A12-T16 PolarHBondContact O-OG1 2.98Å; A12-F62 HydrophobicContact CB-CE1 4.16Å; A12-M292 HydrophobicContact CB-CE 3.49Å; A12-M292 VanDerWaalsContact CB-CE 3.49Å
13A96.2Very high95.2Very high0 Ų063.6 Ų63.60%033%0.33CS..Hα-helixtrans-64.5-44.6176.800000112.6T9 L10 V11 T16 L17 L285 A288 M289 M292T9-A13 WeakPolarHBondContact O-CB 3.38Å; T9-A13 PolarHBondContact O-N 3.45Å; L10-A13 PolarHBondContact O-N 2.95Å; V11-A13 VanDerWaalsContact C-N 3.34Å; V11-A13 PolarHBondContact O-N 2.84Å; A13-T16 WeakPolarHBondContact O-CB 3.43Å; A13-T16 PolarHBondContact O-N 3.08Å; A13-L17 WeakPolarHBondContact O-CG 3.41Å; A13-L17 PolarHBondContact O-N 3.41Å; A13-L285 HydrophobicContact CB-CD2 4.43Å; A13-A288 HydrophobicContact CB-CB 4.26Å; A13-M289 HydrophobicContact CB-CE 4.16Å; A13-M289 HydrophobicContact CB-CG 3.88Å; A13-M292 VanDerWaalsContact CA-SD 3.53Å; A13-M292 HydrophobicContact CB-SD 4.05Å
14T96.6Very high95.3Very high56 Ų5658.4 Ų58.434%0.34431%0.307SS..Hα-helixtrans-66.5-42177.751.10000112.2L10 V11 T16 L17 L18 L285L10-T14 HydrophobicContact CD1-CG2 4.39Å; L10-T14 WeakPolarHBondContact O-CG2 3.37Å; L10-T14 PolarHBondContact O-N 3.45Å; L10-T14 PolarHBondContact O-OG1 3.42Å; V11-T14 WeakPolarHBondContact CA-OG1 3.14Å; V11-T14 PolarHBondContact O-N 3.36Å; V11-T14 PolarHBondContact O-OG1 2.99Å; T14-T16 VanDerWaalsContact C-N 3.31Å; T14-T16 PolarHBondContact O-N 3.28Å; T14-L17 WeakPolarHBondContact O-CB 3.44Å; T14-L17 PolarHBondContact O-N 3.09Å; T14-L18 WeakPolarHBondContact O-CG 3.44Å; T14-L18 PolarHBondContact O-N 2.94Å; T14-L285 HydrophobicContact CG2-CD2 3.71Å
15L97.1Very high95.4Very high104 Ų10461.3 Ų61.355%0.54532%0.319SS..Hα-helixtrans-62.7-39.2173.1-69.7177.6000111.9V11 L17 L18 L19V11-L15 HydrophobicContact CG1-CD1 3.87Å; V11-L15 HydrophobicContact CG1-CG 4.3Å; V11-L15 WeakPolarHBondContact O-CB 3.26Å; V11-L15 VanDerWaalsContact O-CG 3.29Å; V11-L15 WeakPolarHBondContact O-CG 3.43Å; V11-L15 PolarHBondContact O-N 3.27Å; L15-L17 VanDerWaalsContact C-N 3.33Å; L15-L17 PolarHBondContact O-N 3.28Å; L15-L18 PolarHBondContact O-N 3.49Å; L15-L19 WeakPolarHBondContact O-CB 3.31Å; L15-L19 PolarHBondContact O-N 2.86Å
16T96.4Very high95.5Very high7 Ų761.4 Ų61.44%0.04333%0.326CS..Hα-helixtrans-60.8-41.8174.9-62.60000111.4A12 A13 T14 L19 G20 G42 V45 M292A12-T16 VanDerWaalsContact O-CB 3.24Å; A12-T16 WeakPolarHBondContact O-CB 3.38Å; A12-T16 PolarHBondContact O-N 3.11Å; A12-T16 PolarHBondContact O-OG1 2.98Å; A13-T16 WeakPolarHBondContact O-CB 3.43Å; A13-T16 PolarHBondContact O-N 3.08Å; T14-T16 VanDerWaalsContact C-N 3.31Å; T14-T16 PolarHBondContact O-N 3.28Å; T16-L19 PolarHBondContact O-N 3.49Å; T16-G20 PolarHBondContact O-N 3.23Å; T16-G42 VanDerWaalsContact CG2-N 3.3Å; T16-V45 HydrophobicContact CG2-CB 4.47Å; T16-V45 HydrophobicContact CG2-CG2 3.89Å; T16-M292 HydrophobicContact CG2-CG 3.97Å; T16-M292 HydrophobicContact CG2-SD 4.12Å; T16-M292 PolarHBondContact OG1-SD 3.21Å; T16-M292 VanDerWaalsContact OG1-SD 3.37Å
17L96.2Very high95.5Very high24 Ų2462.5 Ų62.513%0.12633%0.332CS..Hα-helixtrans-63.9-46.1174.8-71.1174.4000112.3A13 T14 L15 L19 G20 R21 P38 L285 A288A13-L17 WeakPolarHBondContact O-CG 3.41Å; A13-L17 PolarHBondContact O-N 3.41Å; T14-L17 WeakPolarHBondContact O-CB 3.44Å; T14-L17 PolarHBondContact O-N 3.09Å; L15-L17 VanDerWaalsContact C-N 3.33Å; L15-L17 PolarHBondContact O-N 3.28Å; L17-L19 VanDerWaalsContact C-N 3.31Å; L17-L19 PolarHBondContact O-N 3.09Å; L17-G20 PolarHBondContact O-N 3.41Å; L17-R21 WeakPolarHBondContact O-CB 3.39Å; L17-R21 PolarHBondContact O-N 3.2Å; L17-P38 HydrophobicContact CD2-CB 3.7Å; L17-P38 HydrophobicContact CD2-CG 3.63Å; L17-L285 HydrophobicContact CD1-CD2 3.69Å; L17-L285 HydrophobicContact CD1-CG 4.1Å; L17-A288 HydrophobicContact CD2-CB 3.89Å; L17-A288 HydrophobicContact CG-CB 3.92Å
18L96.9Very high95.4Very high113 Ų11361 Ų6159%0.59233%0.333SS*.Hα-helixtrans-62-40.4177.2-67.3176.4000111.8T14 L15 K22T14-L18 WeakPolarHBondContact O-CG 3.44Å; T14-L18 PolarHBondContact O-N 2.94Å; L15-L18 PolarHBondContact O-N 3.49Å; L18-K22 PolarHBondContact O-N 3.39Å
19L96.6Very high95.1Very high69 Ų6964.6 Ų64.636%0.36134%0.342SS..Hα-helixtrans-62.8-48173.4-179.461.6000110.9L15 T16 L17 R21 K22 L23 L44L15-L19 WeakPolarHBondContact O-CB 3.31Å; L15-L19 PolarHBondContact O-N 2.86Å; T16-L19 PolarHBondContact O-N 3.49Å; L17-L19 VanDerWaalsContact C-N 3.31Å; L17-L19 PolarHBondContact O-N 3.09Å; L19-R21 VanDerWaalsContact C-N 3.35Å; L19-R21 PolarHBondContact O-N 3.39Å; L19-K22 WeakPolarHBondContact O-CB 3.21Å; L19-K22 PolarHBondContact O-N 2.91Å; L19-K22 VanDerWaalsContact O-N 3.17Å; L19-L23 HydrophobicContact CG-CD1 4.17Å; L19-L23 VanDerWaalsContact O-CG 3.29Å; L19-L23 WeakPolarHBondContact O-CG 2.96Å; L19-L23 PolarHBondContact O-N 2.86Å; L19-L44 HydrophobicContact CD2-CD2 3.88Å; L19-L44 HydrophobicContact CG-CD2 4.27Å
20G95.9Very high94.8Very high0 Ų066.3 Ų66.30%035%0.351CS..Hα-helixtrans-55.8-46.917600000112.5T16 L17 K22 L23 V24 E37T16-G20 PolarHBondContact O-N 3.23Å; L17-G20 PolarHBondContact O-N 3.41Å; G20-K22 PolarHBondContact O-N 3.39Å; G20-L23 WeakPolarHBondContact O-CB 3.39Å; G20-L23 PolarHBondContact O-N 3.47Å; G20-V24 WeakPolarHBondContact O-CG2 3.5Å; G20-V24 PolarHBondContact O-N 3.36Å; G20-E37 WeakPolarHBondContact CA-O 3.32Å
21R94.9Very high94.4Very high138 Ų13870 Ų7052%0.52137%0.365SS..Hα-helixtrans-57.3-49.3173.9-179.1165.9179.4-177-0.2111.8L17 L19 L23 V24 H25 E37L17-R21 WeakPolarHBondContact O-CB 3.39Å; L17-R21 PolarHBondContact O-N 3.2Å; L19-R21 VanDerWaalsContact C-N 3.35Å; L19-R21 PolarHBondContact O-N 3.39Å; R21-L23 VanDerWaalsContact C-N 3.31Å; R21-L23 PolarHBondContact O-N 3.16Å; R21-V24 PolarHBondContact O-N 2.91Å; R21-H25 WeakPolarHBondContact O-CB 3.28Å; R21-H25 PolarHBondContact O-CD2 2.9Å; R21-H25 VanDerWaalsContact O-CD2 3.25Å; R21-H25 PolarHBondContact O-N 2.85Å; R21-E37 HydrophobicContact CB-CG 4.23Å; R21-E37 VanDerWaalsContact CG-OE1 3.29Å; R21-E37 WeakPolarHBondContact CG-OE1 3.41Å
22K96.1Very high93.8Very high149 Ų14973.4 Ų73.465%0.64837%0.373SS*.Hα-helixtrans-58.8-42.9177.2-173.6178.5179.4-179.20111.6L18 L19 G20 S26L18-K22 PolarHBondContact O-N 3.39Å; L19-K22 WeakPolarHBondContact O-CB 3.21Å; L19-K22 PolarHBondContact O-N 2.91Å; L19-K22 VanDerWaalsContact O-N 3.17Å; G20-K22 PolarHBondContact O-N 3.39Å; K22-S26 VanDerWaalsContact O-CB 3.28Å; K22-S26 WeakPolarHBondContact O-CB 3.41Å; K22-S26 PolarHBondContact O-N 3.49Å; K22-S26 PolarHBondContact O-OG 3.22Å
23L95.3Very high93.3Very high45 Ų4574.3 Ų74.324%0.23637%0.373CS..Hα-helixtrans-63.4-50.4177.9-69.2167.1000112L19 G20 R21 H25 S26 V27 L30 L44L19-L23 HydrophobicContact CG-CD1 4.17Å; L19-L23 VanDerWaalsContact O-CG 3.29Å; L19-L23 WeakPolarHBondContact O-CG 2.96Å; L19-L23 PolarHBondContact O-N 2.86Å; G20-L23 WeakPolarHBondContact O-CB 3.39Å; G20-L23 PolarHBondContact O-N 3.47Å; R21-L23 VanDerWaalsContact C-N 3.31Å; R21-L23 PolarHBondContact O-N 3.16Å; L23-H25 VanDerWaalsContact C-N 3.28Å; L23-H25 PolarHBondContact O-N 2.81Å; L23-S26 PolarHBondContact O-N 2.73Å; L23-S26 VanDerWaalsContact O-N 3.1Å; L23-V27 WeakPolarHBondContact O-CB 3.47Å; L23-V27 WeakPolarHBondContact O-CG2 3.22Å; L23-V27 PolarHBondContact O-N 3.19Å; L23-L30 HydrophobicContact CB-CD1 4.21Å; L23-L44 HydrophobicContact CD1-CB 4.2Å; L23-L44 HydrophobicContact CD1-CD2 3.47Å; L23-L44 VanDerWaalsContact CD1-CD2 3.47Å; L23-L44 HydrophobicContact CD1-CG 4.43Å; L23-L44 HydrophobicContact CD2-CD2 4.27Å; L23-L44 HydrophobicContact CG-CD2 4.41Å
24V92.8Very high92.6Very high17 Ų1777.6 Ų77.610%0.10339%0.392CS..Hα-helixtrans-59.8-41-179.7173.40000110.7G20 R21 L30 K31 I35 A40G20-V24 WeakPolarHBondContact O-CG2 3.5Å; G20-V24 PolarHBondContact O-N 3.36Å; R21-V24 PolarHBondContact O-N 2.91Å; V24-L30 HydrophobicContact CB-CB 4.42Å; V24-L30 HydrophobicContact CG1-CB 4.48Å; V24-L30 HydrophobicContact CG2-CB 4.21Å; V24-L30 HydrophobicContact CG2-CD1 4.36Å; V24-K31 WeakPolarHBondContact O-CB 3.37Å; V24-I35 WeakPolarHBondContact CG2-O 3.48Å; V24-A40 HydrophobicContact CG2-CB 3.68Å
25H92.9Very high92.2Very high114 Ų11475.4 Ų75.453%0.52838%0.379SS..Hα-helixtrans-70.9-29176.7-83.6-77000114.2R21 L23R21-H25 WeakPolarHBondContact O-CB 3.28Å; R21-H25 PolarHBondContact O-CD2 2.9Å; R21-H25 VanDerWaalsContact O-CD2 3.25Å; R21-H25 PolarHBondContact O-N 2.85Å; L23-H25 VanDerWaalsContact C-N 3.28Å; L23-H25 PolarHBondContact O-N 2.81Å
26S95Very high91.8Very high90 Ų9072 Ų7263%0.62936%0.363SS*.Hα-helixtrans-88.1-31.7-177.1-54.90000112.9K22 L23K22-S26 VanDerWaalsContact O-CB 3.28Å; K22-S26 WeakPolarHBondContact O-CB 3.41Å; K22-S26 PolarHBondContact O-N 3.49Å; K22-S26 PolarHBondContact O-OG 3.22Å; L23-S26 PolarHBondContact O-N 2.73Å; L23-S26 VanDerWaalsContact O-N 3.1Å
27V94.3Very high91.6Very high64 Ų6474.7 Ų74.739%0.38838%0.375SS..  trans-100.9110.8-175.9-177.90000109.8L23 F29 L30 K31L23-V27 WeakPolarHBondContact O-CB 3.47Å; L23-V27 WeakPolarHBondContact O-CG2 3.22Å; L23-V27 PolarHBondContact O-N 3.19Å; V27-F29 HydrophobicContact CG1-CB 4.23Å; V27-F29 PolarHBondContact O-N 3.17Å; V27-L30 HydrophobicContact CB-CB 4.35Å; V27-L30 HydrophobicContact CB-CD1 4Å; V27-L30 HydrophobicContact CB-CG 4.02Å; V27-L30 HydrophobicContact CG1-CD1 4.38Å; V27-L30 HydrophobicContact CG1-CG 3.98Å; V27-L30 HydrophobicContact CG2-CD1 4.4Å; V27-L30 PolarHBondContact O-N 3.22Å; V27-L30 VanDerWaalsContact O-N 3.11Å; V27-K31 PolarHBondContact O-N 3.01Å
28S91.3Very high91.4Very high99 Ų9973.9 Ų73.969%0.69237%0.371SS*.Hα-helixtrans-56.9-35-176.461.60000113.6K31 K32S28-K31 PolarHBondContact O-N 3.41Å; S28-K32 WeakPolarHBondContact O-CB 3.39Å; S28-K32 PolarHBondContact O-N 3.4Å
29F90Very high91.2Very high108 Ų10868.8 Ų68.847%0.47435%0.345SS..Hα-helixtrans-61.5-49.5176.2-179.9-90.9000112V27 K31 K32 Y33V27-F29 HydrophobicContact CG1-CB 4.23Å; V27-F29 PolarHBondContact O-N 3.17Å; F29-K31 VanDerWaalsContact C-N 3.32Å; F29-K31 PolarHBondContact O-N 2.94Å; F29-K32 PolarHBondContact O-N 3.48Å; F29-Y33 HydrophobicContact CD1-CD2 4.26Å; F29-Y33 AromaticContact CD2-CD2 3.61Å; F29-Y33 HydrophobicContact CD2-CD2 3.61Å; F29-Y33 AromaticContact CD2-CE2 3.45Å; F29-Y33 HydrophobicContact CD2-CE2 3.45Å; F29-Y33 VanDerWaalsContact CD2-CE2 3.45Å; F29-Y33 HydrophobicContact CE1-CD2 4.09Å; F29-Y33 AromaticContact CE2-CD2 3.43Å; F29-Y33 HydrophobicContact CE2-CD2 3.43Å; F29-Y33 VanDerWaalsContact CE2-CD2 3.43Å; F29-Y33 AromaticContact CE2-CE2 3.22Å; F29-Y33 HydrophobicContact CE2-CE2 3.22Å; F29-Y33 HydrophobicContact CG-CD2 4.03Å; F29-Y33 HydrophobicContact CG-CE2 4.3Å; F29-Y33 AromaticContact CZ-CD2 3.68Å; F29-Y33 HydrophobicContact CZ-CD2 3.68Å; F29-Y33 AromaticContact CZ-CE2 3.91Å; F29-Y33 HydrophobicContact CZ-CE2 3.91Å; F29-Y33 VanDerWaalsContact O-CD2 3.3Å; F29-Y33 WeakPolarHBondContact O-CD2 3.4Å; F29-Y33 PolarHBondContact O-N 3.29Å
30L88.5Confident91Very high36 Ų3666 Ų6619%0.18833%0.332CS..Hα-helixtrans-62.6-41.8-179.7-63-177.8000111.3L23 V24 V27 T34 I35 A40L23-L30 HydrophobicContact CB-CD1 4.21Å; V24-L30 HydrophobicContact CB-CB 4.42Å; V24-L30 HydrophobicContact CG1-CB 4.48Å; V24-L30 HydrophobicContact CG2-CB 4.21Å; V24-L30 HydrophobicContact CG2-CD1 4.36Å; V27-L30 HydrophobicContact CB-CB 4.35Å; V27-L30 HydrophobicContact CB-CD1 4Å; V27-L30 HydrophobicContact CB-CG 4.02Å; V27-L30 HydrophobicContact CG1-CD1 4.38Å; V27-L30 HydrophobicContact CG1-CG 3.98Å; V27-L30 HydrophobicContact CG2-CD1 4.4Å; V27-L30 PolarHBondContact O-N 3.22Å; V27-L30 VanDerWaalsContact O-N 3.11Å; L30-T34 PolarHBondContact O-N 2.94Å; L30-I35 HydrophobicContact CB-CB 4.4Å; L30-I35 HydrophobicContact CD2-CB 4.08Å; L30-I35 HydrophobicContact CD2-CG1 3.92Å; L30-I35 HydrophobicContact CD2-CG2 4.22Å; L30-I35 PolarHBondContact O-N 3.23Å; L30-A40 HydrophobicContact CD1-CB 4.14Å
31K87.2Confident91Very high134 Ų13466 Ų6658%0.58333%0.332SS*.Hα-helixtrans-63.7-46.4174.7-169.3179178.3-175.80112.4V24 V27 S28 F29 Y33 T34V24-K31 WeakPolarHBondContact O-CB 3.37Å; V27-K31 PolarHBondContact O-N 3.01Å; S28-K31 PolarHBondContact O-N 3.41Å; F29-K31 VanDerWaalsContact C-N 3.32Å; F29-K31 PolarHBondContact O-N 2.94Å; K31-Y33 VanDerWaalsContact C-N 3.32Å; K31-Y33 PolarHBondContact O-N 3.07Å; K31-T34 PolarHBondContact O-N 3.38Å
32K84.5Confident90.9Very high154 Ų15459.5 Ų59.567%0.6731%0.307SS*.Hα-helixtrans-63.2-38.7-176178177.5178.9-177.90112.2S28 F29S28-K32 WeakPolarHBondContact O-CB 3.39Å; S28-K32 PolarHBondContact O-N 3.4Å; F29-K32 PolarHBondContact O-N 3.48Å
33Y84Confident90.7Very high40 Ų4055.8 Ų55.816%0.15729%0.294CS..THydrogen-bonded Turntrans-98.520.3178.4-63.9-73.2000112.4F29 K31 I35 L169 V170 L174F29-Y33 HydrophobicContact CD1-CD2 4.26Å; F29-Y33 AromaticContact CD2-CD2 3.61Å; F29-Y33 HydrophobicContact CD2-CD2 3.61Å; F29-Y33 AromaticContact CD2-CE2 3.45Å; F29-Y33 HydrophobicContact CD2-CE2 3.45Å; F29-Y33 VanDerWaalsContact CD2-CE2 3.45Å; F29-Y33 HydrophobicContact CE1-CD2 4.09Å; F29-Y33 AromaticContact CE2-CD2 3.43Å; F29-Y33 HydrophobicContact CE2-CD2 3.43Å; F29-Y33 VanDerWaalsContact CE2-CD2 3.43Å; F29-Y33 AromaticContact CE2-CE2 3.22Å; F29-Y33 HydrophobicContact CE2-CE2 3.22Å; F29-Y33 HydrophobicContact CG-CD2 4.03Å; F29-Y33 HydrophobicContact CG-CE2 4.3Å; F29-Y33 AromaticContact CZ-CD2 3.68Å; F29-Y33 HydrophobicContact CZ-CD2 3.68Å; F29-Y33 AromaticContact CZ-CE2 3.91Å; F29-Y33 HydrophobicContact CZ-CE2 3.91Å; F29-Y33 VanDerWaalsContact O-CD2 3.3Å; F29-Y33 WeakPolarHBondContact O-CD2 3.4Å; F29-Y33 PolarHBondContact O-N 3.29Å; K31-Y33 VanDerWaalsContact C-N 3.32Å; K31-Y33 PolarHBondContact O-N 3.07Å; Y33-I35 PolarHBondContact O-N 3.22Å; Y33-L169 WeakPolarHBondContact O-CD2 3.33Å; Y33-V170 HydrophobicContact CD1-CB 4.48Å; Y33-V170 HydrophobicContact CD1-CG1 3.88Å; Y33-V170 HydrophobicContact CE1-CG1 4.18Å; Y33-V170 HydrophobicContact CG-CG1 4.21Å; Y33-V170 HydrophobicContact CG-CG2 4.4Å; Y33-L174 HydrophobicContact CE1-CD1 4.46Å; Y33-L174 HydrophobicContact CE1-CD2 3.61Å; Y33-L174 HydrophobicContact CE1-CG 3.77Å; Y33-L174 WeakPolarHBondContact OH-CD2 3.49Å
34T83Confident90.6Very high68 Ų6857.1 Ų57.142%0.41730%0.301SS..THydrogen-bonded Turntrans46.539.4172.9-40.70000113.3L30 K31 P36 P351L30-T34 PolarHBondContact O-N 2.94Å; K31-T34 PolarHBondContact O-N 3.38Å; T34-P36 WeakPolarHBondContact O-CD 3.24Å; T34-P351 HydrophobicContact CG2-CB 4.41Å
35I87.6Confident90.7Very high11 Ų1157.7 Ų57.76%0.05631%0.305CS..  trans-65.5125.4-179.7-58.6-60.6000108V24 L30 Y33 E37 V39 A40 T166 V170V24-I35 WeakPolarHBondContact CG2-O 3.48Å; L30-I35 HydrophobicContact CB-CB 4.4Å; L30-I35 HydrophobicContact CD2-CB 4.08Å; L30-I35 HydrophobicContact CD2-CG1 3.92Å; L30-I35 HydrophobicContact CD2-CG2 4.22Å; L30-I35 PolarHBondContact O-N 3.23Å; Y33-I35 PolarHBondContact O-N 3.22Å; I35-E37 PolarHBondContact O-N 3.48Å; I35-V39 HydrophobicContact CG2-CB 4.33Å; I35-V39 HydrophobicContact CG2-CG1 4.23Å; I35-A40 HydrophobicContact CG2-CB 4.44Å; I35-T166 HydrophobicContact CD1-CG2 3.94Å; I35-V170 HydrophobicContact CD1-CG2 3.69Å
36P88.5Confident90.6Very high33 Ų3352.4 Ų52.421%0.21428%0.281CS..  trans-60139.5-176.3-24.233.5000112T34 P38 V39 A40 L169T34-P36 WeakPolarHBondContact O-CD 3.24Å; P36-P38 VanDerWaalsContact C-N 3.33Å; P36-V39 HydrophobicContact CB-CB 4.29Å; P36-V39 HydrophobicContact CB-CG2 3.9Å; P36-V39 HydrophobicContact CG-CG2 4.04Å; P36-V39 WeakPolarHBondContact O-CA 3.45Å; P36-V39 WeakPolarHBondContact O-CB 3.28Å; P36-V39 PolarHBondContact O-N 3.02Å; P36-A40 PolarHBondContact O-N 3.35Å; P36-L169 HydrophobicContact CG-CD1 4.35Å
37E92.6Very high90.5Very high63 Ų6352 Ų5229%0.29427%0.271SS..Hα-helixtrans-52-42.7176.5-52.6179.6163.300113.4G20 R21 I35 V39 A40 G41G20-E37 WeakPolarHBondContact CA-O 3.32Å; R21-E37 HydrophobicContact CB-CG 4.23Å; R21-E37 VanDerWaalsContact CG-OE1 3.29Å; R21-E37 WeakPolarHBondContact CG-OE1 3.41Å; I35-E37 PolarHBondContact O-N 3.48Å; E37-V39 VanDerWaalsContact C-N 3.31Å; E37-V39 PolarHBondContact O-N 3.13Å; E37-A40 PolarHBondContact O-N 2.91Å; E37-G41 PolarHBondContact O-N 3.37Å
38P92.7Very high90.4Very high7 Ų751.7 Ų51.75%0.04528%0.275CS..Hα-helixtrans-61.4-39.8176.5-16.628.2000112.5L17 P36 G42 L287 L291L17-P38 HydrophobicContact CD2-CB 3.7Å; L17-P38 HydrophobicContact CD2-CG 3.63Å; P36-P38 VanDerWaalsContact C-N 3.33Å; P38-G42 WeakPolarHBondContact O-CA 3.43Å; P38-G42 PolarHBondContact O-N 3.46Å; P38-L287 HydrophobicContact CB-CB 3.64Å; P38-L287 HydrophobicContact CB-CD1 4.45Å; P38-L287 HydrophobicContact CG-CB 4.28Å; P38-L287 HydrophobicContact CG-CD1 4.43Å; P38-L291 VanDerWaalsContact C-CD1 3.42Å; P38-L291 HydrophobicContact CB-CD1 4.37Å; P38-L291 WeakPolarHBondContact O-CD1 3.31Å
39V90.8Very high90.5Very high5 Ų548.9 Ų48.93%0.0325%0.252CS..Hα-helixtrans-64.3-51.3178.9179.80000110.7I35 P36 E37 L43 H138 T166 L291I35-V39 HydrophobicContact CG2-CB 4.33Å; I35-V39 HydrophobicContact CG2-CG1 4.23Å; P36-V39 HydrophobicContact CB-CB 4.29Å; P36-V39 HydrophobicContact CB-CG2 3.9Å; P36-V39 HydrophobicContact CG-CG2 4.04Å; P36-V39 WeakPolarHBondContact O-CA 3.45Å; P36-V39 WeakPolarHBondContact O-CB 3.28Å; P36-V39 PolarHBondContact O-N 3.02Å; E37-V39 VanDerWaalsContact C-N 3.31Å; E37-V39 PolarHBondContact O-N 3.13Å; V39-L43 WeakPolarHBondContact O-CB 3.34Å; V39-L43 PolarHBondContact O-N 2.95Å; V39-H138 VanDerWaalsContact CG2-CD2 3.48Å; V39-H138 WeakPolarHBondContact CG2-CD2 3.16Å; V39-T166 HydrophobicContact CG1-CG2 4.07Å; V39-T166 WeakPolarHBondContact CG1-OG1 3.34Å; V39-L291 HydrophobicContact CB-CD1 4.26Å; V39-L291 HydrophobicContact CG2-CD1 4.04Å
40A93.5Very high90.5Very high12 Ų1246.2 Ų46.210%0.09924%0.243CC..Hα-helixtrans-61.7-47.718000000112.2V24 L30 I35 P36 E37 L44V24-A40 HydrophobicContact CG2-CB 3.68Å; L30-A40 HydrophobicContact CD1-CB 4.14Å; I35-A40 HydrophobicContact CG2-CB 4.44Å; P36-A40 PolarHBondContact O-N 3.35Å; E37-A40 PolarHBondContact O-N 2.91Å; A40-L44 WeakPolarHBondContact O-CB 3.44Å; A40-L44 PolarHBondContact O-N 3.09Å
41G94.6Very high90.6Very high0 Ų049 Ų490%026%0.261CS..Hα-helixtrans-67.1-50.9179.300000112.3E37 L43 L44 V45E37-G41 PolarHBondContact O-N 3.37Å; G41-L43 PolarHBondContact O-N 2.85Å; G41-L44 PolarHBondContact O-N 3.46Å; G41-V45 WeakPolarHBondContact O-CG2 3.23Å; G41-V45 PolarHBondContact O-N 3.05Å
42G93.6Very high90.9Very high0 Ų044.8 Ų44.80%025%0.245CC..Hα-helixtrans-63.6-41.2-176.300000112.8T16 P38 V45 A46T16-G42 VanDerWaalsContact CG2-N 3.3Å; P38-G42 WeakPolarHBondContact O-CA 3.43Å; P38-G42 PolarHBondContact O-N 3.46Å; G42-V45 PolarHBondContact O-N 2.93Å; G42-A46 WeakPolarHBondContact O-CB 3.47Å; G42-A46 PolarHBondContact O-N 2.67Å
43L91.6Very high91.1Very high71 Ų7141 Ų4137%0.37223%0.228SC..Hα-helixtrans-64.9-39.4175.1-17761.4000111.9V39 G41 V45 A46 L47 L296V39-L43 WeakPolarHBondContact O-CB 3.34Å; V39-L43 PolarHBondContact O-N 2.95Å; G41-L43 PolarHBondContact O-N 2.85Å; L43-V45 VanDerWaalsContact C-N 3.35Å; L43-A46 PolarHBondContact O-N 2.94Å; L43-L47 HydrophobicContact CG-CD1 4.23Å; L43-L47 WeakPolarHBondContact O-CB 3.3Å; L43-L47 VanDerWaalsContact O-CG 3.31Å; L43-L47 WeakPolarHBondContact O-CG 3.28Å; L43-L47 PolarHBondContact O-N 3.19Å; L43-L296 HydrophobicContact CD1-CD1 4.19Å; L43-L296 HydrophobicContact CD1-CD2 3.58Å
44L93.4Very high91.4Very high74 Ų7448.2 Ų48.239%0.38726%0.26SS..Hα-helixtrans-63.3-42.9175.7-17667.4000111.2L19 L23 A40 G41 L47 A48L19-L44 HydrophobicContact CD2-CD2 3.88Å; L19-L44 HydrophobicContact CG-CD2 4.27Å; L23-L44 HydrophobicContact CD1-CB 4.2Å; L23-L44 HydrophobicContact CD1-CD2 3.47Å; L23-L44 VanDerWaalsContact CD1-CD2 3.47Å; L23-L44 HydrophobicContact CD1-CG 4.43Å; L23-L44 HydrophobicContact CD2-CD2 4.27Å; L23-L44 HydrophobicContact CG-CD2 4.41Å; A40-L44 WeakPolarHBondContact O-CB 3.44Å; A40-L44 PolarHBondContact O-N 3.09Å; G41-L44 PolarHBondContact O-N 3.46Å; L44-L47 PolarHBondContact O-N 3.11Å; L44-A48 WeakPolarHBondContact O-CB 3.47Å; L44-A48 PolarHBondContact O-N 3.44Å
45V94.2Very high91.9Very high29 Ų2948.9 Ų48.918%0.17627%0.268CS..Hα-helixtrans-64.9-44.3176.1173.70000111T16 G41 G42 L43 L47 A48 L49 M292T16-V45 HydrophobicContact CG2-CB 4.47Å; T16-V45 HydrophobicContact CG2-CG2 3.89Å; G41-V45 WeakPolarHBondContact O-CG2 3.23Å; G41-V45 PolarHBondContact O-N 3.05Å; G42-V45 PolarHBondContact O-N 2.93Å; L43-V45 VanDerWaalsContact C-N 3.35Å; V45-L47 VanDerWaalsContact C-N 3.32Å; V45-L47 PolarHBondContact O-N 3.17Å; V45-A48 PolarHBondContact O-N 2.85Å; V45-A48 VanDerWaalsContact O-N 3.16Å; V45-L49 HydrophobicContact CG1-CD1 3.98Å; V45-L49 HydrophobicContact CG1-CG 4.26Å; V45-L49 WeakPolarHBondContact O-CB 3.44Å; V45-L49 VanDerWaalsContact O-CG 3.32Å; V45-L49 WeakPolarHBondContact O-CG 3.29Å; V45-L49 PolarHBondContact O-N 3.36Å; V45-M292 HydrophobicContact CB-CG 4.28Å; V45-M292 HydrophobicContact CG1-CB 4.44Å; V45-M292 HydrophobicContact CG1-CG 4.01Å
46A92.1Very high92Very high3 Ų353.6 Ų53.63%0.02529%0.291CS..Hα-helixtrans-59.7-41.3175.800000112.2G42 L43 L49 L50 L294 L296G42-A46 WeakPolarHBondContact O-CB 3.47Å; G42-A46 PolarHBondContact O-N 2.67Å; L43-A46 PolarHBondContact O-N 2.94Å; A46-L49 PolarHBondContact O-N 3.26Å; A46-L50 WeakPolarHBondContact O-CB 3.48Å; A46-L50 PolarHBondContact O-N 3.42Å; A46-L294 HydrophobicContact CB-CB 4.36Å; A46-L296 HydrophobicContact CB-CD1 3.89Å; A46-L296 HydrophobicContact CB-CG 4.16Å
47L92.4Very high92Very high81 Ų8154.9 Ų54.942%0.42431%0.31SS..Hα-helixtrans-63.8-43.9173.7-76.6167.8000111.8L43 L44 V45 L50 V51 L296L43-L47 HydrophobicContact CG-CD1 4.23Å; L43-L47 WeakPolarHBondContact O-CB 3.3Å; L43-L47 VanDerWaalsContact O-CG 3.31Å; L43-L47 WeakPolarHBondContact O-CG 3.28Å; L43-L47 PolarHBondContact O-N 3.19Å; L44-L47 PolarHBondContact O-N 3.11Å; V45-L47 VanDerWaalsContact C-N 3.32Å; V45-L47 PolarHBondContact O-N 3.17Å; L47-L50 WeakPolarHBondContact O-CB 3.14Å; L47-L50 PolarHBondContact O-N 3.06Å; L47-V51 WeakPolarHBondContact O-CG2 3.16Å; L47-V51 PolarHBondContact O-N 3.5Å; L47-L296 HydrophobicContact CB-CD1 4.28Å; L47-L296 HydrophobicContact CD2-CD1 3.5Å; L47-L296 VanDerWaalsContact CD2-CD1 3.5Å; L47-L296 HydrophobicContact CG-CD1 3.6Å
48A93.2Very high91.8Very high58 Ų5858 Ų5848%0.47932%0.319SS..Hα-helixtrans-62.7-42.8177.500000111.7L44 V45 V51 L52L44-A48 WeakPolarHBondContact O-CB 3.47Å; L44-A48 PolarHBondContact O-N 3.44Å; V45-A48 PolarHBondContact O-N 2.85Å; V45-A48 VanDerWaalsContact O-N 3.16Å; A48-V51 PolarHBondContact O-N 3.27Å; A48-L52 WeakPolarHBondContact O-CB 3.49Å; A48-L52 PolarHBondContact O-N 3.1Å
49L91.9Very high91.5Very high39 Ų3961.1 Ų61.120%0.20433%0.333CS..Hα-helixtrans-65.9-37175.4-68.7175.9000112.1V45 A46 L52 K53 V60 F62V45-L49 HydrophobicContact CG1-CD1 3.98Å; V45-L49 HydrophobicContact CG1-CG 4.26Å; V45-L49 WeakPolarHBondContact O-CB 3.44Å; V45-L49 VanDerWaalsContact O-CG 3.32Å; V45-L49 WeakPolarHBondContact O-CG 3.29Å; V45-L49 PolarHBondContact O-N 3.36Å; A46-L49 PolarHBondContact O-N 3.26Å; L49-L52 HydrophobicContact CD2-CD2 4.43Å; L49-L52 PolarHBondContact O-N 2.99Å; L49-K53 WeakPolarHBondContact O-CB 3.4Å; L49-K53 PolarHBondContact O-N 3.32Å; L49-V60 HydrophobicContact CD2-CB 3.98Å; L49-V60 HydrophobicContact CD2-CG2 3.79Å; L49-F62 HydrophobicContact CD1-CE2 3.69Å; L49-F62 HydrophobicContact CD1-CZ 3.76Å
50L90.3Very high91.4Very high52 Ų5262.5 Ų62.527%0.27234%0.342SS..Hα-helixtrans-61.8-46173.1178.262.5000111.5A46 L47 L52 K53 K54 L296 W297A46-L50 WeakPolarHBondContact O-CB 3.48Å; A46-L50 PolarHBondContact O-N 3.42Å; L47-L50 WeakPolarHBondContact O-CB 3.14Å; L47-L50 PolarHBondContact O-N 3.06Å; L50-L52 VanDerWaalsContact C-N 3.34Å; L50-K53 PolarHBondContact O-N 2.84Å; L50-K54 WeakPolarHBondContact O-CB 3.46Å; L50-K54 PolarHBondContact O-N 3.47Å; L50-L296 HydrophobicContact CD2-CB 4.13Å; L50-L296 HydrophobicContact CD2-CD1 4.46Å; L50-W297 HydrophobicContact CD1-CE3 3.7Å; L50-W297 HydrophobicContact CD1-CZ3 4.21Å
51V91.9Very high91.2Very high96 Ų9664.3 Ų64.358%0.58235%0.349SS*.Hα-helixtrans-62.5-43.1176.4171.90000110.6L47 A48 K54 S55L47-V51 WeakPolarHBondContact O-CG2 3.16Å; L47-V51 PolarHBondContact O-N 3.5Å; A48-V51 PolarHBondContact O-N 3.27Å; V51-K54 PolarHBondContact O-N 2.85Å; V51-S55 VanDerWaalsContact O-CB 3.3Å; V51-S55 WeakPolarHBondContact O-CB 3.28Å; V51-S55 PolarHBondContact O-N 2.82Å; V51-S55 PolarHBondContact O-OG 3.32Å
52L91.9Very high91.1Very high44 Ų4465.6 Ų65.623%0.2336%0.355CS..Hα-helixtrans-62.9-44.7178-173.967000111.9A48 L49 L50 K54 S55 M56 G57 W58A48-L52 WeakPolarHBondContact O-CB 3.49Å; A48-L52 PolarHBondContact O-N 3.1Å; L49-L52 HydrophobicContact CD2-CD2 4.43Å; L49-L52 PolarHBondContact O-N 2.99Å; L50-L52 VanDerWaalsContact C-N 3.34Å; L52-K54 PolarHBondContact O-N 2.86Å; L52-S55 PolarHBondContact O-N 2.97Å; L52-S55 PolarHBondContact O-OG 3.39Å; L52-M56 HydrophobicContact CD1-CB 4.35Å; L52-M56 HydrophobicContact CD1-CE 4.41Å; L52-M56 HydrophobicContact CD1-CG 4.19Å; L52-M56 HydrophobicContact CD1-SD 3.56Å; L52-M56 VanDerWaalsContact CD1-SD 3.56Å; L52-M56 PolarHBondContact O-N 2.89Å; L52-G57 PolarHBondContact O-N 2.85Å; L52-W58 HydrophobicContact CD1-CE3 3.88Å; L52-W58 HydrophobicContact CD1-CZ3 4.46Å; L52-W58 HydrophobicContact CD2-CB 4.23Å; L52-W58 HydrophobicContact CD2-CE3 4.23Å; L52-W58 HydrophobicContact CG-CB 4.06Å; L52-W58 HydrophobicContact CG-CE3 4.33Å
53K89.6Confident91Very high76 Ų7667.3 Ų67.333%0.3336%0.364SS..Hα-helixtrans-61.4-44.1175.2-176.5171.3-179.2167.50111.5L49 L50 G57 W58 E59L49-K53 WeakPolarHBondContact O-CB 3.4Å; L49-K53 PolarHBondContact O-N 3.32Å; L50-K53 PolarHBondContact O-N 2.84Å; K53-G57 WeakPolarHBondContact O-CA 3.45Å; K53-G57 PolarHBondContact O-N 3.21Å; K53-W58 VanDerWaalsContact CA-O 3.31Å; K53-W58 WeakPolarHBondContact CA-O 3.39Å; K53-E59 IonicContact NZ-OE1 2.68Å; K53-E59 PolarHBondContact NZ-OE1 2.95Å
54K89.9Confident90.9Very high190 Ų19066.6 Ų66.683%0.82636%0.36SS*.Hα-helixtrans-71.9-34.2-178.9-170.5176.5179.9-179.50113.4L50 V51 L52L50-K54 WeakPolarHBondContact O-CB 3.46Å; L50-K54 PolarHBondContact O-N 3.47Å; V51-K54 PolarHBondContact O-N 2.85Å; L52-K54 PolarHBondContact O-N 2.86Å
55S92.8Very high90.9Very high82 Ų8266.8 Ų66.857%0.57337%0.367SS*.Hα-helixtrans-89.3-41-176.157.10000113.7V51 L52V51-S55 VanDerWaalsContact O-CB 3.3Å; V51-S55 WeakPolarHBondContact O-CB 3.28Å; V51-S55 PolarHBondContact O-N 2.82Å; V51-S55 PolarHBondContact O-OG 3.32Å; L52-S55 PolarHBondContact O-N 2.97Å; L52-S55 PolarHBondContact O-OG 3.39Å
56M91.4Very high90.9Very high111 Ų11168 Ų6855%0.54737%0.372SS..Hα-helixtrans-115.7-7.3-173.3-59.1-175-175.500113.6L52 W58L52-M56 HydrophobicContact CD1-CB 4.35Å; L52-M56 HydrophobicContact CD1-CE 4.41Å; L52-M56 HydrophobicContact CD1-CG 4.19Å; L52-M56 HydrophobicContact CD1-SD 3.56Å; L52-M56 VanDerWaalsContact CD1-SD 3.56Å; L52-M56 PolarHBondContact O-N 2.89Å; M56-W58 HydrophobicContact CB-CD2 4.2Å; M56-W58 HydrophobicContact CB-CG 4.09Å; M56-W58 PolarHBondContact O-N 3.09Å; M56-W58 HydrophobicContact SD-CD2 4.35Å; M56-W58 HydrophobicContact SD-CE3 4.18Å; M56-W58 HydrophobicContact SD-CH2 4.2Å; M56-W58 HydrophobicContact SD-CZ2 4.38Å; M56-W58 HydrophobicContact SD-CZ3 4.09Å
57G87.4Confident90.9Very high59 Ų5969.7 Ų69.761%0.60838%0.378SS*.  trans70.410.5-174.400000113.9L52 K53L52-G57 PolarHBondContact O-N 2.85Å; K53-G57 WeakPolarHBondContact O-CA 3.45Å; K53-G57 PolarHBondContact O-N 3.21Å
58W88.3Confident90.9Very high128 Ų12868.5 Ų68.549%0.48537%0.372SS..  trans-82.3127.9-179.8-65.6-1000110.8F2 L52 K53 M56F2-W58 HydrophobicContact CE2-CD2 4.08Å; F2-W58 HydrophobicContact CE2-CE3 4.22Å; F2-W58 HydrophobicContact CE2-CG 4.22Å; L52-W58 HydrophobicContact CD1-CE3 3.88Å; L52-W58 HydrophobicContact CD1-CZ3 4.46Å; L52-W58 HydrophobicContact CD2-CB 4.23Å; L52-W58 HydrophobicContact CD2-CE3 4.23Å; L52-W58 HydrophobicContact CG-CB 4.06Å; L52-W58 HydrophobicContact CG-CE3 4.33Å; K53-W58 VanDerWaalsContact CA-O 3.31Å; K53-W58 WeakPolarHBondContact CA-O 3.39Å; M56-W58 HydrophobicContact CB-CD2 4.2Å; M56-W58 HydrophobicContact CB-CG 4.09Å; M56-W58 PolarHBondContact O-N 3.09Å; M56-W58 HydrophobicContact SD-CD2 4.35Å; M56-W58 HydrophobicContact SD-CE3 4.18Å; M56-W58 HydrophobicContact SD-CH2 4.2Å; M56-W58 HydrophobicContact SD-CZ2 4.38Å; M56-W58 HydrophobicContact SD-CZ3 4.09Å
59E86.4Confident91Very high74 Ų7468.6 Ų68.635%0.34637%0.368SS..  trans-114.3130.6175.3-174.4160.2-130.100109.4M1 F2 K53M1-E59 CarbonylContact C-O 3.59Å; M1-E59 WeakPolarHBondContact CA-O 3.47Å; F2-E59 PolarHBondContact N-O 3.25Å; K53-E59 IonicContact NZ-OE1 2.68Å; K53-E59 PolarHBondContact NZ-OE1 2.95Å
60V89.5Confident91.2Very high34 Ų3468 Ų6821%0.20637%0.365CS..EExtended strand (participates in β ladder)trans-110.9123177.2-177.70000107.6F2 L4 L49 F62F2-V60 HydrophobicContact CB-CG2 4.49Å; F2-V60 CarbonylContact O-C 3.47Å; F2-V60 WeakPolarHBondContact O-CA 3.09Å; L4-V60 HydrophobicContact CD1-CG1 4.18Å; L4-V60 HydrophobicContact CG-CG1 4.18Å; L49-V60 HydrophobicContact CD2-CB 3.98Å; L49-V60 HydrophobicContact CD2-CG2 3.79Å; V60-F62 HydrophobicContact CG1-CE1 4.07Å; V60-F62 HydrophobicContact CG1-CE2 4.26Å; V60-F62 HydrophobicContact CG1-CZ 3.86Å
61N89.5Confident91.4Very high49 Ų4965.9 Ų65.926%0.26235%0.354SS..EExtended strand (participates in β ladder)trans-108.6143.5173.8-67.3-57000109.6M1 F2 L4M1-N61 WeakPolarHBondContact CE-ND2 3.47Å; M1-N61 WeakPolarHBondContact CG-ND2 3.29Å; F2-N61 PolarHBondContact O-N 3.46Å; L4-N61 PolarHBondContact N-O 3.34Å
62F91.1Very high91.7Very high27 Ų2762.6 Ų62.612%0.11833%0.332CS..EExtended strand (participates in β ladder)trans-114.8138.7-177.4-58.8-82.5000109.2L4 T9 A12 L49 V60 M64 M292L4-F62 HydrophobicContact CB-CD1 4.35Å; L4-F62 HydrophobicContact CD1-CD1 3.86Å; L4-F62 HydrophobicContact CD1-CE1 3.65Å; L4-F62 HydrophobicContact CG-CD1 4.49Å; T9-F62 HydrophobicContact CG2-CB 3.82Å; T9-F62 HydrophobicContact CG2-CD1 4.11Å; T9-F62 HydrophobicContact CG2-CG 4.38Å; A12-F62 HydrophobicContact CB-CE1 4.16Å; L49-F62 HydrophobicContact CD1-CE2 3.69Å; L49-F62 HydrophobicContact CD1-CZ 3.76Å; V60-F62 HydrophobicContact CG1-CE1 4.07Å; V60-F62 HydrophobicContact CG1-CE2 4.26Å; V60-F62 HydrophobicContact CG1-CZ 3.86Å; F62-M64 HydrophobicContact CB-CE 3.62Å; F62-M64 HydrophobicContact CB-SD 4.18Å; F62-M64 HydrophobicContact CD2-CE 4.21Å; F62-M64 HydrophobicContact CG-CE 4.25Å; F62-M64 PolarHBondContact O-N 3.38Å; F62-M292 HydrophobicContact CD1-CE 3.8Å; F62-M292 HydrophobicContact CE1-CE 3.34Å; F62-M292 HydrophobicContact CE2-CB 4.2Å; F62-M292 HydrophobicContact CE2-CE 4.44Å; F62-M292 HydrophobicContact CZ-CB 4.34Å; F62-M292 HydrophobicContact CZ-CE 3.72Å
63D92.2Very high91.9Very high37 Ų3761 Ų6120%0.19833%0.325CS..  trans-74.9109.5168.4-177.1-12000110.2L4 T6 T9 S65L4-D63 WeakPolarHBondContact O-CB 3.3Å; L4-D63 PolarHBondContact O-N 2.68Å; T6-D63 PolarHBondContact N-OD2 3.48Å; T6-D63 VanDerWaalsContact OG1-CG 3.25Å; T6-D63 PolarHBondContact OG1-OD2 2.89Å; T9-D63 WeakPolarHBondContact CG2-O 3.46Å; T9-D63 PolarHBondContact OG1-N 3.28Å; T9-D63 VanDerWaalsContact OG1-N 3.16Å; D63-S65 VanDerWaalsContact C-N 3.3Å; D63-S65 PolarHBondContact O-N 3.49Å; D63-S65 WeakPolarHBondContact OD1-CB 3.49Å; D63-S65 PolarHBondContact OD1-N 2.88Å; D63-S65 PolarHBondContact OD1-OG 3.19Å
64M90.3Very high92.3Very high56 Ų5658.6 Ų58.628%0.27632%0.315SS..  trans-89.114.8-176.4-61.2-59.9-174.700113.6F62 L66 R67 M289F62-M64 HydrophobicContact CB-CE 3.62Å; F62-M64 HydrophobicContact CB-SD 4.18Å; F62-M64 HydrophobicContact CD2-CE 4.21Å; F62-M64 HydrophobicContact CG-CE 4.25Å; F62-M64 PolarHBondContact O-N 3.38Å; M64-L66 PolarHBondContact O-N 3.32Å; M64-L66 VanDerWaalsContact O-N 3.1Å; M64-R67 HydrophobicContact CB-CB 4.24Å; M64-R67 WeakPolarHBondContact O-CB 3.2Å; M64-R67 PolarHBondContact O-N 2.69Å; M64-M289 WeakPolarHBondContact CE-O 3.35Å; M64-M289 HydrophobicContact SD-CB 3.99Å
65S93Very high92.6Very high77 Ų7749.9 Ų49.954%0.53828%0.277SS..THydrogen-bonded Turntrans-57-28.7-176.4-64.10000114.3D63 P69D63-S65 VanDerWaalsContact C-N 3.3Å; D63-S65 PolarHBondContact O-N 3.49Å; D63-S65 WeakPolarHBondContact OD1-CB 3.49Å; D63-S65 PolarHBondContact OD1-N 2.88Å; D63-S65 PolarHBondContact OD1-OG 3.19Å; S65-P69 WeakPolarHBondContact O-CD 3.37Å
66L93.6Very high92.8Very high55 Ų5546 Ų4629%0.28825%0.25SC..THydrogen-bonded Turntrans-83.5-16.9176.7-70.1175.6000113.9T6 L10 M64 D68 P69 L70 M289T6-L66 HydrophobicContact CG2-CD1 3.61Å; T6-L66 HydrophobicContact CG2-CD2 4.4Å; T6-L66 HydrophobicContact CG2-CG 3.65Å; L10-L66 HydrophobicContact CB-CD1 4.19Å; L10-L66 HydrophobicContact CD1-CD1 4.24Å; L10-L66 HydrophobicContact CD2-CD1 4.17Å; L10-L66 HydrophobicContact CG-CD1 4.44Å; M64-L66 PolarHBondContact O-N 3.32Å; M64-L66 VanDerWaalsContact O-N 3.1Å; L66-D68 VanDerWaalsContact C-N 3.35Å; L66-D68 PolarHBondContact O-N 3.49Å; L66-P69 WeakPolarHBondContact O-CD 3.49Å; L66-L70 HydrophobicContact CB-CD1 4.07Å; L66-L70 WeakPolarHBondContact O-CB 3.44Å; L66-L70 VanDerWaalsContact O-CD1 3.28Å; L66-L70 WeakPolarHBondContact O-CD1 3.37Å; L66-L70 WeakPolarHBondContact O-CG 3.39Å; L66-L70 PolarHBondContact O-N 3.25Å; L66-L70 VanDerWaalsContact O-N 3.14Å; L66-M289 HydrophobicContact CB-CE 3.85Å; L66-M289 HydrophobicContact CB-SD 4.02Å; L66-M289 HydrophobicContact CD1-CE 4.19Å
67R92.2Very high93.1Very high39 Ų3940.9 Ų40.915%0.14723%0.225CC..Hα-helixtrans-56.9-47.9-175.3-177.8-170.7158.9167.5-2111.5M64 M71 F286M64-R67 HydrophobicContact CB-CB 4.24Å; M64-R67 WeakPolarHBondContact O-CB 3.2Å; M64-R67 PolarHBondContact O-N 2.69Å; R67-M71 WeakPolarHBondContact O-CB 3.48Å; R67-M71 PolarHBondContact O-N 3.13Å; R67-F286 HydrophobicContact CG-CD2 3.52Å; R67-F286 HydrophobicContact CG-CE2 3.69Å; R67-F286 WeakPolarHBondContact O-CD2 3.36Å
68D92.3Very high93.3Very high55 Ų5541.4 Ų41.429%0.29421%0.213SC..Hα-helixtrans-69.8-50.1-175.7-70.6-28.2000113.5L66 L70 M71 L72 K146L66-D68 VanDerWaalsContact C-N 3.35Å; L66-D68 PolarHBondContact O-N 3.49Å; D68-L70 VanDerWaalsContact C-N 3.26Å; D68-L70 PolarHBondContact O-N 2.97Å; D68-M71 PolarHBondContact O-N 2.73Å; D68-L72 WeakPolarHBondContact O-CG 3.41Å; D68-L72 PolarHBondContact O-N 3.42Å; D68-K146 WeakPolarHBondContact OD1-CD 3.36Å; D68-K146 WeakPolarHBondContact OD1-CE 3.21Å; D68-K146 IonicContact OD1-NZ 3.79Å; D68-K146 PolarHBondContact OD1-NZ 3.43Å; D68-K146 IonicContact OD2-NZ 2.73Å; D68-K146 PolarHBondContact OD2-NZ 3.29Å
69P95.2Very high93.7Very high61 Ų6135.3 Ų35.340%0.39619%0.191SC..Hα-helixtrans-55.1-40.6173.5-27.134000113.1S65 L66 L72 A73S65-P69 WeakPolarHBondContact O-CD 3.37Å; L66-P69 WeakPolarHBondContact O-CD 3.49Å; P69-L72 PolarHBondContact O-N 3.45Å; P69-A73 WeakPolarHBondContact O-CB 3.33Å; P69-A73 PolarHBondContact O-N 3.48Å
70L96.1Very high94.1Very high25 Ų2532 Ų3213%0.13118%0.175CC..Hα-helixtrans-66.5-43.1178.5-69.7167.2000111.9L66 D68 A73 F74 S282 L285 F286 M289L66-L70 HydrophobicContact CB-CD1 4.07Å; L66-L70 WeakPolarHBondContact O-CB 3.44Å; L66-L70 VanDerWaalsContact O-CD1 3.28Å; L66-L70 WeakPolarHBondContact O-CD1 3.37Å; L66-L70 WeakPolarHBondContact O-CG 3.39Å; L66-L70 PolarHBondContact O-N 3.25Å; L66-L70 VanDerWaalsContact O-N 3.14Å; D68-L70 VanDerWaalsContact C-N 3.26Å; D68-L70 PolarHBondContact O-N 2.97Å; L70-A73 PolarHBondContact O-N 3.36Å; L70-F74 PolarHBondContact O-N 3.01Å; L70-S282 WeakPolarHBondContact O-CB 3.17Å; L70-L285 HydrophobicContact CD1-CB 3.62Å; L70-L285 HydrophobicContact CD2-CB 4.25Å; L70-L285 HydrophobicContact CD2-CD1 4.1Å; L70-F286 HydrophobicContact CB-CB 3.94Å; L70-M289 HydrophobicContact CD1-CE 3.75Å; L70-M289 HydrophobicContact CD1-SD 3.94Å
71M95.3Very high94.2Very high9 Ų932.9 Ų32.94%0.04418%0.179CC..Hα-helixtrans-59.4-50.5173.9-177.3-173.968.800111.2R67 D68 A73 F74 F75 A143 F286R67-M71 WeakPolarHBondContact O-CB 3.48Å; R67-M71 PolarHBondContact O-N 3.13Å; D68-M71 PolarHBondContact O-N 2.73Å; M71-A73 VanDerWaalsContact C-N 3.31Å; M71-A73 PolarHBondContact O-N 2.81Å; M71-F74 WeakPolarHBondContact O-CB 3.38Å; M71-F74 PolarHBondContact O-N 3.27Å; M71-F75 HydrophobicContact CG-CD2 4.15Å; M71-F75 HydrophobicContact CG-CE2 4.11Å; M71-F75 WeakPolarHBondContact O-CD2 3.34Å; M71-F75 PolarHBondContact O-N 2.89Å; M71-F75 VanDerWaalsContact O-N 3.1Å; M71-A143 HydrophobicContact CG-CB 4.24Å; M71-A143 WeakPolarHBondContact SD-CA 3.28Å; M71-A143 HydrophobicContact SD-CB 3.54Å; M71-A143 VanDerWaalsContact SD-CB 3.54Å; M71-F286 HydrophobicContact CB-CD1 4.23Å; M71-F286 HydrophobicContact CB-CD2 3.71Å; M71-F286 HydrophobicContact CB-CE1 4.15Å; M71-F286 HydrophobicContact CB-CE2 3.65Å; M71-F286 HydrophobicContact CB-CG 3.99Å; M71-F286 HydrophobicContact CB-CZ 3.84Å; M71-F286 HydrophobicContact CG-CD1 4.37Å; M71-F286 HydrophobicContact CG-CD2 4.36Å; M71-F286 HydrophobicContact CG-CE1 3.85Å; M71-F286 HydrophobicContact CG-CE2 3.87Å; M71-F286 HydrophobicContact CG-CZ 3.55Å; M71-F286 HydrophobicContact SD-CE1 4.46Å; M71-F286 HydrophobicContact SD-CE2 3.92Å; M71-F286 HydrophobicContact SD-CZ 3.65Å
72L97Very high94.2Very high26 Ų2632.2 Ų32.214%0.13618%0.18CC..Hα-helixtrans-63.6-38.3179.7-64.6179.4000111.5D68 P69 F74 F75 A76 L228 T247 F248 V251D68-L72 WeakPolarHBondContact O-CG 3.41Å; D68-L72 PolarHBondContact O-N 3.42Å; P69-L72 PolarHBondContact O-N 3.45Å; L72-F74 VanDerWaalsContact C-N 3.33Å; L72-F74 PolarHBondContact O-N 3.32Å; L72-F75 PolarHBondContact O-N 3.32Å; L72-A76 WeakPolarHBondContact O-CB 3.19Å; L72-A76 PolarHBondContact O-N 3.45Å; L72-L228 HydrophobicContact CB-CD1 4.09Å; L72-L228 HydrophobicContact CB-CD2 4.32Å; L72-L228 HydrophobicContact CB-CG 3.87Å; L72-T247 HydrophobicContact CD1-CG2 4.28Å; L72-T247 HydrophobicContact CD2-CG2 4.13Å; L72-F248 HydrophobicContact CD2-CB 3.8Å; L72-V251 HydrophobicContact CD2-CG2 4.17Å; L72-V251 WeakPolarHBondContact O-CG1 3.36Å
73A97.7Very high94Very high10 Ų1034.1 Ų34.18%0.08319%0.191CC..Hα-helixtrans-60.8-43.1175.600000111.5P69 L70 M71 A76 T77 I224P69-A73 WeakPolarHBondContact O-CB 3.33Å; P69-A73 PolarHBondContact O-N 3.48Å; L70-A73 PolarHBondContact O-N 3.36Å; M71-A73 VanDerWaalsContact C-N 3.31Å; M71-A73 PolarHBondContact O-N 2.81Å; A73-A76 WeakPolarHBondContact O-CB 3.14Å; A73-A76 PolarHBondContact O-N 2.92Å; A73-T77 WeakPolarHBondContact O-CG2 3.33Å; A73-T77 PolarHBondContact O-N 3.5Å; A73-I224 HydrophobicContact CB-CG2 3.74Å
74F96.2Very high93.7Very high26 Ų2635.3 Ų35.311%0.11420%0.197CC..Hα-helixtrans-57.9-49.5172.8166.7-110.6000112.1L70 M71 L72 A76 T77 I78 L283L70-F74 PolarHBondContact O-N 3.01Å; M71-F74 WeakPolarHBondContact O-CB 3.38Å; M71-F74 PolarHBondContact O-N 3.27Å; L72-F74 VanDerWaalsContact C-N 3.33Å; L72-F74 PolarHBondContact O-N 3.32Å; F74-A76 VanDerWaalsContact C-N 3.32Å; F74-A76 PolarHBondContact O-N 2.89Å; F74-T77 WeakPolarHBondContact O-CB 3.4Å; F74-T77 PolarHBondContact O-N 3.05Å; F74-T77 PolarHBondContact O-OG1 3.38Å; F74-I78 HydrophobicContact CD1-CD1 4.32Å; F74-I78 HydrophobicContact CE1-CD1 3.64Å; F74-I78 HydrophobicContact CE2-CD1 4.1Å; F74-I78 HydrophobicContact CE2-CG1 4.22Å; F74-I78 HydrophobicContact CZ-CD1 3.55Å; F74-I78 HydrophobicContact CZ-CG1 4.17Å; F74-I78 PolarHBondContact O-N 2.89Å; F74-I78 VanDerWaalsContact O-N 3.14Å; F74-L283 HydrophobicContact CB-CB 4.36Å; F74-L283 HydrophobicContact CD1-CD1 3.93Å; F74-L283 HydrophobicContact CD2-CB 3.62Å; F74-L283 HydrophobicContact CD2-CD1 4.21Å; F74-L283 HydrophobicContact CD2-CD2 4.25Å; F74-L283 HydrophobicContact CD2-CG 4.23Å; F74-L283 HydrophobicContact CE1-CD1 3.84Å; F74-L283 HydrophobicContact CE2-CB 3.98Å; F74-L283 HydrophobicContact CE2-CD1 4.12Å; F74-L283 HydrophobicContact CE2-CD2 3.71Å; F74-L283 HydrophobicContact CE2-CG 4.14Å; F74-L283 HydrophobicContact CG-CB 3.95Å; F74-L283 HydrophobicContact CG-CD1 4.08Å; F74-L283 HydrophobicContact CZ-CD1 3.91Å; F74-L283 HydrophobicContact CZ-CD2 3.94Å; F74-L283 HydrophobicContact CZ-CG 4.37Å
75F96.5Very high93.3Very high7 Ų735.6 Ų35.63%0.03121%0.209CC..Hα-helixtrans-65.7-33.4178.5-81.2-79.5000113.4M71 L72 T77 I78 G79 A143 F248 L252M71-F75 HydrophobicContact CG-CD2 4.15Å; M71-F75 HydrophobicContact CG-CE2 4.11Å; M71-F75 WeakPolarHBondContact O-CD2 3.34Å; M71-F75 PolarHBondContact O-N 2.89Å; M71-F75 VanDerWaalsContact O-N 3.1Å; L72-F75 PolarHBondContact O-N 3.32Å; F75-T77 VanDerWaalsContact C-N 3.29Å; F75-T77 PolarHBondContact O-N 3.33Å; F75-I78 HydrophobicContact CD1-CD1 4.01Å; F75-I78 HydrophobicContact CE1-CD1 4.2Å; F75-I78 PolarHBondContact O-N 3.35Å; F75-G79 PolarHBondContact O-N 3.24Å; F75-A143 HydrophobicContact CE2-CB 3.63Å; F75-A143 HydrophobicContact CZ-CB 3.95Å; F75-F248 HydrophobicContact CB-CB 4.29Å; F75-F248 AromaticContact CD1-CD2 3.89Å; F75-F248 HydrophobicContact CD1-CD2 3.89Å; F75-F248 HydrophobicContact CD2-CB 3.75Å; F75-F248 HydrophobicContact CD2-CD2 4.16Å; F75-F248 HydrophobicContact CD2-CG 4.25Å; F75-F248 AromaticContact CE1-CD2 3.77Å; F75-F248 HydrophobicContact CE1-CD2 3.77Å; F75-F248 HydrophobicContact CE1-CE2 4.24Å; F75-F248 HydrophobicContact CE2-CB 4.27Å; F75-F248 HydrophobicContact CE2-CD2 4.06Å; F75-F248 HydrophobicContact CE2-CG 4.31Å; F75-F248 HydrophobicContact CG-CB 3.94Å; F75-F248 HydrophobicContact CG-CD2 4.1Å; F75-F248 HydrophobicContact CG-CG 4.46Å; F75-F248 AromaticContact CZ-CD2 3.87Å; F75-F248 HydrophobicContact CZ-CD2 3.87Å; F75-F248 HydrophobicContact CZ-CE2 4.29Å; F75-L252 HydrophobicContact CB-CB 4.41Å; F75-L252 HydrophobicContact CD1-CD1 4.01Å
76A97.9Very high92.6Very high0 Ų035.3 Ų35.30%021%0.207CC..Hα-helixtrans-59.2-42.2170.100000110.9L72 A73 F74 I78 G79 L80 I224 C227 L228 V251L72-A76 WeakPolarHBondContact O-CB 3.19Å; L72-A76 PolarHBondContact O-N 3.45Å; A73-A76 WeakPolarHBondContact O-CB 3.14Å; A73-A76 PolarHBondContact O-N 2.92Å; F74-A76 VanDerWaalsContact C-N 3.32Å; F74-A76 PolarHBondContact O-N 2.89Å; A76-I78 PolarHBondContact O-N 2.83Å; A76-G79 PolarHBondContact O-N 3.45Å; A76-L80 WeakPolarHBondContact O-CB 3.38Å; A76-L80 VanDerWaalsContact O-CG 3.25Å; A76-L80 WeakPolarHBondContact O-CG 3.34Å; A76-L80 PolarHBondContact O-N 3.33Å; A76-I224 HydrophobicContact CB-CG1 4.48Å; A76-I224 HydrophobicContact CB-CG2 4.27Å; A76-C227 HydrophobicContact CB-CB 3.68Å; A76-L228 HydrophobicContact CB-CD1 3.94Å; A76-V251 HydrophobicContact CB-CG1 3.7Å
77T96.6Very high92.1Very high5 Ų538 Ų383%0.03122%0.22CC..Hα-helixtrans-66.3-34.3179.170.20000113.4A73 F74 F75 L80 N81 I224 V275 G279A73-T77 WeakPolarHBondContact O-CG2 3.33Å; A73-T77 PolarHBondContact O-N 3.5Å; F74-T77 WeakPolarHBondContact O-CB 3.4Å; F74-T77 PolarHBondContact O-N 3.05Å; F74-T77 PolarHBondContact O-OG1 3.38Å; F75-T77 VanDerWaalsContact C-N 3.29Å; F75-T77 PolarHBondContact O-N 3.33Å; T77-L80 PolarHBondContact O-N 3.07Å; T77-N81 WeakPolarHBondContact O-CB 3.33Å; T77-N81 PolarHBondContact O-N 2.8Å; T77-I224 HydrophobicContact CG2-CD1 3.66Å; T77-I224 HydrophobicContact CG2-CG1 4.15Å; T77-V275 HydrophobicContact CG2-CG1 4.01Å; T77-V275 WeakPolarHBondContact CG2-O 3.26Å; T77-V275 WeakPolarHBondContact O-CG1 3.49Å; T77-G279 VanDerWaalsContact CG2-CA 3.48Å; T77-G279 WeakPolarHBondContact OG1-CA 3.38Å
78I93.2Very high91.8Very high69 Ų6944.8 Ų44.835%0.35425%0.246SC..Hα-helixtrans-60.5-48.8171.8-64.7173.7000109.9F74 F75 A76 N81 A82 L252F74-I78 HydrophobicContact CD1-CD1 4.32Å; F74-I78 HydrophobicContact CE1-CD1 3.64Å; F74-I78 HydrophobicContact CE2-CD1 4.1Å; F74-I78 HydrophobicContact CE2-CG1 4.22Å; F74-I78 HydrophobicContact CZ-CD1 3.55Å; F74-I78 HydrophobicContact CZ-CG1 4.17Å; F74-I78 PolarHBondContact O-N 2.89Å; F74-I78 VanDerWaalsContact O-N 3.14Å; F75-I78 HydrophobicContact CD1-CD1 4.01Å; F75-I78 HydrophobicContact CE1-CD1 4.2Å; F75-I78 PolarHBondContact O-N 3.35Å; A76-I78 PolarHBondContact O-N 2.83Å; I78-N81 PolarHBondContact O-N 3.47Å; I78-A82 PolarHBondContact O-N 2.93Å; I78-L252 HydrophobicContact CB-CD1 4.12Å; I78-L252 HydrophobicContact CG2-CD1 3.71Å; I78-L252 HydrophobicContact CG2-CG 4.4Å
79G95.4Very high91.3Very high1 Ų146.3 Ų46.31%0.0127%0.266CS..Hα-helixtrans-63.7-43.1178.300000112.7F75 A76 N81 A82 L252 G255 V256 S259F75-G79 PolarHBondContact O-N 3.24Å; A76-G79 PolarHBondContact O-N 3.45Å; G79-N81 VanDerWaalsContact C-N 3.26Å; G79-N81 PolarHBondContact O-N 3.3Å; G79-A82 WeakPolarHBondContact O-CB 3.48Å; G79-A82 PolarHBondContact O-N 3.17Å; G79-L252 WeakPolarHBondContact CA-O 3.43Å; G79-G255 CarbonylContact O-C 3.31Å; G79-V256 WeakPolarHBondContact O-CA 3.35Å; G79-V256 PolarHBondContact O-N 3.45Å; G79-S259 PolarHBondContact O-OG 2.87Å
80L95.6Very high90.7Very high4 Ų444 Ų442%0.02125%0.254CS..Hα-helixtrans-64.7-29.7-179.7-73.9169.4000113.1A76 T77 A82 L223 I224 L258 S259 V270 V275A76-L80 WeakPolarHBondContact O-CB 3.38Å; A76-L80 VanDerWaalsContact O-CG 3.25Å; A76-L80 WeakPolarHBondContact O-CG 3.34Å; A76-L80 PolarHBondContact O-N 3.33Å; T77-L80 PolarHBondContact O-N 3.07Å; L80-A82 VanDerWaalsContact C-N 3.35Å; L80-L223 HydrophobicContact CD1-CB 4.03Å; L80-L223 HydrophobicContact CD2-CB 4.2Å; L80-I224 HydrophobicContact CD1-CG1 3.84Å; L80-L258 HydrophobicContact CD2-CB 4.43Å; L80-L258 HydrophobicContact CD2-CD2 4.23Å; L80-L258 HydrophobicContact CD2-CG 4.47Å; L80-S259 WeakPolarHBondContact O-CB 3.27Å; L80-V270 HydrophobicContact CB-CG1 4.45Å; L80-V275 HydrophobicContact CB-CG1 3.93Å; L80-V275 HydrophobicContact CB-CG2 4.36Å
81N91.9Very high90.3Very high52 Ų5244.9 Ų44.928%0.27827%0.269SS..THydrogen-bonded Turntrans-83.9-5.8173.5-79.1-24.4000113.5T77 I78 G79 N83 V275 S276T77-N81 WeakPolarHBondContact O-CB 3.33Å; T77-N81 PolarHBondContact O-N 2.8Å; I78-N81 PolarHBondContact O-N 3.47Å; G79-N81 VanDerWaalsContact C-N 3.26Å; G79-N81 PolarHBondContact O-N 3.3Å; N81-N83 PolarHBondContact O-N 3.13Å; N81-V275 WeakPolarHBondContact OD1-CG1 3.27Å; N81-S276 PolarHBondContact ND2-OG 3.02Å; N81-S276 VanDerWaalsContact ND2-OG 3.12Å
82A89Confident90Very high35 Ų3554.6 Ų54.629%0.28931%0.305SS..  trans-71.3119.1179.300000110.7I78 G79 L80 V256 S259 N260I78-A82 PolarHBondContact O-N 2.93Å; G79-A82 WeakPolarHBondContact O-CB 3.48Å; G79-A82 PolarHBondContact O-N 3.17Å; L80-A82 VanDerWaalsContact C-N 3.35Å; A82-V256 HydrophobicContact CB-CB 4.42Å; A82-V256 HydrophobicContact CB-CG1 4.24Å; A82-V256 HydrophobicContact CB-CG2 3.77Å; A82-S259 PolarHBondContact O-OG 3.31Å; A82-N260 PolarHBondContact O-ND2 2.87Å
83N86.9Confident89.5Confident67 Ų6755.7 Ų55.736%0.35831%0.313SS..  trans-110.7102.9178.2-172.8-24.9000110.6N81 A85 S86 L87N81-N83 PolarHBondContact O-N 3.13Å; N83-A85 PolarHBondContact O-N 2.97Å; N83-A85 WeakPolarHBondContact OD1-CA 3.19Å; N83-A85 VanDerWaalsContact OD1-CB 3.31Å; N83-A85 WeakPolarHBondContact OD1-CB 3.26Å; N83-A85 PolarHBondContact OD1-N 2.85Å; N83-S86 PolarHBondContact ND2-OG 3.43Å; N83-S86 VanDerWaalsContact ND2-OG 3.16Å; N83-S86 PolarHBondContact O-N 3.26Å; N83-S86 PolarHBondContact OD1-N 3.13Å; N83-S86 VanDerWaalsContact OD1-N 3.08Å; N83-L87 PolarHBondContact O-N 2.88Å; N83-L87 VanDerWaalsContact O-N 3.12Å
84I84.8Confident89.1Confident63 Ų6356.6 Ų56.632%0.32332%0.317SS..Hα-helixtrans-65.8-30.7-179.1-63.6171.1000111L87 R88 V256 N260I84-L87 PolarHBondContact O-N 3.01Å; I84-R88 WeakPolarHBondContact O-CG 3.3Å; I84-R88 PolarHBondContact O-N 3.49Å; I84-V256 HydrophobicContact CD1-CG1 4.17Å; I84-V256 HydrophobicContact CG1-CG1 4.5Å; I84-N260 WeakPolarHBondContact CB-OD1 3.39Å; I84-N260 HydrophobicContact CD1-CB 3.95Å; I84-N260 WeakPolarHBondContact CG1-OD1 3.33Å; I84-N260 PolarHBondContact N-OD1 3.36Å
85A82.8Confident88.9Confident62 Ų6257 Ų5751%0.51233%0.328SS..Hα-helixtrans-66.8-42.5177.500000111.2N83 R88 A89N83-A85 PolarHBondContact O-N 2.97Å; N83-A85 WeakPolarHBondContact OD1-CA 3.19Å; N83-A85 VanDerWaalsContact OD1-CB 3.31Å; N83-A85 WeakPolarHBondContact OD1-CB 3.26Å; N83-A85 PolarHBondContact OD1-N 2.85Å; A85-R88 PolarHBondContact O-N 3.43Å; A85-A89 PolarHBondContact O-N 3.31Å
86S79.4Confident88.8Confident71 Ų7159 Ų5950%0.49734%0.339SS..Hα-helixtrans-62.6-41.7174.1-570000111.9N83 R88 A89 G90N83-S86 PolarHBondContact ND2-OG 3.43Å; N83-S86 VanDerWaalsContact ND2-OG 3.16Å; N83-S86 PolarHBondContact O-N 3.26Å; N83-S86 PolarHBondContact OD1-N 3.13Å; N83-S86 VanDerWaalsContact OD1-N 3.08Å; S86-R88 VanDerWaalsContact C-N 3.3Å; S86-R88 PolarHBondContact O-N 2.82Å; S86-A89 WeakPolarHBondContact O-CB 3.34Å; S86-A89 PolarHBondContact O-N 3.16Å; S86-A89 VanDerWaalsContact O-N 3.14Å; S86-G90 PolarHBondContact O-N 3.08Å
87L82.9Confident88.6Confident110 Ų11060.9 Ų60.958%0.57635%0.347SS*.Hα-helixtrans-60.8-39.9176.4-169.973.6000111.9N83 I84 V94N83-L87 PolarHBondContact O-N 2.88Å; N83-L87 VanDerWaalsContact O-N 3.12Å; I84-L87 PolarHBondContact O-N 3.01Å; L87-V94 HydrophobicContact CD1-CG1 3.54Å; L87-V94 HydrophobicContact CG-CG1 4.3Å
88R85.1Confident88.4Confident183 Ų18365.7 Ų65.769%0.69137%0.372SS*.Hα-helixtrans-68.5-36.6174.7-70.5-177.5-147163.56.7112.5I84 A85 S86 G90 G91I84-R88 WeakPolarHBondContact O-CG 3.3Å; I84-R88 PolarHBondContact O-N 3.49Å; A85-R88 PolarHBondContact O-N 3.43Å; S86-R88 VanDerWaalsContact C-N 3.3Å; S86-R88 PolarHBondContact O-N 2.82Å; R88-G90 VanDerWaalsContact C-N 3.28Å; R88-G90 PolarHBondContact O-N 3.36Å; R88-G91 PolarHBondContact O-N 2.85Å
89A82.9Confident88.5Confident87 Ų8767.8 Ų67.872%0.71938%0.383SS*.Hα-helixtrans-63.2-33.5179.500000112.5A85 S86 G91A85-A89 PolarHBondContact O-N 3.31Å; S86-A89 WeakPolarHBondContact O-CB 3.34Å; S86-A89 PolarHBondContact O-N 3.16Å; S86-A89 VanDerWaalsContact O-N 3.14Å; A89-G91 PolarHBondContact O-N 2.87Å
90G81.3Confident88.6Confident13 Ų1367.8 Ų67.813%0.13438%0.383CS..THydrogen-bonded Turntrans-66.9-11173.500000114.8S86 R88 V93 V94S86-G90 PolarHBondContact O-N 3.08Å; R88-G90 VanDerWaalsContact C-N 3.28Å; R88-G90 PolarHBondContact O-N 3.36Å; G90-V93 PolarHBondContact O-N 2.87Å; G90-V94 PolarHBondContact O-N 3.49Å
91G87.8Confident88.6Confident43 Ų4368.6 Ų68.644%0.44339%0.388SS..Hα-helixtrans55.5-134.7165.400000114.7R88 A89 V93 G95R88-G91 PolarHBondContact O-N 2.85Å; A89-G91 PolarHBondContact O-N 2.87Å; G91-V93 VanDerWaalsContact C-N 3.33Å; G91-V93 PolarHBondContact O-N 3.01Å; G91-G95 PolarHBondContact O-N 3.01Å
92R89.2Confident88.8Confident212 Ų21269.7 Ų69.780%0.840%0.396SS*.Hα-helixtrans-65.8-34.7-174.8-172.1177.6-178.5179.10.7112.8G95 I96R92-G95 PolarHBondContact O-N 3.38Å; R92-I96 HydrophobicContact CG-CD1 3.84Å; R92-I96 HydrophobicContact CG-CG1 4.35Å; R92-I96 WeakPolarHBondContact O-CG1 3.37Å; R92-I96 PolarHBondContact O-N 2.89Å
93V87.4Confident89.2Confident50 Ų5069.2 Ų69.230%0.30340%0.395SS..Hα-helixtrans-62.7-51.4-178.3172.70000110.1G90 G91 G95 I96 F97 M329 M369G90-V93 PolarHBondContact O-N 2.87Å; G91-V93 VanDerWaalsContact C-N 3.33Å; G91-V93 PolarHBondContact O-N 3.01Å; V93-G95 VanDerWaalsContact C-N 3.34Å; V93-G95 PolarHBondContact O-N 2.88Å; V93-I96 PolarHBondContact O-N 3.47Å; V93-F97 WeakPolarHBondContact O-CB 3.26Å; V93-F97 PolarHBondContact O-N 3.43Å; V93-M329 HydrophobicContact CG1-CE 3.58Å; V93-M369 HydrophobicContact CB-SD 4.39Å; V93-M369 HydrophobicContact CG1-SD 3.42Å; V93-M369 WeakPolarHBondContact CG1-SD 3.26Å; V93-M369 HydrophobicContact CG2-SD 4.01Å
94V88.9Confident89.7Confident29 Ų2966 Ų6618%0.17638%0.378CS..Hα-helixtrans-62.1-41.4177.4170.60000111.5L87 G90 I96 F97 L98 I372L87-V94 HydrophobicContact CD1-CG1 3.54Å; L87-V94 HydrophobicContact CG-CG1 4.3Å; G90-V94 PolarHBondContact O-N 3.49Å; V94-I96 PolarHBondContact O-N 3.17Å; V94-F97 PolarHBondContact O-N 2.84Å; V94-L98 VanDerWaalsContact O-CB 3.32Å; V94-L98 WeakPolarHBondContact O-CB 3.21Å; V94-L98 PolarHBondContact O-N 3.21Å; V94-I372 HydrophobicContact CG2-CG2 3.49Å; V94-I372 VanDerWaalsContact CG2-CG2 3.49Å
95G91.9Very high90.3Very high34 Ų3465.5 Ų65.535%0.35138%0.375SS..Hα-helixtrans-60.6-45.4177.200000113.2G91 R92 V93 L98 I99G91-G95 PolarHBondContact O-N 3.01Å; R92-G95 PolarHBondContact O-N 3.38Å; V93-G95 VanDerWaalsContact C-N 3.34Å; V93-G95 PolarHBondContact O-N 2.88Å; G95-L98 PolarHBondContact O-N 3.39Å; G95-I99 WeakPolarHBondContact O-CG1 3.17Å; G95-I99 PolarHBondContact O-N 3.21Å
96I94.1Very high91Very high48 Ų4866.9 Ų66.925%0.24638%0.377CS..Hα-helixtrans-65.2-45.2176.1-67169.1000110.2R92 V93 V94 L98 I99 V100 M328 M329R92-I96 HydrophobicContact CG-CD1 3.84Å; R92-I96 HydrophobicContact CG-CG1 4.35Å; R92-I96 WeakPolarHBondContact O-CG1 3.37Å; R92-I96 PolarHBondContact O-N 2.89Å; V93-I96 PolarHBondContact O-N 3.47Å; V94-I96 PolarHBondContact O-N 3.17Å; I96-L98 VanDerWaalsContact C-N 3.32Å; I96-L98 PolarHBondContact O-N 3.02Å; I96-I99 WeakPolarHBondContact O-CB 3.37Å; I96-I99 PolarHBondContact O-N 3.25Å; I96-V100 WeakPolarHBondContact O-CG2 3.41Å; I96-V100 PolarHBondContact O-N 3.44Å; I96-M328 HydrophobicContact CG2-CB 4.34Å; I96-M328 HydrophobicContact CG2-CE 4.26Å; I96-M329 HydrophobicContact CB-SD 4.5Å; I96-M329 HydrophobicContact CG2-SD 3.91Å
97F93.2Very high91.8Very high40 Ų4067.8 Ų67.818%0.17537%0.374CS..Hα-helixtrans-62.2-41.1179.9-168.4-116.6000111.8V93 V94 I99 V100 V101 T325 M329 H342 F345V93-F97 WeakPolarHBondContact O-CB 3.26Å; V93-F97 PolarHBondContact O-N 3.43Å; V94-F97 PolarHBondContact O-N 2.84Å; F97-I99 VanDerWaalsContact C-N 3.31Å; F97-I99 PolarHBondContact O-N 2.82Å; F97-V100 CarbonylContact O-C 3.4Å; F97-V100 WeakPolarHBondContact O-CA 3.4Å; F97-V100 WeakPolarHBondContact O-CB 3.27Å; F97-V100 PolarHBondContact O-N 2.88Å; F97-V100 VanDerWaalsContact O-N 3.08Å; F97-V101 HydrophobicContact CD1-CG2 4.07Å; F97-V101 HydrophobicContact CE1-CG2 3.83Å; F97-V101 HydrophobicContact CZ-CG2 4.08Å; F97-V101 WeakPolarHBondContact O-CG2 3.28Å; F97-V101 PolarHBondContact O-N 2.89Å; F97-T325 HydrophobicContact CD2-CG2 4.45Å; F97-T325 HydrophobicContact CE2-CG2 3.9Å; F97-M329 HydrophobicContact CB-CE 3.99Å; F97-M329 HydrophobicContact CB-SD 4.11Å; F97-M329 HydrophobicContact CD2-CE 4.27Å; F97-M329 HydrophobicContact CD2-CG 4.35Å; F97-M329 HydrophobicContact CD2-SD 4.03Å; F97-M329 HydrophobicContact CG-CE 4.49Å; F97-H342 HydrophobicContact CE2-CB 4.24Å; F97-H342 HydrophobicContact CZ-CB 4.09Å; F97-F345 AromaticContact CE1-CE1 3.89Å; F97-F345 HydrophobicContact CE1-CE1 3.89Å; F97-F345 AromaticContact CE1-CZ 3.89Å; F97-F345 HydrophobicContact CE1-CZ 3.89Å; F97-F345 AromaticContact CZ-CE1 3.68Å; F97-F345 HydrophobicContact CZ-CE1 3.68Å; F97-F345 AromaticContact CZ-CZ 3.85Å; F97-F345 HydrophobicContact CZ-CZ 3.85Å
98L93.3Very high92.5Very high106 Ų10662.5 Ų62.556%0.55535%0.347SS*.Hα-helixtrans-57.4-43.7174.8-172.480.3000111.6V94 G95 I96 V100 V101 V102V94-L98 VanDerWaalsContact O-CB 3.32Å; V94-L98 WeakPolarHBondContact O-CB 3.21Å; V94-L98 PolarHBondContact O-N 3.21Å; G95-L98 PolarHBondContact O-N 3.39Å; I96-L98 VanDerWaalsContact C-N 3.32Å; I96-L98 PolarHBondContact O-N 3.02Å; L98-V100 VanDerWaalsContact C-N 3.31Å; L98-V100 PolarHBondContact O-N 3.43Å; L98-V101 PolarHBondContact O-N 3.46Å; L98-V102 VanDerWaalsContact O-CG2 3.32Å; L98-V102 WeakPolarHBondContact O-CG2 3.3Å; L98-V102 PolarHBondContact O-N 2.65Å
99I95.9Very high93.1Very high113 Ų11355.7 Ų55.758%0.57932%0.324SS*.Hα-helixtrans-61.4-42.9176.4-66.9166000110.5G95 I96 F97 V102 G103G95-I99 WeakPolarHBondContact O-CG1 3.17Å; G95-I99 PolarHBondContact O-N 3.21Å; I96-I99 WeakPolarHBondContact O-CB 3.37Å; I96-I99 PolarHBondContact O-N 3.25Å; F97-I99 VanDerWaalsContact C-N 3.31Å; F97-I99 PolarHBondContact O-N 2.82Å; I99-V102 PolarHBondContact O-N 2.88Å; I99-G103 PolarHBondContact O-N 3.27Å
100V96.3Very high93.9Very high1 Ų154.3 Ų54.31%0.00631%0.313CS..Hα-helixtrans-61.9-43.1175.7173.90000111I96 F97 L98 G103 L104 Y320 T325 M328I96-V100 WeakPolarHBondContact O-CG2 3.41Å; I96-V100 PolarHBondContact O-N 3.44Å; F97-V100 CarbonylContact O-C 3.4Å; F97-V100 WeakPolarHBondContact O-CA 3.4Å; F97-V100 WeakPolarHBondContact O-CB 3.27Å; F97-V100 PolarHBondContact O-N 2.88Å; F97-V100 VanDerWaalsContact O-N 3.08Å; L98-V100 VanDerWaalsContact C-N 3.31Å; L98-V100 PolarHBondContact O-N 3.43Å; V100-G103 PolarHBondContact O-N 3.31Å; V100-L104 PolarHBondContact O-N 3.38Å; V100-Y320 HydrophobicContact CG1-CE1 3.7Å; V100-Y320 PolarHBondContact O-OH 3.48Å; V100-T325 HydrophobicContact CG1-CG2 4.08Å; V100-T325 WeakPolarHBondContact CG1-OG1 3.42Å; V100-M328 HydrophobicContact CG2-CB 3.88Å; V100-M328 HydrophobicContact CG2-CE 3.71Å; V100-M328 HydrophobicContact CG2-CG 4.29Å; V100-M328 HydrophobicContact CG2-SD 3.56Å; V100-M328 VanDerWaalsContact CG2-SD 3.56Å
101V95.6Very high94.6Very high21 Ų2155.5 Ų55.513%0.12732%0.316CS..Hα-helixtrans-65.3-49.2177.4175.50000110.8F97 L98 G103 L104 L105 F345F97-V101 HydrophobicContact CD1-CG2 4.07Å; F97-V101 HydrophobicContact CE1-CG2 3.83Å; F97-V101 HydrophobicContact CZ-CG2 4.08Å; F97-V101 WeakPolarHBondContact O-CG2 3.28Å; F97-V101 PolarHBondContact O-N 2.89Å; L98-V101 PolarHBondContact O-N 3.46Å; V101-G103 VanDerWaalsContact C-N 3.26Å; V101-G103 PolarHBondContact O-N 3.3Å; V101-L104 WeakPolarHBondContact O-CA 3.49Å; V101-L104 WeakPolarHBondContact O-CB 3.48Å; V101-L104 PolarHBondContact O-N 3.19Å; V101-L105 HydrophobicContact CG1-CD1 4.22Å; V101-L105 HydrophobicContact CG1-CG 4.28Å; V101-L105 WeakPolarHBondContact O-CG 3.41Å; V101-L105 PolarHBondContact O-N 3.43Å; V101-F345 HydrophobicContact CG1-CE2 4.08Å; V101-F345 HydrophobicContact CG1-CZ 4.42Å; V101-F345 HydrophobicContact CG2-CE2 4.09Å; V101-F345 HydrophobicContact CG2-CZ 3.59Å
102V96.5Very high95.1Very high76 Ų7653.4 Ų53.446%0.46130%0.295SS..Hα-helixtrans-57.5-42.7177.2171.50000110.9L98 I99 L104 L105 V106L98-V102 VanDerWaalsContact O-CG2 3.32Å; L98-V102 WeakPolarHBondContact O-CG2 3.3Å; L98-V102 PolarHBondContact O-N 2.65Å; I99-V102 PolarHBondContact O-N 2.88Å; V102-L104 PolarHBondContact O-N 3.44Å; V102-L105 PolarHBondContact O-N 3.02Å; V102-V106 WeakPolarHBondContact O-CG2 3.33Å; V102-V106 PolarHBondContact O-N 2.98Å
103G97.2Very high95.5Very high25 Ų2546.3 Ų46.326%0.25827%0.272SS..Hα-helixtrans-59.3-43.4173.600000112.8I99 V100 V101 M107I99-G103 PolarHBondContact O-N 3.27Å; V100-G103 PolarHBondContact O-N 3.31Å; V101-G103 VanDerWaalsContact C-N 3.26Å; V101-G103 PolarHBondContact O-N 3.3Å; G103-M107 VanDerWaalsContact O-CG 3.25Å; G103-M107 WeakPolarHBondContact O-CG 3.29Å; G103-M107 PolarHBondContact O-N 2.8Å; G103-M107 VanDerWaalsContact O-N 3.14Å
104L97.2Very high96Very high0 Ų045.3 Ų45.30%027%0.272CS..Hα-helixtrans-59.2-50.1173.5177.573.1000111V100 V101 V102 V106 M107 Q108 F316 M317 Y320 H342V100-L104 PolarHBondContact O-N 3.38Å; V101-L104 WeakPolarHBondContact O-CA 3.49Å; V101-L104 WeakPolarHBondContact O-CB 3.48Å; V101-L104 PolarHBondContact O-N 3.19Å; V102-L104 PolarHBondContact O-N 3.44Å; L104-V106 VanDerWaalsContact C-N 3.33Å; L104-V106 PolarHBondContact O-N 2.98Å; L104-M107 PolarHBondContact O-N 3.48Å; L104-M107 VanDerWaalsContact O-N 3.17Å; L104-Q108 HydrophobicContact CD1-CG 3.97Å; L104-Q108 HydrophobicContact CG-CG 4.03Å; L104-Q108 WeakPolarHBondContact O-CB 3.42Å; L104-Q108 WeakPolarHBondContact O-CG 3.24Å; L104-Q108 PolarHBondContact O-N 3.37Å; L104-F316 HydrophobicContact CD1-CD1 4.4Å; L104-F316 HydrophobicContact CD1-CE1 3.64Å; L104-F316 HydrophobicContact CD1-CZ 4.27Å; L104-M317 HydrophobicContact CD1-CE 4.16Å; L104-M317 HydrophobicContact CD1-SD 3.68Å; L104-M317 HydrophobicContact CD2-CE 3.98Å; L104-M317 HydrophobicContact CD2-SD 3.5Å; L104-M317 VanDerWaalsContact CD2-SD 3.5Å; L104-M317 HydrophobicContact CG-SD 4.26Å; L104-Y320 HydrophobicContact CB-CD1 4.09Å; L104-Y320 HydrophobicContact CB-CE1 3.69Å; L104-Y320 HydrophobicContact CD1-CD1 3.69Å; L104-Y320 HydrophobicContact CD1-CD2 4.25Å; L104-Y320 HydrophobicContact CD1-CE1 4.18Å; L104-Y320 HydrophobicContact CD1-CG 3.73Å; L104-Y320 HydrophobicContact CG-CD1 4.41Å; L104-Y320 HydrophobicContact CG-CE1 4.5Å; L104-Y320 PolarHBondContact N-OH 3.19Å; L104-H342 WeakPolarHBondContact CD2-NE2 3.46Å
105L97.1Very high96.4Very high52 Ų5246 Ų4627%0.27227%0.274SS..Hα-helixtrans-59.6-44-175.8-61.4175000111.6V101 V102 Q108 N109 S135V101-L105 HydrophobicContact CG1-CD1 4.22Å; V101-L105 HydrophobicContact CG1-CG 4.28Å; V101-L105 WeakPolarHBondContact O-CG 3.41Å; V101-L105 PolarHBondContact O-N 3.43Å; V102-L105 PolarHBondContact O-N 3.02Å; L105-Q108 PolarHBondContact O-N 3.38Å; L105-N109 WeakPolarHBondContact O-CB 3.33Å; L105-N109 VanDerWaalsContact O-CG 3.26Å; L105-N109 PolarHBondContact O-N 3.17Å; L105-N109 PolarHBondContact O-ND2 3.4Å; L105-S135 WeakPolarHBondContact CD2-OG 3.41Å
106V97.5Very high96.6Very high91 Ų9144.4 Ų44.455%0.55226%0.257SS*.Hα-helixtrans-60.6-47.6176.2172.20000110.7V102 L104 N109 A110V102-V106 WeakPolarHBondContact O-CG2 3.33Å; V102-V106 PolarHBondContact O-N 2.98Å; L104-V106 VanDerWaalsContact C-N 3.33Å; L104-V106 PolarHBondContact O-N 2.98Å; V106-N109 PolarHBondContact O-N 3.16Å; V106-A110 WeakPolarHBondContact O-CB 3.32Å; V106-A110 PolarHBondContact O-N 3.05Å
107M97.6Very high96.7Very high89 Ų8945.1 Ų45.144%0.43827%0.266SS..Hα-helixtrans-67.9-40.5-179.8-67.4-64.3-67.600112.6G103 L104 N109 A110 I111 F316G103-M107 VanDerWaalsContact O-CG 3.25Å; G103-M107 WeakPolarHBondContact O-CG 3.29Å; G103-M107 PolarHBondContact O-N 2.8Å; G103-M107 VanDerWaalsContact O-N 3.14Å; L104-M107 PolarHBondContact O-N 3.48Å; L104-M107 VanDerWaalsContact O-N 3.17Å; M107-N109 VanDerWaalsContact C-N 3.3Å; M107-N109 PolarHBondContact O-N 2.85Å; M107-A110 PolarHBondContact O-N 2.95Å; M107-I111 WeakPolarHBondContact O-CB 3.47Å; M107-I111 VanDerWaalsContact O-CG1 3.27Å; M107-I111 WeakPolarHBondContact O-CG1 3.12Å; M107-I111 PolarHBondContact O-N 2.96Å; M107-F316 HydrophobicContact CB-CE1 3.82Å; M107-F316 HydrophobicContact CB-CE2 4.26Å; M107-F316 HydrophobicContact CB-CZ 3.35Å; M107-F316 HydrophobicContact CE-CE2 4.44Å; M107-F316 HydrophobicContact CG-CZ 4.14Å
108Q97.3Very high96.9Very high0 Ų050.2 Ų50.20%030%0.295CS..Hα-helixtrans-60.4-40.7175-79.4-170.7-14.300111.5L104 L105 G112 S135 Q313 F316 G346L104-Q108 HydrophobicContact CD1-CG 3.97Å; L104-Q108 HydrophobicContact CG-CG 4.03Å; L104-Q108 WeakPolarHBondContact O-CB 3.42Å; L104-Q108 WeakPolarHBondContact O-CG 3.24Å; L104-Q108 PolarHBondContact O-N 3.37Å; L105-Q108 PolarHBondContact O-N 3.38Å; Q108-G112 PolarHBondContact O-N 3.43Å; Q108-S135 PolarHBondContact OE1-OG 2.83Å; Q108-Q313 PolarHBondContact O-NE2 3.32Å; Q108-F316 HydrophobicContact CG-CD1 4.26Å; Q108-F316 HydrophobicContact CG-CE1 4.01Å; Q108-G346 PolarHBondContact NE2-O 2.82Å
109N97.7Very high97Very high39 Ų3949 Ų4921%0.20929%0.288CS..Hα-helixtrans-67.8-43.5175.7-71.6-20.9000111.7L105 V106 M107 I111 G112 I113 L127 S131L105-N109 WeakPolarHBondContact O-CB 3.33Å; L105-N109 VanDerWaalsContact O-CG 3.26Å; L105-N109 PolarHBondContact O-N 3.17Å; L105-N109 PolarHBondContact O-ND2 3.4Å; V106-N109 PolarHBondContact O-N 3.16Å; M107-N109 VanDerWaalsContact C-N 3.3Å; M107-N109 PolarHBondContact O-N 2.85Å; N109-I111 PolarHBondContact O-N 3.01Å; N109-G112 PolarHBondContact O-N 3.28Å; N109-I113 VanDerWaalsContact O-CB 3.3Å; N109-I113 WeakPolarHBondContact O-CB 3.38Å; N109-I113 VanDerWaalsContact O-CG1 3.28Å; N109-I113 WeakPolarHBondContact O-CG1 3.26Å; N109-I113 PolarHBondContact O-N 3.48Å; N109-L127 HydrophobicContact CB-CD2 3.87Å; N109-S131 PolarHBondContact ND2-OG 3.13Å; N109-S131 VanDerWaalsContact OD1-CB 3.31Å; N109-S131 WeakPolarHBondContact OD1-CB 3.41Å; N109-S131 PolarHBondContact OD1-N 2.76Å; N109-S131 PolarHBondContact OD1-OG 3.28Å
110A97.9Very high96.9Very high59 Ų5946.9 Ų46.949%0.48829%0.294SS..Hα-helixtrans-60.7-45.2176.500000111.9V106 M107 G114V106-A110 WeakPolarHBondContact O-CB 3.32Å; V106-A110 PolarHBondContact O-N 3.05Å; M107-A110 PolarHBondContact O-N 2.95Å; A110-G114 PolarHBondContact O-N 3.23Å
111I97.8Very high96.7Very high37 Ų3748.5 Ų48.519%0.1930%0.303CS..Hα-helixtrans-65.3-45.8176.5-69.2166.1000110.7M107 N109 G114 M115 V312 F316M107-I111 WeakPolarHBondContact O-CB 3.47Å; M107-I111 VanDerWaalsContact O-CG1 3.27Å; M107-I111 WeakPolarHBondContact O-CG1 3.12Å; M107-I111 PolarHBondContact O-N 2.96Å; N109-I111 PolarHBondContact O-N 3.01Å; I111-G114 PolarHBondContact O-N 2.95Å; I111-M115 HydrophobicContact CG2-CG 4.25Å; I111-M115 WeakPolarHBondContact O-CB 3.37Å; I111-M115 VanDerWaalsContact O-CG 3.28Å; I111-M115 WeakPolarHBondContact O-CG 2.82Å; I111-M115 PolarHBondContact O-N 2.95Å; I111-V312 HydrophobicContact CG2-CG1 3.82Å; I111-F316 HydrophobicContact CD1-CB 3.95Å; I111-F316 HydrophobicContact CD1-CD1 3.48Å; I111-F316 VanDerWaalsContact CD1-CD1 3.48Å; I111-F316 HydrophobicContact CD1-CD2 3.45Å; I111-F316 VanDerWaalsContact CD1-CD2 3.45Å; I111-F316 HydrophobicContact CD1-CE1 3.79Å; I111-F316 HydrophobicContact CD1-CE2 3.78Å; I111-F316 HydrophobicContact CD1-CG 3.3Å; I111-F316 HydrophobicContact CD1-CZ 3.96Å
112G97.7Very high96.6Very high0 Ų050.8 Ų50.80%031%0.314CS..Hα-helixtrans-60.7-52-18000000111.9Q108 N109 M115 A116 G126Q108-G112 PolarHBondContact O-N 3.43Å; N109-G112 PolarHBondContact O-N 3.28Å; G112-M115 PolarHBondContact O-N 2.82Å; G112-A116 WeakPolarHBondContact O-CB 3.44Å; G112-A116 PolarHBondContact O-N 3.36Å; G112-G126 WeakPolarHBondContact CA-O 3.39Å; G112-G126 WeakPolarHBondContact O-CA 3.5Å
113I97.6Very high96.6Very high62 Ų6249.9 Ų49.932%0.31831%0.31SS..Hα-helixtrans-58.7-48.8174.8-71.4168.7000110.4N109 M115 A116 S117 P123 L127N109-I113 VanDerWaalsContact O-CB 3.3Å; N109-I113 WeakPolarHBondContact O-CB 3.38Å; N109-I113 VanDerWaalsContact O-CG1 3.28Å; N109-I113 WeakPolarHBondContact O-CG1 3.26Å; N109-I113 PolarHBondContact O-N 3.48Å; I113-M115 PolarHBondContact O-N 3.31Å; I113-A116 PolarHBondContact O-N 3.16Å; I113-S117 WeakPolarHBondContact O-CB 3.48Å; I113-S117 PolarHBondContact O-N 3.42Å; I113-S117 PolarHBondContact O-OG 3.18Å; I113-S117 VanDerWaalsContact O-OG 3.05Å; I113-P123 HydrophobicContact CG2-CB 4.21Å; I113-L127 HydrophobicContact CD1-CD2 3.7Å; I113-L127 HydrophobicContact CD1-CG 4Å; I113-L127 HydrophobicContact CG1-CD2 4.01Å; I113-L127 HydrophobicContact CG1-CG 3.95Å
114G97.8Very high96.5Very high30 Ų3049.9 Ų49.931%0.30930%0.304SS..Hα-helixtrans-59.3-47.5-178.700000112.4A110 I111 S117 L118A110-G114 PolarHBondContact O-N 3.23Å; I111-G114 PolarHBondContact O-N 2.95Å; G114-S117 PolarHBondContact O-N 3.44Å; G114-L118 WeakPolarHBondContact O-CB 3.47Å; G114-L118 VanDerWaalsContact O-CG 3.23Å; G114-L118 WeakPolarHBondContact O-CG 3.41Å; G114-L118 PolarHBondContact O-N 3.42Å
115M97.1Very high96.4Very high44 Ų4450 Ų5022%0.21730%0.304CS..Hα-helixtrans-67.2-40.7178.3-71.3-65.3-59.100112.5I111 G112 I113 L118 L119 I309 V312I111-M115 HydrophobicContact CG2-CG 4.25Å; I111-M115 WeakPolarHBondContact O-CB 3.37Å; I111-M115 VanDerWaalsContact O-CG 3.28Å; I111-M115 WeakPolarHBondContact O-CG 2.82Å; I111-M115 PolarHBondContact O-N 2.95Å; G112-M115 PolarHBondContact O-N 2.82Å; I113-M115 PolarHBondContact O-N 3.31Å; M115-L118 PolarHBondContact O-N 2.95Å; M115-L118 HydrophobicContact SD-CD1 4.45Å; M115-L119 WeakPolarHBondContact O-CB 3.5Å; M115-L119 VanDerWaalsContact O-CG 3.26Å; M115-L119 WeakPolarHBondContact O-CG 3.11Å; M115-L119 PolarHBondContact O-N 3.42Å; M115-I309 HydrophobicContact CB-CG1 3.85Å; M115-I309 HydrophobicContact CB-CG2 4.44Å; M115-V312 HydrophobicContact CE-CG2 3.88Å; M115-V312 HydrophobicContact CG-CG1 4.35Å; M115-V312 HydrophobicContact SD-CG1 4.46Å; M115-V312 HydrophobicContact SD-CG2 4.31Å
116A96.7Very high96.3Very high0 Ų047.5 Ų47.50%029%0.292CS..Hα-helixtrans-59.8-48.9175.200000110.8G112 I113 L118 L119 G120 L121 I309G112-A116 WeakPolarHBondContact O-CB 3.44Å; G112-A116 PolarHBondContact O-N 3.36Å; I113-A116 PolarHBondContact O-N 3.16Å; A116-L118 PolarHBondContact O-N 3.08Å; A116-L119 CarbonylContact O-C 2.79Å; A116-L119 PolarHBondContact O-N 3.21Å; A116-G120 PolarHBondContact O-N 3.07Å; A116-L121 HydrophobicContact CB-CB 4.3Å; A116-L121 WeakPolarHBondContact O-CB 3.26Å; A116-L121 PolarHBondContact O-N 3.16Å; A116-I309 HydrophobicContact CB-CD1 4.23Å
117S96.4Very high96.3Very high63 Ų6345 Ų4544%0.44128%0.275SS..Hα-helixtrans-60.6-42.2176.7-62.40000112.7I113 G114 L119 G120I113-S117 WeakPolarHBondContact O-CB 3.48Å; I113-S117 PolarHBondContact O-N 3.42Å; I113-S117 PolarHBondContact O-OG 3.18Å; I113-S117 VanDerWaalsContact O-OG 3.05Å; G114-S117 PolarHBondContact O-N 3.44Å; S117-L119 VanDerWaalsContact C-N 3.29Å; S117-L119 PolarHBondContact O-N 3.43Å; S117-G120 PolarHBondContact O-N 3.49Å; S117-G120 VanDerWaalsContact O-N 3.09Å
118L96.5Very high96.3Very high147 Ų14740.8 Ų40.877%0.7725%0.254SS*.Hα-helixtrans-64.2-32.8177.4-75.7171.7000112.9G114 M115 A116 G120G114-L118 WeakPolarHBondContact O-CB 3.47Å; G114-L118 VanDerWaalsContact O-CG 3.23Å; G114-L118 WeakPolarHBondContact O-CG 3.41Å; G114-L118 PolarHBondContact O-N 3.42Å; M115-L118 PolarHBondContact O-N 2.95Å; M115-L118 HydrophobicContact SD-CD1 4.45Å; A116-L118 PolarHBondContact O-N 3.08Å; L118-G120 PolarHBondContact O-N 3.37Å
119L95.2Very high96.2Very high79 Ų7940.8 Ų40.841%0.41425%0.254SS..THydrogen-bonded Turntrans-83.92.4176.4-66170.3000112.8M115 A116 S117 L121 P305 A308 I309M115-L119 WeakPolarHBondContact O-CB 3.5Å; M115-L119 VanDerWaalsContact O-CG 3.26Å; M115-L119 WeakPolarHBondContact O-CG 3.11Å; M115-L119 PolarHBondContact O-N 3.42Å; A116-L119 CarbonylContact O-C 2.79Å; A116-L119 PolarHBondContact O-N 3.21Å; S117-L119 VanDerWaalsContact C-N 3.29Å; S117-L119 PolarHBondContact O-N 3.43Å; L119-L121 VanDerWaalsContact C-N 3.33Å; L119-L121 HydrophobicContact CB-CD1 4.12Å; L119-L121 HydrophobicContact CB-CG 4.12Å; L119-P305 HydrophobicContact CD1-CB 4.15Å; L119-A308 HydrophobicContact CD1-CB 4.46Å; L119-I309 HydrophobicContact CD1-CD1 4.38Å; L119-I309 HydrophobicContact CD1-CG1 3.99Å
120G93.8Very high96.1Very high69 Ų6938.9 Ų38.971%0.71124%0.244SC*.THydrogen-bonded Turntrans72.324.8-178.600000113.9A116 S117 L118A116-G120 PolarHBondContact O-N 3.07Å; S117-G120 PolarHBondContact O-N 3.49Å; S117-G120 VanDerWaalsContact O-N 3.09Å; L118-G120 PolarHBondContact O-N 3.37Å
121L92.9Very high96Very high36 Ų3636.8 Ų36.819%0.18823%0.226CC..  trans-101.7165.7179.7-56.5173.9000111.6A116 L119 M125 L302 P305A116-L121 HydrophobicContact CB-CB 4.3Å; A116-L121 WeakPolarHBondContact O-CB 3.26Å; A116-L121 PolarHBondContact O-N 3.16Å; L119-L121 VanDerWaalsContact C-N 3.33Å; L119-L121 HydrophobicContact CB-CD1 4.12Å; L119-L121 HydrophobicContact CB-CG 4.12Å; L121-M125 HydrophobicContact CB-SD 4.19Å; L121-M125 HydrophobicContact CD1-CE 3.97Å; L121-M125 HydrophobicContact CD1-SD 3.45Å; L121-M125 WeakPolarHBondContact CD1-SD 3.38Å; L121-M125 HydrophobicContact CD2-SD 4.49Å; L121-M125 HydrophobicContact CG-SD 4.25Å; L121-L302 HydrophobicContact CD2-CD2 4.12Å; L121-P305 HydrophobicContact CD1-CB 3.33Å; L121-P305 HydrophobicContact CD1-CG 4.21Å; L121-P305 HydrophobicContact CG-CB 4.37Å
122D93.5Very high95.9Very high69 Ų6935.8 Ų35.837%0.36922%0.221SC..  trans-62.2126.9173.8-165.8-52.4000111.1L124 M125 F154D122-L124 PolarHBondContact O-N 3.43Å; D122-L124 VanDerWaalsContact O-N 3.09Å; D122-L124 WeakPolarHBondContact OD1-CB 3.13Å; D122-L124 VanDerWaalsContact OD1-CG 3.26Å; D122-L124 WeakPolarHBondContact OD1-CG 3.25Å; D122-L124 PolarHBondContact OD1-N 3.19Å; D122-M125 WeakPolarHBondContact O-CB 3.17Å; D122-M125 PolarHBondContact O-N 3.27Å; D122-F154 HydrophobicContact CB-CD2 4.29Å; D122-F154 HydrophobicContact CB-CE2 4.19Å
123P95.7Very high95.8Very high56 Ų5635.8 Ų35.836%0.36422%0.221SC..Hα-helixtrans-52-28.8175-30.938.2000115.1I113 M125 G126 L127I113-P123 HydrophobicContact CG2-CB 4.21Å; P123-M125 VanDerWaalsContact C-N 3.27Å; P123-M125 PolarHBondContact O-N 3.08Å; P123-G126 WeakPolarHBondContact O-CA 3.32Å; P123-G126 PolarHBondContact O-N 2.9Å; P123-L127 PolarHBondContact O-N 3.47Å; P123-L127 VanDerWaalsContact O-N 3.13Å
124L95.3Very high95.7Very high26 Ų2632.9 Ų32.914%0.13621%0.206CC..Hα-helixtrans-63.6-33.5175.3-63176.5000111.9D122 G126 L127 L128 F148 Y152 F154D122-L124 PolarHBondContact O-N 3.43Å; D122-L124 VanDerWaalsContact O-N 3.09Å; D122-L124 WeakPolarHBondContact OD1-CB 3.13Å; D122-L124 VanDerWaalsContact OD1-CG 3.26Å; D122-L124 WeakPolarHBondContact OD1-CG 3.25Å; D122-L124 PolarHBondContact OD1-N 3.19Å; L124-G126 PolarHBondContact O-N 3.43Å; L124-L127 HydrophobicContact CD2-CD1 4.15Å; L124-L127 PolarHBondContact O-N 2.98Å; L124-L128 PolarHBondContact O-N 2.93Å; L124-F148 HydrophobicContact CB-CD2 3.93Å; L124-F148 HydrophobicContact CB-CE2 3.96Å; L124-F148 HydrophobicContact CD2-CD1 4.48Å; L124-F148 HydrophobicContact CD2-CD2 4.3Å; L124-F148 HydrophobicContact CD2-CE1 4.17Å; L124-F148 HydrophobicContact CD2-CE2 3.98Å; L124-F148 HydrophobicContact CD2-CZ 3.92Å; L124-Y152 VanDerWaalsContact CD1-CB 3.43Å; L124-Y152 HydrophobicContact CD1-CD1 4.31Å; L124-Y152 HydrophobicContact CD1-CD2 4.47Å; L124-Y152 HydrophobicContact CD1-CG 3.85Å; L124-F154 HydrophobicContact CB-CD1 4.32Å; L124-F154 HydrophobicContact CD1-CB 4.15Å
125M95Very high95.5Very high2 Ų232.6 Ų32.61%0.0120%0.199CC..Hα-helixtrans-60.7-39.6170.8-171.9-179.5169.500110.6L121 D122 P123 L128 A129 F154 V160 L302 M306L121-M125 HydrophobicContact CB-SD 4.19Å; L121-M125 HydrophobicContact CD1-CE 3.97Å; L121-M125 HydrophobicContact CD1-SD 3.45Å; L121-M125 WeakPolarHBondContact CD1-SD 3.38Å; L121-M125 HydrophobicContact CD2-SD 4.49Å; L121-M125 HydrophobicContact CG-SD 4.25Å; D122-M125 WeakPolarHBondContact O-CB 3.17Å; D122-M125 PolarHBondContact O-N 3.27Å; P123-M125 VanDerWaalsContact C-N 3.27Å; P123-M125 PolarHBondContact O-N 3.08Å; M125-L128 PolarHBondContact O-N 3.32Å; M125-A129 WeakPolarHBondContact O-CB 3.39Å; M125-A129 PolarHBondContact O-N 2.78Å; M125-F154 HydrophobicContact CB-CE1 4.18Å; M125-F154 HydrophobicContact CB-CZ 3.74Å; M125-F154 HydrophobicContact CG-CZ 4.14Å; M125-V160 HydrophobicContact CG-CG1 3.93Å; M125-V160 HydrophobicContact CG-CG2 4.41Å; M125-L302 HydrophobicContact CE-CB 3.92Å; M125-L302 HydrophobicContact CE-CD2 4.41Å; M125-L302 HydrophobicContact SD-CD1 4.37Å; M125-L302 HydrophobicContact SD-CD2 4.03Å; M125-M306 HydrophobicContact CE-CB 3.59Å; M125-M306 HydrophobicContact CE-CG 4.24Å
126G96.3Very high95.3Very high0 Ų031.9 Ų31.90%020%0.203CC..Hα-helixtrans-62.5-38.617600000113.5G112 P123 L124 A129 G130G112-G126 WeakPolarHBondContact CA-O 3.39Å; G112-G126 WeakPolarHBondContact O-CA 3.5Å; P123-G126 WeakPolarHBondContact O-CA 3.32Å; P123-G126 PolarHBondContact O-N 2.9Å; L124-G126 PolarHBondContact O-N 3.43Å; G126-A129 CarbonylContact O-C 3.47Å; G126-A129 PolarHBondContact O-N 3.48Å; G126-G130 PolarHBondContact O-N 3.02Å
127L96.8Very high95.1Very high38 Ų3832.1 Ų32.120%0.19921%0.205CC..Hα-helixtrans-65.9-42.8173.6-73.4174.6000112.1N109 I113 P123 L124 G130 I132 F148N109-L127 HydrophobicContact CB-CD2 3.87Å; I113-L127 HydrophobicContact CD1-CD2 3.7Å; I113-L127 HydrophobicContact CD1-CG 4Å; I113-L127 HydrophobicContact CG1-CD2 4.01Å; I113-L127 HydrophobicContact CG1-CG 3.95Å; P123-L127 PolarHBondContact O-N 3.47Å; P123-L127 VanDerWaalsContact O-N 3.13Å; L124-L127 HydrophobicContact CD2-CD1 4.15Å; L124-L127 PolarHBondContact O-N 2.98Å; L127-G130 CarbonylContact O-C 3.6Å; L127-G130 PolarHBondContact O-N 3.45Å; L127-G130 VanDerWaalsContact O-N 3.12Å; L127-I132 HydrophobicContact CB-CD1 3.84Å; L127-I132 WeakPolarHBondContact O-CB 3.47Å; L127-F148 HydrophobicContact CB-CE2 4.28Å; L127-F148 HydrophobicContact CB-CZ 4.38Å; L127-F148 HydrophobicContact CD1-CZ 4.1Å
128L96.6Very high94.9Very high0 Ų029.8 Ų29.80%019%0.187CC..Iπ-helixtrans-66.6-40.2174.8-67.1-179.9000111.7L124 M125 G130 I132 T133 F148 F154 A157 V160 A161L124-L128 PolarHBondContact O-N 2.93Å; M125-L128 PolarHBondContact O-N 3.32Å; L128-G130 PolarHBondContact O-N 2.86Å; L128-I132 HydrophobicContact CD2-CB 4.43Å; L128-I132 HydrophobicContact CD2-CD1 4.37Å; L128-I132 HydrophobicContact CD2-CG2 3.87Å; L128-T133 VanDerWaalsContact O-CB 3.28Å; L128-T133 WeakPolarHBondContact O-CB 3.22Å; L128-T133 WeakPolarHBondContact O-CG2 3.28Å; L128-T133 PolarHBondContact O-OG1 2.87Å; L128-F148 HydrophobicContact CD1-CD2 4.1Å; L128-F148 HydrophobicContact CD2-CD2 4.04Å; L128-F148 HydrophobicContact CD2-CE2 3.91Å; L128-F148 HydrophobicContact CG-CD2 3.94Å; L128-F148 HydrophobicContact CG-CE2 3.86Å; L128-F154 HydrophobicContact CD1-CD1 4.19Å; L128-F154 HydrophobicContact CD1-CE1 3.86Å; L128-A157 HydrophobicContact CD1-CB 3.88Å; L128-A157 WeakPolarHBondContact CD1-O 3.37Å; L128-V160 HydrophobicContact CB-CG1 3.85Å; L128-V160 HydrophobicContact CD1-CB 4.15Å; L128-V160 HydrophobicContact CD1-CG1 4.05Å; L128-A161 HydrophobicContact CD1-CB 4.38Å; L128-A161 HydrophobicContact CD2-CB 4.15Å
129A95.8Very high94.6Very high0 Ų023 Ų230%015%0.154CC..Iπ-helixtrans-78.911.2172.200000113.4M125 G126 L134 C164 I309 Q313M125-A129 WeakPolarHBondContact O-CB 3.39Å; M125-A129 PolarHBondContact O-N 2.78Å; G126-A129 CarbonylContact O-C 3.47Å; G126-A129 PolarHBondContact O-N 3.48Å; A129-L134 WeakPolarHBondContact O-CD1 3.46Å; A129-C164 VanDerWaalsContact CA-SG 3.59Å; A129-I309 HydrophobicContact CB-CB 4.33Å; A129-I309 HydrophobicContact CB-CD1 4.46Å; A129-I309 HydrophobicContact CB-CG2 3.73Å; A129-Q313 PolarHBondContact O-NE2 2.88Å
130G96.3Very high94.5Very high0 Ų020.8 Ų20.80%014%0.143CC..Iπ-helixtrans-121.8-138.5176.100000110.7G126 L127 L128 I132 T133 L134G126-G130 PolarHBondContact O-N 3.02Å; L127-G130 CarbonylContact O-C 3.6Å; L127-G130 PolarHBondContact O-N 3.45Å; L127-G130 VanDerWaalsContact O-N 3.12Å; L128-G130 PolarHBondContact O-N 2.86Å; G130-I132 VanDerWaalsContact C-N 3.26Å; G130-I132 PolarHBondContact O-N 2.9Å; G130-I132 VanDerWaalsContact O-N 3.14Å; G130-T133 PolarHBondContact O-N 2.95Å; G130-L134 VanDerWaalsContact O-CB 3.22Å; G130-L134 WeakPolarHBondContact O-CB 3.45Å; G130-L134 VanDerWaalsContact O-CG 3.28Å; G130-L134 WeakPolarHBondContact O-CG 3.31Å; G130-L134 PolarHBondContact O-N 3.42Å
131S96Very high94.5Very high15 Ų1517.5 Ų17.511%0.10511%0.109CC..Iπ-helixtrans-61.6-30.1-167.369.70000114.6N109 T133 S135 G136N109-S131 PolarHBondContact ND2-OG 3.13Å; N109-S131 VanDerWaalsContact OD1-CB 3.31Å; N109-S131 WeakPolarHBondContact OD1-CB 3.41Å; N109-S131 PolarHBondContact OD1-N 2.76Å; N109-S131 PolarHBondContact OD1-OG 3.28Å; S131-T133 VanDerWaalsContact C-N 3.26Å; S131-T133 PolarHBondContact O-N 3.45Å; S131-S135 WeakPolarHBondContact O-CB 3.41Å; S131-S135 PolarHBondContact O-N 3.41Å; S131-G136 PolarHBondContact O-N 2.81Å
132I95.7Very high94.5Very high16 Ų1615.8 Ų15.88%0.08210%0.1CC..Iπ-helixtrans-57.6-41.3-176.2-65.8-177000111.1L127 L128 G130 G136 T140 W144 F148L127-I132 HydrophobicContact CB-CD1 3.84Å; L127-I132 WeakPolarHBondContact O-CB 3.47Å; L128-I132 HydrophobicContact CD2-CB 4.43Å; L128-I132 HydrophobicContact CD2-CD1 4.37Å; L128-I132 HydrophobicContact CD2-CG2 3.87Å; G130-I132 VanDerWaalsContact C-N 3.26Å; G130-I132 PolarHBondContact O-N 2.9Å; G130-I132 VanDerWaalsContact O-N 3.14Å; I132-G136 VanDerWaalsContact O-CA 3.32Å; I132-G136 WeakPolarHBondContact O-CA 3.49Å; I132-T140 HydrophobicContact CG2-CG2 4.28Å; I132-T140 WeakPolarHBondContact O-CB 2.83Å; I132-T140 WeakPolarHBondContact O-CG2 3.29Å; I132-W144 HydrophobicContact CD1-CB 4.24Å; I132-W144 HydrophobicContact CD1-CD2 4.22Å; I132-W144 HydrophobicContact CD1-CG 4.07Å; I132-W144 HydrophobicContact CG2-CB 3.7Å; I132-W144 HydrophobicContact CG2-CG 3.81Å; I132-F148 HydrophobicContact CD1-CE2 4.09Å; I132-F148 HydrophobicContact CD1-CZ 3.71Å
133T95.3Very high94.4Very high0 Ų012.6 Ų12.60%08%0.083CC..Hα-helixtrans-104.2-39.2179.368.70000112.6L128 G130 S131 S135 G137 A161 C164L128-T133 VanDerWaalsContact O-CB 3.28Å; L128-T133 WeakPolarHBondContact O-CB 3.22Å; L128-T133 WeakPolarHBondContact O-CG2 3.28Å; L128-T133 PolarHBondContact O-OG1 2.87Å; G130-T133 PolarHBondContact O-N 2.95Å; S131-T133 VanDerWaalsContact C-N 3.26Å; S131-T133 PolarHBondContact O-N 3.45Å; T133-S135 VanDerWaalsContact C-N 3.34Å; T133-S135 PolarHBondContact O-N 3.24Å; T133-G137 VanDerWaalsContact O-CA 3.23Å; T133-G137 WeakPolarHBondContact O-CA 3.38Å; T133-G137 PolarHBondContact O-N 3.21Å; T133-A161 HydrophobicContact CG2-CB 3.97Å; T133-A161 WeakPolarHBondContact CG2-O 3.42Å; T133-C164 HydrophobicContact CG2-CB 4.2Å; T133-C164 WeakPolarHBondContact OG1-CB 3.49Å
134L95.8Very high94.4Very high1 Ų113.4 Ų13.41%0.0058%0.079CC..Hα-helixtrans-70.9-32.8-174.3-63.3-176.6000112A129 G130 L310 Q313 G346 L347 G348A129-L134 WeakPolarHBondContact O-CD1 3.46Å; G130-L134 VanDerWaalsContact O-CB 3.22Å; G130-L134 WeakPolarHBondContact O-CB 3.45Å; G130-L134 VanDerWaalsContact O-CG 3.28Å; G130-L134 WeakPolarHBondContact O-CG 3.31Å; G130-L134 PolarHBondContact O-N 3.42Å; L134-L310 HydrophobicContact CD1-CD2 4.32Å; L134-L310 HydrophobicContact CD2-CD2 3.77Å; L134-L310 HydrophobicContact CG-CD2 4.48Å; L134-Q313 HydrophobicContact CD1-CB 3.66Å; L134-Q313 HydrophobicContact CD1-CG 3.75Å; L134-G346 CarbonylContact C-O 3.4Å; L134-G346 CarbonylContact O-C 3.57Å; L134-L347 HydrophobicContact CB-CD2 4.48Å; L134-L347 HydrophobicContact CD1-CD2 3.98Å; L134-L347 HydrophobicContact CD2-CD2 4.38Å; L134-L347 CarbonylContact O-C 3.51Å; L134-L347 WeakPolarHBondContact O-CA 3.27Å; L134-L347 PolarHBondContact O-N 3.12Å; L134-G348 PolarHBondContact O-N 3.15Å
135S93.5Very high94.3Very high24 Ų2412.1 Ų12.117%0.1687%0.073CC..THydrogen-bonded Turntrans-105.2-33.3173-630000112.9L105 Q108 S131 T133 F345L105-S135 WeakPolarHBondContact CD2-OG 3.41Å; Q108-S135 PolarHBondContact OE1-OG 2.83Å; S131-S135 WeakPolarHBondContact O-CB 3.41Å; S131-S135 PolarHBondContact O-N 3.41Å; T133-S135 VanDerWaalsContact C-N 3.34Å; T133-S135 PolarHBondContact O-N 3.24Å; S135-F345 WeakPolarHBondContact CA-O 3.39Å
136G91.9Very high94.1Very high29 Ų2914 Ų1430%0.2998%0.081SC..THydrogen-bonded Turntrans-83.5-15.4-178.300000115.4S131 I132 T140S131-G136 PolarHBondContact O-N 2.81Å; I132-G136 VanDerWaalsContact O-CA 3.32Å; I132-G136 WeakPolarHBondContact O-CA 3.49Å; G136-T140 WeakPolarHBondContact O-CB 3.23Å; G136-T140 PolarHBondContact O-OG1 2.94Å
137G92.7Very high93.8Very high5 Ų515.3 Ų15.35%0.0529%0.088CC..Hα-helixtrans68.1-171.8-177.400000114.5T133 G139 T140 G141T133-G137 VanDerWaalsContact O-CA 3.23Å; T133-G137 WeakPolarHBondContact O-CA 3.38Å; T133-G137 PolarHBondContact O-N 3.21Å; G137-G139 PolarHBondContact O-N 3.22Å; G137-T140 PolarHBondContact O-N 3.14Å; G137-G141 PolarHBondContact O-N 3.33Å
138H91.7Very high93.7Very high13 Ų1313.9 Ų13.96%0.068%0.08CC..Hα-helixtrans-60.2-40.6-176.1-58.674.5000113.4V39 G141 A142 M162 A165 T166 L287V39-H138 VanDerWaalsContact CG2-CD2 3.48Å; V39-H138 WeakPolarHBondContact CG2-CD2 3.16Å; H138-G141 PolarHBondContact O-N 3.25Å; H138-A142 VanDerWaalsContact O-CB 3.29Å; H138-A142 WeakPolarHBondContact O-CB 3.04Å; H138-A142 PolarHBondContact O-N 3Å; H138-M162 HydrophobicContact CB-CE 4.49Å; H138-M162 WeakPolarHBondContact O-CE 3.46Å; H138-A165 HydrophobicContact CB-CB 4.37Å; H138-T166 PolarHBondContact NE2-N 3.34Å; H138-T166 PolarHBondContact NE2-OG1 3.42Å; H138-L287 HydrophobicContact CB-CD1 3.79Å; H138-L287 HydrophobicContact CB-CD2 3.87Å
139G90.5Very high93.6Very high6 Ų616.8 Ų16.86%0.06210%0.095CC..Hα-helixtrans-62.4-46.6-178.700000112.6G137 A143G137-G139 PolarHBondContact O-N 3.22Å; G139-A143 WeakPolarHBondContact O-CB 3.17Å; G139-A143 PolarHBondContact O-N 2.87Å; G139-A143 VanDerWaalsContact O-N 3.15Å
140T93.1Very high93.3Very high31 Ų3123 Ų2319%0.1912%0.124CC..Hα-helixtrans-67.9-45.2176.5-530000111.2I132 G136 G137 A142 A143 W144I132-T140 HydrophobicContact CG2-CG2 4.28Å; I132-T140 WeakPolarHBondContact O-CB 2.83Å; I132-T140 WeakPolarHBondContact O-CG2 3.29Å; G136-T140 WeakPolarHBondContact O-CB 3.23Å; G136-T140 PolarHBondContact O-OG1 2.94Å; G137-T140 PolarHBondContact O-N 3.14Å; T140-A142 PolarHBondContact O-N 3.07Å; T140-A143 PolarHBondContact O-N 3.41Å; T140-W144 VanDerWaalsContact O-CD1 3.28Å; T140-W144 PolarHBondContact O-N 2.54Å
141G94.5Very high93Very high0 Ų030 Ų300%015%0.15CC..Hα-helixtrans-53.1-49.8173.800000113.6G137 H138 A143 S145 A161G137-G141 PolarHBondContact O-N 3.33Å; H138-G141 PolarHBondContact O-N 3.25Å; G141-A143 VanDerWaalsContact C-N 3.33Å; G141-A143 PolarHBondContact O-N 3.25Å; G141-S145 VanDerWaalsContact O-CB 3.28Å; G141-S145 WeakPolarHBondContact O-CB 3.35Å; G141-S145 PolarHBondContact O-N 3.12Å; G141-A161 WeakPolarHBondContact O-CB 3.47Å
142A92.2Very high92.9Very high0 Ų036.2 Ų36.20%017%0.172CC..Hα-helixtrans-68.3-30-179.500000113.7H138 T140 S145 K146 M162 F286 L287H138-A142 VanDerWaalsContact O-CB 3.29Å; H138-A142 WeakPolarHBondContact O-CB 3.04Å; H138-A142 PolarHBondContact O-N 3Å; T140-A142 PolarHBondContact O-N 3.07Å; A142-S145 WeakPolarHBondContact CA-OG 3.43Å; A142-S145 PolarHBondContact O-OG 2.96Å; A142-K146 PolarHBondContact O-N 3.3Å; A142-M162 HydrophobicContact CB-CE 3.49Å; A142-M162 VanDerWaalsContact CB-CE 3.49Å; A142-F286 HydrophobicContact CB-CE1 3.39Å; A142-F286 HydrophobicContact CB-CE2 4.25Å; A142-F286 HydrophobicContact CB-CZ 3.17Å; A142-L287 HydrophobicContact CB-CD2 4.16Å
143A92.4Very high92.7Very high2 Ų237.9 Ų37.92%0.01719%0.193CC..Hα-helixtrans-75-45.317800000111.8M71 F75 G139 T140 G141 S145 K146 L147 F248M71-A143 HydrophobicContact CG-CB 4.24Å; M71-A143 WeakPolarHBondContact SD-CA 3.28Å; M71-A143 HydrophobicContact SD-CB 3.54Å; M71-A143 VanDerWaalsContact SD-CB 3.54Å; F75-A143 HydrophobicContact CE2-CB 3.63Å; F75-A143 HydrophobicContact CZ-CB 3.95Å; G139-A143 WeakPolarHBondContact O-CB 3.17Å; G139-A143 PolarHBondContact O-N 2.87Å; G139-A143 VanDerWaalsContact O-N 3.15Å; T140-A143 PolarHBondContact O-N 3.41Å; G141-A143 VanDerWaalsContact C-N 3.33Å; G141-A143 PolarHBondContact O-N 3.25Å; A143-S145 VanDerWaalsContact C-N 3.35Å; A143-K146 PolarHBondContact O-N 3.12Å; A143-L147 PolarHBondContact O-N 2.77Å; A143-F248 HydrophobicContact CB-CD1 3.79Å; A143-F248 HydrophobicContact CB-CD2 4.27Å; A143-F248 HydrophobicContact CB-CE1 3.84Å; A143-F248 HydrophobicContact CB-CE2 4.33Å; A143-F248 HydrophobicContact CB-CG 4.02Å; A143-F248 HydrophobicContact CB-CZ 4.14Å
144W94.6Very high92.6Very high73 Ų7339 Ų3928%0.27720%0.198SC..Hα-helixtrans-68.4-33.8173.7-78.9100.2000112.4I132 T140 K146 L147 F148 P246 F248I132-W144 HydrophobicContact CD1-CB 4.24Å; I132-W144 HydrophobicContact CD1-CD2 4.22Å; I132-W144 HydrophobicContact CD1-CG 4.07Å; I132-W144 HydrophobicContact CG2-CB 3.7Å; I132-W144 HydrophobicContact CG2-CG 3.81Å; T140-W144 VanDerWaalsContact O-CD1 3.28Å; T140-W144 PolarHBondContact O-N 2.54Å; W144-K146 VanDerWaalsContact C-N 3.27Å; W144-K146 PolarHBondContact O-N 2.96Å; W144-L147 HydrophobicContact CE3-CD2 3.61Å; W144-L147 HydrophobicContact CH2-CD2 4.47Å; W144-L147 HydrophobicContact CZ3-CD2 3.47Å; W144-L147 VanDerWaalsContact CZ3-CD2 3.47Å; W144-L147 WeakPolarHBondContact O-CB 3.43Å; W144-L147 PolarHBondContact O-N 3.35Å; W144-L147 VanDerWaalsContact O-N 3.12Å; W144-F148 HydrophobicContact CE3-CD1 4.35Å; W144-F148 AromaticContact CE3-CE1 3.64Å; W144-F148 HydrophobicContact CE3-CE1 3.64Å; W144-F148 HydrophobicContact CE3-CZ 4.24Å; W144-F148 HydrophobicContact CZ3-CE1 4.21Å; W144-F148 WeakPolarHBondContact O-CD1 3.49Å; W144-F148 WeakPolarHBondContact O-CG 3.28Å; W144-F148 PolarHBondContact O-N 3.22Å; W144-P246 HydrophobicContact CH2-CG 3.92Å; W144-P246 HydrophobicContact CZ2-CG 4.36Å; W144-P246 HydrophobicContact CZ3-CG 4.19Å; W144-F248 AromaticContact CD1-CZ 3.81Å; W144-F248 HydrophobicContact CD2-CZ 4.1Å; W144-F248 AromaticContact CE2-CZ 3.71Å; W144-F248 HydrophobicContact CG-CZ 4.19Å; W144-F248 HydrophobicContact CZ2-CZ 4.2Å; W144-F248 AromaticContact NE1-CZ 3.54Å
145S93.5Very high92.3Very high0 Ų043.4 Ų43.40%023%0.225CC..Hα-helixtrans-60.4-39.7177.775.40000112.2G141 A142 A143 F148 I149 A157 T158G141-S145 VanDerWaalsContact O-CB 3.28Å; G141-S145 WeakPolarHBondContact O-CB 3.35Å; G141-S145 PolarHBondContact O-N 3.12Å; A142-S145 WeakPolarHBondContact CA-OG 3.43Å; A142-S145 PolarHBondContact O-OG 2.96Å; A143-S145 VanDerWaalsContact C-N 3.35Å; S145-F148 PolarHBondContact O-N 3.46Å; S145-I149 WeakPolarHBondContact O-CD1 3.45Å; S145-I149 VanDerWaalsContact O-CG1 3.26Å; S145-I149 WeakPolarHBondContact O-CG1 3.47Å; S145-I149 PolarHBondContact O-N 3.49Å; S145-A157 VanDerWaalsContact CB-C 3.41Å; S145-A157 WeakPolarHBondContact CB-O 3.5Å; S145-A157 WeakPolarHBondContact O-CB 3.31Å; S145-T158 PolarHBondContact OG-OG1 3.4Å
146K90.2Very high92.1Very high42 Ų4243.3 Ų43.318%0.18322%0.223CC..Hα-helixtrans-58.7-49.1173.8-175.6-175171.6-176.10111.1D68 A142 A143 W144 F148 I149 E150D68-K146 WeakPolarHBondContact OD1-CD 3.36Å; D68-K146 WeakPolarHBondContact OD1-CE 3.21Å; D68-K146 IonicContact OD1-NZ 3.79Å; D68-K146 PolarHBondContact OD1-NZ 3.43Å; D68-K146 IonicContact OD2-NZ 2.73Å; D68-K146 PolarHBondContact OD2-NZ 3.29Å; A142-K146 PolarHBondContact O-N 3.3Å; A143-K146 PolarHBondContact O-N 3.12Å; W144-K146 VanDerWaalsContact C-N 3.27Å; W144-K146 PolarHBondContact O-N 2.96Å; K146-F148 VanDerWaalsContact C-N 3.31Å; K146-F148 PolarHBondContact O-N 3.24Å; K146-I149 PolarHBondContact O-N 2.75Å; K146-E150 WeakPolarHBondContact CE-OE1 3.42Å; K146-E150 WeakPolarHBondContact CE-OE2 3.28Å; K146-E150 HydrophobicContact CG-CG 4.46Å; K146-E150 IonicContact NZ-OE1 2.62Å; K146-E150 WeakPolarHBondContact O-CG 3.42Å; K146-E150 PolarHBondContact O-N 3.01Å
147L91.6Very high92.2Very high27 Ų2742 Ų4214%0.14121%0.209CC..Hα-helixtrans-60.8-41178.1-171.974.7000111.9A143 W144 E150 R151 P246A143-L147 PolarHBondContact O-N 2.77Å; W144-L147 HydrophobicContact CE3-CD2 3.61Å; W144-L147 HydrophobicContact CH2-CD2 4.47Å; W144-L147 HydrophobicContact CZ3-CD2 3.47Å; W144-L147 VanDerWaalsContact CZ3-CD2 3.47Å; W144-L147 WeakPolarHBondContact O-CB 3.43Å; W144-L147 PolarHBondContact O-N 3.35Å; W144-L147 VanDerWaalsContact O-N 3.12Å; L147-E150 PolarHBondContact O-N 3.36Å; L147-R151 HydrophobicContact CD1-CG 3.98Å; L147-R151 HydrophobicContact CG-CG 4.49Å; L147-R151 WeakPolarHBondContact O-CB 3.42Å; L147-R151 PolarHBondContact O-N 3.42Å; L147-P246 HydrophobicContact CD2-CB 4.41Å; L147-P246 HydrophobicContact CD2-CG 3.82Å
148F94.8Very high92.2Very high7 Ų742.1 Ų42.13%0.03121%0.209CC..Hα-helixtrans-66-37.7179.4-74.17.8000112.2L124 L127 L128 I132 W144 S145 K146 Y152 G153 F154 A157L124-F148 HydrophobicContact CB-CD2 3.93Å; L124-F148 HydrophobicContact CB-CE2 3.96Å; L124-F148 HydrophobicContact CD2-CD1 4.48Å; L124-F148 HydrophobicContact CD2-CD2 4.3Å; L124-F148 HydrophobicContact CD2-CE1 4.17Å; L124-F148 HydrophobicContact CD2-CE2 3.98Å; L124-F148 HydrophobicContact CD2-CZ 3.92Å; L127-F148 HydrophobicContact CB-CE2 4.28Å; L127-F148 HydrophobicContact CB-CZ 4.38Å; L127-F148 HydrophobicContact CD1-CZ 4.1Å; L128-F148 HydrophobicContact CD1-CD2 4.1Å; L128-F148 HydrophobicContact CD2-CD2 4.04Å; L128-F148 HydrophobicContact CD2-CE2 3.91Å; L128-F148 HydrophobicContact CG-CD2 3.94Å; L128-F148 HydrophobicContact CG-CE2 3.86Å; I132-F148 HydrophobicContact CD1-CE2 4.09Å; I132-F148 HydrophobicContact CD1-CZ 3.71Å; W144-F148 HydrophobicContact CE3-CD1 4.35Å; W144-F148 AromaticContact CE3-CE1 3.64Å; W144-F148 HydrophobicContact CE3-CE1 3.64Å; W144-F148 HydrophobicContact CE3-CZ 4.24Å; W144-F148 HydrophobicContact CZ3-CE1 4.21Å; W144-F148 WeakPolarHBondContact O-CD1 3.49Å; W144-F148 WeakPolarHBondContact O-CG 3.28Å; W144-F148 PolarHBondContact O-N 3.22Å; S145-F148 PolarHBondContact O-N 3.46Å; K146-F148 VanDerWaalsContact C-N 3.31Å; K146-F148 PolarHBondContact O-N 3.24Å; F148-Y152 HydrophobicContact CD1-CD2 4.14Å; F148-Y152 HydrophobicContact CD1-CE2 4.38Å; F148-Y152 CarbonylContact O-C 3.15Å; F148-Y152 WeakPolarHBondContact O-CA 3.2Å; F148-Y152 WeakPolarHBondContact O-CB 3.37Å; F148-Y152 PolarHBondContact O-N 2.59Å; F148-Y152 VanDerWaalsContact O-N 3.12Å; F148-G153 PolarHBondContact O-N 3.12Å; F148-G153 VanDerWaalsContact O-N 3.08Å; F148-F154 HydrophobicContact CB-CB 4.36Å; F148-F154 PolarHBondContact O-N 2.91Å; F148-F154 VanDerWaalsContact O-N 3.16Å; F148-A157 HydrophobicContact CB-CB 3.97Å
149I93.2Very high92.2Very high62 Ų6242.1 Ų42.132%0.31821%0.209SC..Hα-helixtrans-66.3-52.2173.5-68160.7000110.4S145 K146 G153 F154 A157 T158S145-I149 WeakPolarHBondContact O-CD1 3.45Å; S145-I149 VanDerWaalsContact O-CG1 3.26Å; S145-I149 WeakPolarHBondContact O-CG1 3.47Å; S145-I149 PolarHBondContact O-N 3.49Å; K146-I149 PolarHBondContact O-N 2.75Å; I149-G153 WeakPolarHBondContact O-CA 3.22Å; I149-G153 PolarHBondContact O-N 3.26Å; I149-F154 WeakPolarHBondContact CG1-O 3.31Å; I149-A157 HydrophobicContact CD1-CB 4.2Å; I149-A157 HydrophobicContact CG1-CB 3.89Å; I149-T158 WeakPolarHBondContact CD1-OG1 3.47Å
150E90.4Very high92.3Very high131 Ų13141.8 Ų41.861%0.61221%0.206SC*.Hα-helixtrans-71.8-36.6-171.5-70.8177.6166.700113.8K146 L147K146-E150 WeakPolarHBondContact CE-OE1 3.42Å; K146-E150 WeakPolarHBondContact CE-OE2 3.28Å; K146-E150 HydrophobicContact CG-CG 4.46Å; K146-E150 IonicContact NZ-OE1 2.62Å; K146-E150 WeakPolarHBondContact O-CG 3.42Å; K146-E150 PolarHBondContact O-N 3.01Å; L147-E150 PolarHBondContact O-N 3.36Å
151R90.1Very high92.4Very high145 Ų14540.3 Ų40.355%0.54720%0.197SC..Hα-helixtrans-101.1-29.7-175.3-66.4-160.1177.9-141.21.9114.8L147 E244L147-R151 HydrophobicContact CD1-CG 3.98Å; L147-R151 HydrophobicContact CG-CG 4.49Å; L147-R151 WeakPolarHBondContact O-CB 3.42Å; L147-R151 PolarHBondContact O-N 3.42Å; R151-E244 IonicContact CZ-OE1 2.81Å; R151-E244 IonicContact NH1-OE1 3.08Å; R151-E244 PolarHBondContact NH1-OE1 3.48Å; R151-E244 IonicContact NH1-OE2 3.67Å; R151-E244 IonicContact NH2-OE1 3.81Å; R151-E244 PolarHBondContact NH2-OE1 2.77Å
152Y93.3Very high92.3Very high146 Ų14640.6 Ų40.657%0.57320%0.198SC*.Hα-helixtrans-118-4.3-172.6-58.2-87.1000113L124 F148 F154L124-Y152 VanDerWaalsContact CD1-CB 3.43Å; L124-Y152 HydrophobicContact CD1-CD1 4.31Å; L124-Y152 HydrophobicContact CD1-CD2 4.47Å; L124-Y152 HydrophobicContact CD1-CG 3.85Å; F148-Y152 HydrophobicContact CD1-CD2 4.14Å; F148-Y152 HydrophobicContact CD1-CE2 4.38Å; F148-Y152 CarbonylContact O-C 3.15Å; F148-Y152 WeakPolarHBondContact O-CA 3.2Å; F148-Y152 WeakPolarHBondContact O-CB 3.37Å; F148-Y152 PolarHBondContact O-N 2.59Å; F148-Y152 VanDerWaalsContact O-N 3.12Å; Y152-F154 PolarHBondContact O-N 3.26Å
153G92.5Very high92.3Very high51 Ų5141.2 Ų41.253%0.52620%0.203SC..  trans69.915.9177.600000114.3F148 I149 T155F148-G153 PolarHBondContact O-N 3.12Å; F148-G153 VanDerWaalsContact O-N 3.08Å; I149-G153 WeakPolarHBondContact O-CA 3.22Å; I149-G153 PolarHBondContact O-N 3.26Å; G153-T155 VanDerWaalsContact C-N 3.32Å; G153-T155 PolarHBondContact O-N 2.95Å
154F92.8Very high92.4Very high24 Ų2441.1 Ų41.111%0.10520%0.202CC..  trans-77.482.6178-173-129.5000110.3D122 L124 M125 L128 F148 I149 Y152 N156 A157 V160D122-F154 HydrophobicContact CB-CD2 4.29Å; D122-F154 HydrophobicContact CB-CE2 4.19Å; L124-F154 HydrophobicContact CB-CD1 4.32Å; L124-F154 HydrophobicContact CD1-CB 4.15Å; M125-F154 HydrophobicContact CB-CE1 4.18Å; M125-F154 HydrophobicContact CB-CZ 3.74Å; M125-F154 HydrophobicContact CG-CZ 4.14Å; L128-F154 HydrophobicContact CD1-CD1 4.19Å; L128-F154 HydrophobicContact CD1-CE1 3.86Å; F148-F154 HydrophobicContact CB-CB 4.36Å; F148-F154 PolarHBondContact O-N 2.91Å; F148-F154 VanDerWaalsContact O-N 3.16Å; I149-F154 WeakPolarHBondContact CG1-O 3.31Å; Y152-F154 PolarHBondContact O-N 3.26Å; F154-N156 VanDerWaalsContact C-N 3.25Å; F154-N156 PolarHBondContact O-N 2.93Å; F154-N156 VanDerWaalsContact O-N 3.13Å; F154-A157 HydrophobicContact CD1-CB 3.57Å; F154-A157 HydrophobicContact CE1-CB 4.15Å; F154-A157 HydrophobicContact CG-CB 4.4Å; F154-A157 VanDerWaalsContact O-CB 3.27Å; F154-A157 WeakPolarHBondContact O-CB 3.38Å; F154-A157 PolarHBondContact O-N 2.91Å; F154-A157 VanDerWaalsContact O-N 3.13Å; F154-V160 HydrophobicContact CE1-CG2 4.39Å; F154-V160 HydrophobicContact CZ-CG2 4.2Å
155T89.5Confident92.4Very high93 Ų9337.6 Ų37.657%0.57119%0.189SC*.THydrogen-bonded Turntrans-57.2-32.9-166.653.90000114.6G153 A157G153-T155 VanDerWaalsContact C-N 3.32Å; G153-T155 PolarHBondContact O-N 2.95Å; T155-A157 VanDerWaalsContact C-N 3.3Å; T155-A157 PolarHBondContact O-N 3.01Å
156N89.6Confident92.4Very high23 Ų2339 Ų3912%0.12320%0.197CC..THydrogen-bonded Turntrans-93.713.7-173.8-52.93.1000112.3F154 T158 E159 V160 E298 L302F154-N156 VanDerWaalsContact C-N 3.25Å; F154-N156 PolarHBondContact O-N 2.93Å; F154-N156 VanDerWaalsContact O-N 3.13Å; N156-T158 PolarHBondContact O-N 3.24Å; N156-E159 VanDerWaalsContact C-OE2 3.32Å; N156-E159 WeakPolarHBondContact CA-OE2 3.43Å; N156-E159 PolarHBondContact O-N 3.34Å; N156-V160 WeakPolarHBondContact O-CG2 3.43Å; N156-V160 PolarHBondContact O-N 2.94Å; N156-E298 PolarHBondContact ND2-O 3.31Å; N156-E298 VanDerWaalsContact ND2-O 3.11Å; N156-E298 PolarHBondContact OD1-OE2 2.95Å; N156-L302 HydrophobicContact CB-CD1 4.07Å
157A93.7Very high92.5Very high0 Ų041.3 Ų41.30%021%0.208CC..Hα-helixtrans-59.2-35.9-172.500000112.5L128 S145 F148 I149 F154 T155 A161L128-A157 HydrophobicContact CD1-CB 3.88Å; L128-A157 WeakPolarHBondContact CD1-O 3.37Å; S145-A157 VanDerWaalsContact CB-C 3.41Å; S145-A157 WeakPolarHBondContact CB-O 3.5Å; S145-A157 WeakPolarHBondContact O-CB 3.31Å; F148-A157 HydrophobicContact CB-CB 3.97Å; I149-A157 HydrophobicContact CD1-CB 4.2Å; I149-A157 HydrophobicContact CG1-CB 3.89Å; F154-A157 HydrophobicContact CD1-CB 3.57Å; F154-A157 HydrophobicContact CE1-CB 4.15Å; F154-A157 HydrophobicContact CG-CB 4.4Å; F154-A157 VanDerWaalsContact O-CB 3.27Å; F154-A157 WeakPolarHBondContact O-CB 3.38Å; F154-A157 PolarHBondContact O-N 2.91Å; F154-A157 VanDerWaalsContact O-N 3.13Å; T155-A157 VanDerWaalsContact C-N 3.3Å; T155-A157 PolarHBondContact O-N 3.01Å; A157-A161 WeakPolarHBondContact O-CB 3.29Å; A157-A161 PolarHBondContact O-N 2.8Å
158T91.7Very high92.6Very high8 Ų840 Ų405%0.04920%0.201CC..Hα-helixtrans-72.1-42.6-176.1-56.10000110.2S145 I149 N156 A161 M162 A290 L294S145-T158 PolarHBondContact OG-OG1 3.4Å; I149-T158 WeakPolarHBondContact CD1-OG1 3.47Å; N156-T158 PolarHBondContact O-N 3.24Å; T158-A161 PolarHBondContact O-N 3.44Å; T158-M162 HydrophobicContact CG2-CG 4.35Å; T158-M162 WeakPolarHBondContact O-CB 3.46Å; T158-M162 WeakPolarHBondContact O-CG 3.36Å; T158-M162 PolarHBondContact O-N 2.91Å; T158-A290 HydrophobicContact CG2-CB 4.38Å; T158-L294 HydrophobicContact CG2-CD2 3.86Å
159E91.5Very high92.4Very high13 Ų1340.1 Ų40.16%0.06120%0.202CC..Hα-helixtrans-58.3-51.7175.6-67.262-153.700110.7N156 A161 M162 A163 L294 K295 L299N156-E159 VanDerWaalsContact C-OE2 3.32Å; N156-E159 WeakPolarHBondContact CA-OE2 3.43Å; N156-E159 PolarHBondContact O-N 3.34Å; E159-A161 PolarHBondContact O-N 3.2Å; E159-M162 PolarHBondContact O-N 2.99Å; E159-A163 WeakPolarHBondContact O-CB 3.43Å; E159-A163 PolarHBondContact O-N 3.2Å; E159-L294 HydrophobicContact CB-CD2 4.19Å; E159-L294 HydrophobicContact CG-CD2 3.74Å; E159-L294 WeakPolarHBondContact OE1-CD2 3.38Å; E159-K295 PolarHBondContact OE1-N 3.38Å; E159-L299 HydrophobicContact CB-CB 4Å; E159-L299 HydrophobicContact CB-CD1 3.98Å; E159-L299 HydrophobicContact CB-CD2 4.39Å; E159-L299 HydrophobicContact CB-CG 4.33Å; E159-L299 HydrophobicContact CG-CB 4.3Å
160V94Very high92.3Very high0 Ų038.1 Ų38.10%019%0.193CC..Hα-helixtrans-60.9-46.5177.8173.10000110.2M125 L128 F154 N156 M162 A163 C164 L299 L302 M306M125-V160 HydrophobicContact CG-CG1 3.93Å; M125-V160 HydrophobicContact CG-CG2 4.41Å; L128-V160 HydrophobicContact CB-CG1 3.85Å; L128-V160 HydrophobicContact CD1-CB 4.15Å; L128-V160 HydrophobicContact CD1-CG1 4.05Å; F154-V160 HydrophobicContact CE1-CG2 4.39Å; F154-V160 HydrophobicContact CZ-CG2 4.2Å; N156-V160 WeakPolarHBondContact O-CG2 3.43Å; N156-V160 PolarHBondContact O-N 2.94Å; V160-M162 PolarHBondContact O-N 3.41Å; V160-A163 PolarHBondContact O-N 2.97Å; V160-C164 WeakPolarHBondContact O-CB 3.36Å; V160-C164 PolarHBondContact O-N 3.48Å; V160-C164 PolarHBondContact O-SG 2.86Å; V160-L299 HydrophobicContact CG2-CD1 4.39Å; V160-L302 HydrophobicContact CG2-CD1 3.76Å; V160-M306 HydrophobicContact CG1-SD 4.42Å
161A94.6Very high92.4Very high0 Ų033.7 Ų33.70%017%0.173CC..Hα-helixtrans-61.4-45.7-178.100000112.6L128 T133 G141 A157 T158 E159 A165L128-A161 HydrophobicContact CD1-CB 4.38Å; L128-A161 HydrophobicContact CD2-CB 4.15Å; T133-A161 HydrophobicContact CG2-CB 3.97Å; T133-A161 WeakPolarHBondContact CG2-O 3.42Å; G141-A161 WeakPolarHBondContact O-CB 3.47Å; A157-A161 WeakPolarHBondContact O-CB 3.29Å; A157-A161 PolarHBondContact O-N 2.8Å; T158-A161 PolarHBondContact O-N 3.44Å; E159-A161 PolarHBondContact O-N 3.2Å; A161-A165 VanDerWaalsContact O-CB 3.29Å; A161-A165 WeakPolarHBondContact O-CB 3.38Å; A161-A165 PolarHBondContact O-N 3.44Å
162M91.8Very high92.5Very high5 Ų526.8 Ų26.83%0.02515%0.147CC..Hα-helixtrans-66-41.2179.5-68.6-57.8104.200111.6H138 A142 T158 E159 V160 T166 L287 L291 L294H138-M162 HydrophobicContact CB-CE 4.49Å; H138-M162 WeakPolarHBondContact O-CE 3.46Å; A142-M162 HydrophobicContact CB-CE 3.49Å; A142-M162 VanDerWaalsContact CB-CE 3.49Å; T158-M162 HydrophobicContact CG2-CG 4.35Å; T158-M162 WeakPolarHBondContact O-CB 3.46Å; T158-M162 WeakPolarHBondContact O-CG 3.36Å; T158-M162 PolarHBondContact O-N 2.91Å; E159-M162 PolarHBondContact O-N 2.99Å; V160-M162 PolarHBondContact O-N 3.41Å; M162-T166 WeakPolarHBondContact O-CB 3.48Å; M162-T166 PolarHBondContact O-N 3.11Å; M162-T166 VanDerWaalsContact O-N 3.13Å; M162-T166 PolarHBondContact O-OG1 2.59Å; M162-L287 HydrophobicContact CE-CD2 4.16Å; M162-L287 HydrophobicContact SD-CD2 3.96Å; M162-L291 HydrophobicContact CB-CD2 3.9Å; M162-L291 HydrophobicContact CG-CD2 3.58Å; M162-L291 HydrophobicContact CG-CG 4.38Å; M162-L291 HydrophobicContact SD-CD2 3.88Å; M162-L291 HydrophobicContact SD-CG 4.23Å; M162-L294 HydrophobicContact CB-CD1 4.42Å; M162-L294 HydrophobicContact CG-CD1 4.41Å
163A92.8Very high92.3Very high13 Ų1321.2 Ų21.211%0.10713%0.134CC..Hα-helixtrans-66.7-51.2178.400000111.4E159 V160 A165 T166 F167 L299 M306E159-A163 WeakPolarHBondContact O-CB 3.43Å; E159-A163 PolarHBondContact O-N 3.2Å; V160-A163 PolarHBondContact O-N 2.97Å; A163-A165 PolarHBondContact O-N 2.89Å; A163-T166 PolarHBondContact O-N 2.92Å; A163-T166 VanDerWaalsContact O-N 3.16Å; A163-F167 VanDerWaalsContact O-CD2 3.28Å; A163-F167 WeakPolarHBondContact O-CD2 3.24Å; A163-F167 PolarHBondContact O-N 2.62Å; A163-L299 HydrophobicContact CB-CD1 4.27Å; A163-L299 HydrophobicContact CB-CD2 4.01Å; A163-M306 HydrophobicContact CB-CE 3.52Å; A163-M306 HydrophobicContact CB-SD 3.75Å
164C95.1Very high92.2Very high0 Ų022.7 Ų22.70%013%0.129CC..Hα-helixtrans-58.3-45.6178.4-69.10000112.2A129 T133 V160 T166 F167 G168 M306 L310A129-C164 VanDerWaalsContact CA-SG 3.59Å; T133-C164 HydrophobicContact CG2-CB 4.2Å; T133-C164 WeakPolarHBondContact OG1-CB 3.49Å; V160-C164 WeakPolarHBondContact O-CB 3.36Å; V160-C164 PolarHBondContact O-N 3.48Å; V160-C164 PolarHBondContact O-SG 2.86Å; C164-T166 VanDerWaalsContact C-N 3.3Å; C164-T166 PolarHBondContact O-N 3.49Å; C164-F167 PolarHBondContact O-N 3.34Å; C164-G168 WeakPolarHBondContact O-CA 3.31Å; C164-G168 PolarHBondContact O-N 2.94Å; C164-M306 VanDerWaalsContact SG-CG 3.53Å; C164-M306 PolarHBondContact SG-SD 3.13Å; C164-L310 HydrophobicContact CB-CD2 4.25Å
165A93.9Very high92.2Very high0 Ų022.7 Ų22.70%013%0.13CC..Hα-helixtrans-60.9-39.1177.300000112.2H138 A161 A163 L169H138-A165 HydrophobicContact CB-CB 4.37Å; A161-A165 VanDerWaalsContact O-CB 3.29Å; A161-A165 WeakPolarHBondContact O-CB 3.38Å; A161-A165 PolarHBondContact O-N 3.44Å; A163-A165 PolarHBondContact O-N 2.89Å; A165-L169 WeakPolarHBondContact O-CB 3.42Å; A165-L169 PolarHBondContact O-N 3.4Å; A165-L169 VanDerWaalsContact O-N 3.07Å
166T92.1Very high92.3Very high28 Ų2818.3 Ų18.317%0.17210%0.103CC..Hα-helixtrans-72.7-46.9-179.3-54.50000111.9I35 V39 H138 M162 A163 C164 G168 L169 V170I35-T166 HydrophobicContact CD1-CG2 3.94Å; V39-T166 HydrophobicContact CG1-CG2 4.07Å; V39-T166 WeakPolarHBondContact CG1-OG1 3.34Å; H138-T166 PolarHBondContact NE2-N 3.34Å; H138-T166 PolarHBondContact NE2-OG1 3.42Å; M162-T166 WeakPolarHBondContact O-CB 3.48Å; M162-T166 PolarHBondContact O-N 3.11Å; M162-T166 VanDerWaalsContact O-N 3.13Å; M162-T166 PolarHBondContact O-OG1 2.59Å; A163-T166 PolarHBondContact O-N 2.92Å; A163-T166 VanDerWaalsContact O-N 3.16Å; C164-T166 VanDerWaalsContact C-N 3.3Å; C164-T166 PolarHBondContact O-N 3.49Å; T166-G168 VanDerWaalsContact C-N 3.31Å; T166-G168 PolarHBondContact O-N 2.97Å; T166-L169 PolarHBondContact O-N 3.1Å; T166-V170 WeakPolarHBondContact O-CG2 3.19Å; T166-V170 PolarHBondContact O-N 2.97Å
167F92.5Very high92.1Very high91 Ų9118.4 Ų18.440%0.39911%0.11SC..Hα-helixtrans-61.7-43.2174.5-85.3-70.9000111.4A163 C164 L169 V170 L171 M306 L307 L310A163-F167 VanDerWaalsContact O-CD2 3.28Å; A163-F167 WeakPolarHBondContact O-CD2 3.24Å; A163-F167 PolarHBondContact O-N 2.62Å; C164-F167 PolarHBondContact O-N 3.34Å; F167-L169 VanDerWaalsContact C-N 3.29Å; F167-L169 PolarHBondContact O-N 3.39Å; F167-V170 PolarHBondContact O-N 3.08Å; F167-L171 HydrophobicContact CB-CD1 4.35Å; F167-L171 WeakPolarHBondContact O-CB 3.26Å; F167-L171 WeakPolarHBondContact O-CD1 3.33Å; F167-L171 WeakPolarHBondContact O-CG 3.39Å; F167-L171 PolarHBondContact O-N 3.31Å; F167-M306 HydrophobicContact CD2-CE 4.41Å; F167-M306 HydrophobicContact CE2-CE 4.27Å; F167-L307 HydrophobicContact CE1-CD1 4.4Å; F167-L310 HydrophobicContact CB-CD1 3.68Å; F167-L310 HydrophobicContact CD2-CD1 4.12Å; F167-L310 HydrophobicContact CG-CD1 4.03Å
168G93.9Very high92Very high0 Ų021.6 Ų21.60%013%0.13CC..Hα-helixtrans-55.9-44.4176.500000112.4C164 T166 V170 L171 G172 L347C164-G168 WeakPolarHBondContact O-CA 3.31Å; C164-G168 PolarHBondContact O-N 2.94Å; T166-G168 VanDerWaalsContact C-N 3.31Å; T166-G168 PolarHBondContact O-N 2.97Å; G168-V170 PolarHBondContact O-N 3.25Å; G168-L171 PolarHBondContact O-N 3.37Å; G168-G172 PolarHBondContact O-N 2.93Å; G168-L347 VanDerWaalsContact C-C 3.47Å; G168-L347 CarbonylContact C-O 3.25Å; G168-L347 WeakPolarHBondContact CA-O 3.29Å; G168-L347 CarbonylContact O-C 3.44Å; G168-L347 VanDerWaalsContact O-C 3.31Å; G168-L347 WeakPolarHBondContact O-CB 3.5Å
169L90.3Very high92.1Very high9 Ų921.6 Ų21.65%0.04713%0.13CC..Hα-helixtrans-59.2-46.2176.6-163.1158.4000112.2Y33 P36 A165 T166 F167 G173 L347 G348 T352Y33-L169 WeakPolarHBondContact O-CD2 3.33Å; P36-L169 HydrophobicContact CG-CD1 4.35Å; A165-L169 WeakPolarHBondContact O-CB 3.42Å; A165-L169 PolarHBondContact O-N 3.4Å; A165-L169 VanDerWaalsContact O-N 3.07Å; T166-L169 PolarHBondContact O-N 3.1Å; F167-L169 VanDerWaalsContact C-N 3.29Å; F167-L169 PolarHBondContact O-N 3.39Å; L169-G173 PolarHBondContact O-N 3.15Å; L169-L347 PolarHBondContact N-O 3.24Å; L169-G348 VanDerWaalsContact CA-CA 3.48Å; L169-T352 WeakPolarHBondContact CG-OG1 3.33Å
170V91.8Very high92Very high21 Ų2121.1 Ų21.113%0.12713%0.128CC..Hα-helixtrans-61.7-48.6175.8177.20000110.8Y33 I35 T166 F167 G168 G173 L174Y33-V170 HydrophobicContact CD1-CB 4.48Å; Y33-V170 HydrophobicContact CD1-CG1 3.88Å; Y33-V170 HydrophobicContact CE1-CG1 4.18Å; Y33-V170 HydrophobicContact CG-CG1 4.21Å; Y33-V170 HydrophobicContact CG-CG2 4.4Å; I35-V170 HydrophobicContact CD1-CG2 3.69Å; T166-V170 WeakPolarHBondContact O-CG2 3.19Å; T166-V170 PolarHBondContact O-N 2.97Å; F167-V170 PolarHBondContact O-N 3.08Å; G168-V170 PolarHBondContact O-N 3.25Å; V170-G173 PolarHBondContact O-N 3.15Å; V170-L174 HydrophobicContact CG1-CD1 3.82Å; V170-L174 HydrophobicContact CG1-CG 4.36Å; V170-L174 WeakPolarHBondContact O-CB 3.48Å; V170-L174 VanDerWaalsContact O-CG 3.29Å; V170-L174 WeakPolarHBondContact O-CG 3.23Å; V170-L174 PolarHBondContact O-N 3.17Å
171L93.4Very high91.7Very high37 Ų3727 Ų2719%0.19415%0.151CC..Hα-helixtrans-65.2-42.1-177.1-67.4164.9000111.4F167 G168 G173 L174 I175 L310 T314 L347F167-L171 HydrophobicContact CB-CD1 4.35Å; F167-L171 WeakPolarHBondContact O-CB 3.26Å; F167-L171 WeakPolarHBondContact O-CD1 3.33Å; F167-L171 WeakPolarHBondContact O-CG 3.39Å; F167-L171 PolarHBondContact O-N 3.31Å; G168-L171 PolarHBondContact O-N 3.37Å; L171-G173 VanDerWaalsContact C-N 3.34Å; L171-G173 PolarHBondContact O-N 3.2Å; L171-L174 PolarHBondContact O-N 3.25Å; L171-L174 VanDerWaalsContact O-N 3.16Å; L171-I175 WeakPolarHBondContact O-CG1 3.32Å; L171-I175 PolarHBondContact O-N 2.85Å; L171-L310 HydrophobicContact CD1-CB 4.24Å; L171-T314 HydrophobicContact CB-CG2 4.26Å; L171-T314 WeakPolarHBondContact CD1-OG1 3.23Å; L171-T314 HydrophobicContact CD2-CG2 4.36Å; L171-L347 HydrophobicContact CB-CD1 4.34Å
172G91.9Very high91.6Very high0 Ų032.2 Ų32.20%017%0.171CC..Hα-helixtrans-60.8-38.7175.700000113.4G168 G176 N356G168-G172 PolarHBondContact O-N 2.93Å; G172-G176 PolarHBondContact O-N 3.44Å; G172-N356 PolarHBondContact O-ND2 3.49Å; G172-N356 VanDerWaalsContact O-ND2 3.08Å
173G87.9Confident91.7Very high29 Ų2932 Ų3230%0.29917%0.17SC..Hα-helixtrans-71.7-36.8173.300000112.7L169 V170 L171 T352L169-G173 PolarHBondContact O-N 3.15Å; V170-G173 PolarHBondContact O-N 3.15Å; L171-G173 VanDerWaalsContact C-N 3.34Å; L171-G173 PolarHBondContact O-N 3.2Å; G173-T352 VanDerWaalsContact N-CG2 3.3Å
174L91.5Very high91.5Very high82 Ų8231.6 Ų31.643%0.42917%0.166SC..Hα-helixtrans-67.5-42.4178.6-77.4173000112.9Y33 V170 L171 P178Y33-L174 HydrophobicContact CE1-CD1 4.46Å; Y33-L174 HydrophobicContact CE1-CD2 3.61Å; Y33-L174 HydrophobicContact CE1-CG 3.77Å; Y33-L174 WeakPolarHBondContact OH-CD2 3.49Å; V170-L174 HydrophobicContact CG1-CD1 3.82Å; V170-L174 HydrophobicContact CG1-CG 4.36Å; V170-L174 WeakPolarHBondContact O-CB 3.48Å; V170-L174 VanDerWaalsContact O-CG 3.29Å; V170-L174 WeakPolarHBondContact O-CG 3.23Å; V170-L174 PolarHBondContact O-N 3.17Å; L171-L174 PolarHBondContact O-N 3.25Å; L171-L174 VanDerWaalsContact O-N 3.16Å; L174-P178 WeakPolarHBondContact O-CD 3.21Å; L174-P178 WeakPolarHBondContact O-CG 3.46Å
175I93.5Very high91.2Very high25 Ų2539.6 Ų39.613%0.12820%0.201CC..Hα-helixtrans-83.8-24-17769.6162.3000113.6L171 G177 P178 V179 T314 M317 A318 C343 L347L171-I175 WeakPolarHBondContact O-CG1 3.32Å; L171-I175 PolarHBondContact O-N 2.85Å; I175-G177 PolarHBondContact O-N 3.14Å; I175-P178 WeakPolarHBondContact O-CD 3.37Å; I175-V179 WeakPolarHBondContact O-CB 3.49Å; I175-V179 VanDerWaalsContact O-CG2 3.31Å; I175-V179 WeakPolarHBondContact O-CG2 3.43Å; I175-V179 PolarHBondContact O-N 3.41Å; I175-T314 HydrophobicContact CD1-CG2 4.4Å; I175-T314 HydrophobicContact CG2-CG2 3.49Å; I175-T314 VanDerWaalsContact CG2-CG2 3.49Å; I175-M317 HydrophobicContact CD1-CB 4.26Å; I175-M317 HydrophobicContact CD1-CG 4.1Å; I175-A318 HydrophobicContact CD1-CB 4.22Å; I175-C343 HydrophobicContact CD1-CB 4Å; I175-C343 HydrophobicContact CG1-CB 4.09Å; I175-L347 HydrophobicContact CD1-CD1 3.4Å; I175-L347 HydrophobicContact CG1-CD1 4.05Å
176G89.8Confident91Very high1 Ų143.9 Ų43.91%0.0122%0.221CC..Hα-helixtrans-54.6-49.5-177.100000112.8G172 A180 N356G172-G176 PolarHBondContact O-N 3.44Å; G176-A180 WeakPolarHBondContact O-CB 3.14Å; G176-A180 PolarHBondContact O-N 3.37Å; G176-N356 WeakPolarHBondContact CA-ND2 3.47Å
177G86.7Confident90.7Very high25 Ų2543.1 Ų43.126%0.25822%0.217SC..Hα-helixtrans-62.6-53.3178.900000114.4I175 A180 R181I175-G177 PolarHBondContact O-N 3.14Å; G177-A180 PolarHBondContact O-N 2.87Å; G177-R181 WeakPolarHBondContact O-CB 3.32Å; G177-R181 WeakPolarHBondContact O-CG 3.35Å; G177-R181 PolarHBondContact O-N 3.22Å
178P91.8Very high90Very high66 Ų6643.8 Ų43.843%0.42923%0.228SC..Hα-helixtrans-55.9-47174.6-27.734.1000114.1L174 I175 R181 Y182L174-P178 WeakPolarHBondContact O-CD 3.21Å; L174-P178 WeakPolarHBondContact O-CG 3.46Å; I175-P178 WeakPolarHBondContact O-CD 3.37Å; P178-R181 PolarHBondContact O-N 3.04Å; P178-Y182 PolarHBondContact O-N 3.29Å; P178-Y182 VanDerWaalsContact O-N 3.08Å
179V93.3Very high89.3Confident9 Ų945.3 Ų45.36%0.05524%0.238CC..Hα-helixtrans-63.2-47.2178.1172.80000109.9I175 R181 Y182 L183 A318 A321 I322I175-V179 WeakPolarHBondContact O-CB 3.49Å; I175-V179 VanDerWaalsContact O-CG2 3.31Å; I175-V179 WeakPolarHBondContact O-CG2 3.43Å; I175-V179 PolarHBondContact O-N 3.41Å; V179-R181 PolarHBondContact O-N 3.1Å; V179-Y182 WeakPolarHBondContact O-CB 3.49Å; V179-Y182 PolarHBondContact O-N 3.44Å; V179-L183 HydrophobicContact CG1-CD1 3.7Å; V179-L183 HydrophobicContact CG1-CG 4.12Å; V179-L183 VanDerWaalsContact O-CG 3.28Å; V179-L183 WeakPolarHBondContact O-CG 3.42Å; V179-L183 PolarHBondContact O-N 2.93Å; V179-A318 HydrophobicContact CG2-CB 3.89Å; V179-A321 HydrophobicContact CG1-CB 4.22Å; V179-I322 HydrophobicContact CG1-CG1 4.04Å
180A88.5Confident88.2Confident2 Ų247.6 Ų47.62%0.01725%0.253CS..Hα-helixtrans-57-49.7177.500000113G176 G177 Y182 L183 V184 A340 I360G176-A180 WeakPolarHBondContact O-CB 3.14Å; G176-A180 PolarHBondContact O-N 3.37Å; G177-A180 PolarHBondContact O-N 2.87Å; A180-Y182 VanDerWaalsContact C-N 3.26Å; A180-Y182 PolarHBondContact O-N 2.96Å; A180-L183 PolarHBondContact O-N 3.49Å; A180-L183 VanDerWaalsContact O-N 3.14Å; A180-V184 WeakPolarHBondContact O-CG2 3.42Å; A180-V184 PolarHBondContact O-N 2.88Å; A180-A340 HydrophobicContact CB-CB 3.82Å; A180-I360 HydrophobicContact CB-CD1 3.23Å; A180-I360 HydrophobicContact CB-CG1 3.53Å
181R88.7Confident87.1Confident125 Ų12554 Ų5447%0.47229%0.287SS..Hα-helixtrans-58.4-40.8178.1-76.4-172.8-67.2-96.46.1111.9G177 P178 V179 K185G177-R181 WeakPolarHBondContact O-CB 3.32Å; G177-R181 WeakPolarHBondContact O-CG 3.35Å; G177-R181 PolarHBondContact O-N 3.22Å; P178-R181 PolarHBondContact O-N 3.04Å; V179-R181 PolarHBondContact O-N 3.1Å; R181-K185 WeakPolarHBondContact O-CB 3.11Å; R181-K185 PolarHBondContact O-N 3.38Å
182Y92.8Very high85.6Confident108 Ų10852.9 Ų52.942%0.42428%0.284SS..Hα-helixtrans-63.4-47.8175.6177-92.5000111.2P178 V179 A180 K185 H186 I322P178-Y182 PolarHBondContact O-N 3.29Å; P178-Y182 VanDerWaalsContact O-N 3.08Å; V179-Y182 WeakPolarHBondContact O-CB 3.49Å; V179-Y182 PolarHBondContact O-N 3.44Å; A180-Y182 VanDerWaalsContact C-N 3.26Å; A180-Y182 PolarHBondContact O-N 2.96Å; Y182-K185 PolarHBondContact O-N 2.78Å; Y182-H186 AromaticContact CD2-CE1 3.72Å; Y182-H186 AromaticContact CD2-ND1 3.91Å; Y182-H186 AromaticContact CE2-CE1 3.43Å; Y182-H186 VanDerWaalsContact CE2-CE1 3.43Å; Y182-H186 WeakPolarHBondContact CE2-CE1 3.38Å; Y182-H186 AromaticContact CE2-ND1 3.8Å; Y182-H186 AromaticContact CZ-CE1 3.91Å; Y182-H186 AromaticContact CZ-ND1 3.95Å; Y182-H186 PolarHBondContact O-N 3.39Å; Y182-H186 PolarHBondContact O-ND1 3.43Å; Y182-I322 HydrophobicContact CD1-CD1 4.16Å; Y182-I322 HydrophobicContact CD1-CG1 4.23Å; Y182-I322 HydrophobicContact CD1-CG2 4.36Å; Y182-I322 HydrophobicContact CE1-CD1 4.39Å; Y182-I322 HydrophobicContact CE1-CG1 4.45Å; Y182-I322 HydrophobicContact CE1-CG2 3.77Å
183L93Very high84Confident0 Ų056.4 Ų56.40%030%0.302CS..Hα-helixtrans-68.8-43-176.7-65.8179.8000113.3V179 A180 K185 H186 S187 I322 W326 A336 A339V179-L183 HydrophobicContact CG1-CD1 3.7Å; V179-L183 HydrophobicContact CG1-CG 4.12Å; V179-L183 VanDerWaalsContact O-CG 3.28Å; V179-L183 WeakPolarHBondContact O-CG 3.42Å; V179-L183 PolarHBondContact O-N 2.93Å; A180-L183 PolarHBondContact O-N 3.49Å; A180-L183 VanDerWaalsContact O-N 3.14Å; L183-K185 VanDerWaalsContact C-N 3.33Å; L183-K185 PolarHBondContact O-N 2.99Å; L183-H186 CarbonylContact O-C 3.59Å; L183-H186 PolarHBondContact O-N 2.97Å; L183-H186 VanDerWaalsContact O-N 3.16Å; L183-S187 PolarHBondContact O-N 2.77Å; L183-I322 HydrophobicContact CD2-CB 4.31Å; L183-I322 HydrophobicContact CD2-CG1 4Å; L183-I322 HydrophobicContact CD2-CG2 4.28Å; L183-I322 HydrophobicContact CG-CG1 4.47Å; L183-W326 HydrophobicContact CD1-CB 4.05Å; L183-W326 HydrophobicContact CD1-CG 4.17Å; L183-W326 HydrophobicContact CD2-CB 3.96Å; L183-W326 HydrophobicContact CD2-CD2 3.62Å; L183-W326 HydrophobicContact CD2-CE3 3.86Å; L183-W326 HydrophobicContact CD2-CG 3.67Å; L183-W326 HydrophobicContact CG-CG 4.36Å; L183-A336 HydrophobicContact CB-CB 3.58Å; L183-A339 HydrophobicContact CD1-CB 3.44Å; L183-A339 VanDerWaalsContact CD1-CB 3.44Å
184V89.3Confident82.1Confident5 Ų561.1 Ų61.13%0.0333%0.328CS..Hα-helixtrans-61.2-42.6177173.60000110.7A180 H186 S187 Y333 A336 I360 F364A180-V184 WeakPolarHBondContact O-CG2 3.42Å; A180-V184 PolarHBondContact O-N 2.88Å; V184-H186 PolarHBondContact O-N 3.17Å; V184-S187 PolarHBondContact O-N 3.44Å; V184-S187 PolarHBondContact O-OG 3.2Å; V184-Y333 HydrophobicContact CG1-CD2 4.18Å; V184-Y333 HydrophobicContact CG1-CE2 4.32Å; V184-Y333 HydrophobicContact CG2-CD2 3.96Å; V184-Y333 HydrophobicContact CG2-CE2 3.9Å; V184-A336 HydrophobicContact CG2-CB 3.99Å; V184-I360 HydrophobicContact CG2-CG2 4.27Å; V184-F364 HydrophobicContact CG1-CD1 3.79Å; V184-F364 HydrophobicContact CG1-CD2 4.46Å; V184-F364 HydrophobicContact CG1-CE1 3.89Å; V184-F364 HydrophobicContact CG1-CG 4.09Å; V184-F364 HydrophobicContact CG1-CZ 4.27Å; V184-F364 HydrophobicContact CG2-CD2 4.44Å
185K89.7Confident80.1Confident168 Ų16863.1 Ų63.173%0.7334%0.339SS*.Hα-helixtrans-61.5-30177.5-177.5178.9176.7-1750113.2R181 Y182 L183R181-K185 WeakPolarHBondContact O-CB 3.11Å; R181-K185 PolarHBondContact O-N 3.38Å; Y182-K185 PolarHBondContact O-N 2.78Å; L183-K185 VanDerWaalsContact C-N 3.33Å; L183-K185 PolarHBondContact O-N 2.99Å
186H89.1Confident78.1Confident91 Ų9164.1 Ų64.142%0.42134%0.344SS..THydrogen-bonded Turntrans-104.59.3-178.9-6288.8000112.8Y182 L183 V184 W326Y182-H186 AromaticContact CD2-CE1 3.72Å; Y182-H186 AromaticContact CD2-ND1 3.91Å; Y182-H186 AromaticContact CE2-CE1 3.43Å; Y182-H186 VanDerWaalsContact CE2-CE1 3.43Å; Y182-H186 WeakPolarHBondContact CE2-CE1 3.38Å; Y182-H186 AromaticContact CE2-ND1 3.8Å; Y182-H186 AromaticContact CZ-CE1 3.91Å; Y182-H186 AromaticContact CZ-ND1 3.95Å; Y182-H186 PolarHBondContact O-N 3.39Å; Y182-H186 PolarHBondContact O-ND1 3.43Å; L183-H186 CarbonylContact O-C 3.59Å; L183-H186 PolarHBondContact O-N 2.97Å; L183-H186 VanDerWaalsContact O-N 3.16Å; V184-H186 PolarHBondContact O-N 3.17Å; H186-W326 HydrophobicContact CB-CH2 4.14Å; H186-W326 HydrophobicContact CB-CZ2 4.47Å; H186-W326 WeakPolarHBondContact O-CH2 3.37Å; H186-W326 VanDerWaalsContact O-CZ2 3.29Å; H186-W326 WeakPolarHBondContact O-CZ2 3.25Å
187S84.8Confident75.7Confident12 Ų1272.6 Ų72.68%0.08438%0.384CS..SBendtrans-72.4153.9178.284.20000111L183 V184 T189 P190 K331L183-S187 PolarHBondContact O-N 2.77Å; V184-S187 PolarHBondContact O-N 3.44Å; V184-S187 PolarHBondContact O-OG 3.2Å; S187-T189 PolarHBondContact O-N 3.41Å; S187-T189 VanDerWaalsContact OG-C 3.22Å; S187-T189 PolarHBondContact OG-N 3.22Å; S187-T189 PolarHBondContact OG-O 3.15Å; S187-P190 VanDerWaalsContact OG-CA 3.23Å; S187-P190 WeakPolarHBondContact OG-CA 3.21Å; S187-P190 VanDerWaalsContact OG-N 3.11Å; S187-K331 WeakPolarHBondContact CA-O 3.21Å
188T78.4Confident73.6Confident105 Ų10577.8 Ų77.864%0.64440%0.401SS*.SBendtrans-69.1-18.3173.3510000112.5K331T188-K331 PolarHBondContact N-O 2.87Å; T188-K331 VanDerWaalsContact N-O 3.1Å; T188-K331 PolarHBondContact OG1-O 3.18Å
189T78.9Confident71Confident32 Ų3278.9 Ų78.920%0.19641%0.406CS..  trans-134.763.3-176560000111S187 N191 G192 I193 Y333S187-T189 PolarHBondContact O-N 3.41Å; S187-T189 VanDerWaalsContact OG-C 3.22Å; S187-T189 PolarHBondContact OG-N 3.22Å; S187-T189 PolarHBondContact OG-O 3.15Å; T189-N191 PolarHBondContact O-N 2.88Å; T189-N191 VanDerWaalsContact O-N 3.08Å; T189-G192 PolarHBondContact O-N 3.44Å; T189-I193 HydrophobicContact CG2-CD1 4.45Å; T189-I193 HydrophobicContact CG2-CG1 3.81Å; T189-Y333 WeakPolarHBondContact O-CB 3.34Å; T189-Y333 PolarHBondContact OG1-N 2.99Å; T189-Y333 VanDerWaalsContact OG1-N 3.15Å
190P68.5Low68.3Low57 Ų5781.9 Ų81.937%0.3743%0.426SS..THydrogen-bonded Turntrans-64.9-18.3-170.725.3-33.8000114.2S187S187-P190 VanDerWaalsContact OG-CA 3.23Å; S187-P190 WeakPolarHBondContact OG-CA 3.21Å; S187-P190 VanDerWaalsContact OG-N 3.11Å
191N67.5Low65.7Low155 Ų15587.8 Ų87.883%0.82946%0.462SS*.THydrogen-bonded Turntrans-10214.7177-61.6-25.6000113T189T189-N191 PolarHBondContact O-N 2.88Å; T189-N191 VanDerWaalsContact O-N 3.08Å
192G62.7Low63.1Low14 Ų1485.6 Ų85.614%0.14447%0.471CS..  trans78.6-178.9-167.200000112.4T189 D196T189-G192 PolarHBondContact O-N 3.44Å; G192-D196 VanDerWaalsContact CA-OD2 3.24Å; G192-D196 WeakPolarHBondContact CA-OD2 3.32Å
193I57.6Low60.2Low73 Ų7388.8 Ų88.837%0.37449%0.487SS..  trans-98.5141.3172.2-62.7174.1000106.9T189 D195 D196T189-I193 HydrophobicContact CG2-CD1 4.45Å; T189-I193 HydrophobicContact CG2-CG1 3.81Å; I193-D195 HydrophobicContact CG2-CB 4.42Å; I193-D195 PolarHBondContact O-N 2.98Å; I193-D196 PolarHBondContact N-OD2 2.62Å; I193-D196 WeakPolarHBondContact O-CB 3.5Å; I193-D196 PolarHBondContact O-N 3.47Å; I193-D196 VanDerWaalsContact O-OD2 3.07Å
194P48.2Very low57.3Low129 Ų12994.8 Ų94.884%0.83852%0.515SS*.THydrogen-bonded Turntrans-58.4-3.6-178.1-24.133.4000116.5
195D50.2Low54.4Low124 Ų124102.8 Ų102.866%0.66355%0.55SS*.THydrogen-bonded Turntrans-933.7175.6-141.412.1000112.9I193 Q197I193-D195 HydrophobicContact CG2-CB 4.42Å; I193-D195 PolarHBondContact O-N 2.98Å; D195-Q197 PolarHBondContact O-N 2.81Å
196D50.8Low51.8Low45 Ų45100 Ų10024%0.24155%0.548CS..THydrogen-bonded Turntrans-70.320.5177-69.3-31000113.5G192 I193G192-D196 VanDerWaalsContact CA-OD2 3.24Å; G192-D196 WeakPolarHBondContact CA-OD2 3.32Å; I193-D196 PolarHBondContact N-OD2 2.62Å; I193-D196 WeakPolarHBondContact O-CB 3.5Å; I193-D196 PolarHBondContact O-N 3.47Å; I193-D196 VanDerWaalsContact O-OD2 3.07Å
197Q40.2Very low49.4Very low180 Ų180102.3 Ų102.384%0.84156%0.564SS**THydrogen-bonded Turntrans-95.8-3174.3-70.3-163-4.900114.1D195 V199D195-Q197 PolarHBondContact O-N 2.81Å; Q197-V199 PolarHBondContact O-N 2.94Å; Q197-V199 VanDerWaalsContact O-N 3.11Å
198E41.4Very low47.3Very low134 Ų134107.9 Ų107.963%0.62660%0.597SS**SBendtrans-71107.3161.7-70.8-162.4159.600108.7
199V38.2Very low46Very low88 Ų88105.7 Ų105.753%0.53360%0.595SS.*  trans-36.2131.2169178.50000108.9Q197 T201Q197-V199 PolarHBondContact O-N 2.94Å; Q197-V199 VanDerWaalsContact O-N 3.11Å; V199-T201 VanDerWaalsContact C-N 3.35Å; V199-T201 PolarHBondContact O-N 3.16Å
200P36.4Very low44.9Very low72 Ų72112.4 Ų112.447%0.46862%0.617SS.*  trans-55.9102.1178.821.4-31.3000108.8A202P200-A202 PolarHBondContact O-N 3.33Å
201T33.7Very low45.2Very low126 Ų126117 Ų11777%0.77364%0.636SS**THydrogen-bonded Turntrans-67.5106.8174.546.30000106.7V199V199-T201 VanDerWaalsContact C-N 3.35Å; V199-T201 PolarHBondContact O-N 3.16Å
202A33.5Very low46Very low79 Ų79112.9 Ų112.965%0.65361%0.613SS**THydrogen-bonded Turntrans75.953.7158.200000119.3P200 E204P200-A202 PolarHBondContact O-N 3.33Å; A202-E204 VanDerWaalsContact C-N 3.26Å
203F32.4Very low47.3Very low176 Ų176115.5 Ų115.577%0.77263%0.626SS**SBend-93.73.8117.2-88.3-83.7000111.4K205 C371F203-K205 PolarHBondContact O-N 3.23Å; F203-C371 HydrophobicContact CD2-CB 4.33Å; F203-C371 HydrophobicContact CE2-CB 4.19Å
204E31.8Very low49Very low125 Ų125116.6 Ų116.658%0.58464%0.64SS**SBendtrans-74.2110.2174.7-76.9-169.6142.300112.5A202A202-E204 VanDerWaalsContact C-N 3.26Å
205K29.3Very low51Low174 Ų174115.7 Ų115.776%0.75763%0.628SS**  trans90.7114.1167.6-59.5179.9-177.8171.20113.9F203 D207F203-K205 PolarHBondContact O-N 3.23Å; K205-D207 PolarHBondContact O-N 3.04Å
206P34.5Very low53Low108 Ų108110.4 Ų110.470%0.70160%0.6SS**  trans-55.1121.4161.825.5-29.4000105V208P206-V208 WeakPolarHBondContact O-CA 3.29Å; P206-V208 PolarHBondContact O-N 3.02Å
207D39.2Very low55Low140 Ų140111 Ų11175%0.74960%0.603SS**  trans-41.6117.7175.1-132.2-11.6000107.4K205 G209 R273K205-D207 PolarHBondContact O-N 3.04Å; D207-G209 PolarHBondContact O-N 3.48Å; D207-R273 PolarHBondContact O-NH2 3.14Å
208V40.5Very low57.6Low129 Ų129107.9 Ų107.978%0.78259%0.59SS**THydrogen-bonded Turntrans-51.8108.9-157.6-165.70000107.9P206 R210P206-V208 WeakPolarHBondContact O-CA 3.29Å; P206-V208 PolarHBondContact O-N 3.02Å; V208-R210 VanDerWaalsContact C-N 3.29Å; V208-R210 PolarHBondContact O-N 3.01Å
209G50.3Low60Low59 Ų59104.5 Ų104.561%0.60858%0.575SS**THydrogen-bonded Turntrans53.220155.200000119.7D207 M211D207-G209 PolarHBondContact O-N 3.48Å; G209-M211 PolarHBondContact O-N 2.84Å
210R56.5Low62.7Low174 Ų174100.3 Ų100.366%0.65755%0.549SS*.  trans-69.6101.6170.9-148.8173.4-178.4177.7-2.7108.3V208 F271 R273V208-R210 VanDerWaalsContact C-N 3.29Å; V208-R210 PolarHBondContact O-N 3.01Å; R210-F271 HydrophobicContact CB-CE2 4.04Å; R210-F271 HydrophobicContact CB-CZ 3.96Å; R210-F271 HydrophobicContact CG-CE2 4.37Å; R210-F271 HydrophobicContact CG-CZ 4.38Å; R210-R273 PolarHBondContact O-NH1 2.99Å
211M74.3Confident65.6Low153 Ų153101 Ų10175%0.75455%0.548SS*.  trans-64.4143.8178.4-67.7-178.9-79.500109.2G209 T213G209-M211 PolarHBondContact O-N 2.84Å; M211-T213 PolarHBondContact O-N 3.44Å; M211-T213 VanDerWaalsContact O-N 3.1Å
212I84.6Confident68.6Low69 Ų6997.1 Ų97.135%0.35453%0.529SS..  trans-68.3108.9168.2-62.1171.5000106.3L217 F271 R273 V277I212-L217 HydrophobicContact CG2-CB 4.48Å; I212-L217 HydrophobicContact CG2-CD1 4.33Å; I212-F271 HydrophobicContact CG1-CE1 4.26Å; I212-R273 HydrophobicContact CD1-CG 4.48Å; I212-V277 HydrophobicContact CD1-CB 4.14Å; I212-V277 HydrophobicContact CD1-CG1 4.41Å; I212-V277 HydrophobicContact CD1-CG2 3.69Å
213T89.8Confident71.6Confident69 Ų6994 Ų9442%0.42350%0.501SS..  trans-93.5159.7174.3680000110M211 L215 V216 L217M211-T213 PolarHBondContact O-N 3.44Å; M211-T213 VanDerWaalsContact O-N 3.1Å; T213-L215 PolarHBondContact O-N 2.89Å; T213-V216 PolarHBondContact O-N 2.89Å; T213-V216 WeakPolarHBondContact OG1-CG2 3.43Å; T213-V216 PolarHBondContact OG1-N 3.17Å; T213-L217 PolarHBondContact O-N 3.26Å
214S92.7Very high74.7Confident95 Ų9586.2 Ų86.266%0.66447%0.468SS*.Hα-helixtrans-56.2-37.2175.8-49.90000112.2L217 I218S214-L217 PolarHBondContact O-N 3.24Å; S214-I218 VanDerWaalsContact O-CG1 3.29Å; S214-I218 WeakPolarHBondContact O-CG1 3.5Å; S214-I218 PolarHBondContact O-N 3.14Å
215L91.8Very high77.8Confident111 Ų11182.4 Ų82.458%0.58146%0.457SS*.Hα-helixtrans-61.5-51.9177179.865000111.5T213 L217 I218 E219T213-L215 PolarHBondContact O-N 2.89Å; L215-L217 PolarHBondContact O-N 3.48Å; L215-I218 PolarHBondContact O-N 3.06Å; L215-I218 VanDerWaalsContact O-N 3.12Å; L215-E219 WeakPolarHBondContact O-CG 3.48Å; L215-E219 PolarHBondContact O-N 3.38Å
216V90.5Very high81.1Confident12 Ų1277.8 Ų77.87%0.07344%0.44CS..Hα-helixtrans-61.8-35.2179.5172.90000111.2T213 T220 F271 A274T213-V216 PolarHBondContact O-N 2.89Å; T213-V216 WeakPolarHBondContact OG1-CG2 3.43Å; T213-V216 PolarHBondContact OG1-N 3.17Å; V216-T220 WeakPolarHBondContact O-CB 3.38Å; V216-T220 PolarHBondContact O-N 3.02Å; V216-T220 PolarHBondContact O-OG1 2.93Å; V216-F271 HydrophobicContact CG1-CB 3.88Å; V216-F271 HydrophobicContact CG1-CD1 3.35Å; V216-F271 HydrophobicContact CG1-CE1 4.13Å; V216-F271 HydrophobicContact CG1-CG 3.89Å; V216-A274 HydrophobicContact CG1-CB 3.76Å
217L93.2Very high84.1Confident58 Ų5872.7 Ų72.730%0.30441%0.407SS..Hα-helixtrans-66.9-43.9175.2-16570.2000111.7I212 T213 S214 L215 T220 I221 L278I212-L217 HydrophobicContact CG2-CB 4.48Å; I212-L217 HydrophobicContact CG2-CD1 4.33Å; T213-L217 PolarHBondContact O-N 3.26Å; S214-L217 PolarHBondContact O-N 3.24Å; L215-L217 PolarHBondContact O-N 3.48Å; L217-T220 PolarHBondContact O-N 3.28Å; L217-I221 HydrophobicContact CG-CD1 4.13Å; L217-I221 WeakPolarHBondContact O-CB 2.8Å; L217-I221 VanDerWaalsContact O-CG1 3.27Å; L217-I221 WeakPolarHBondContact O-CG1 3.37Å; L217-I221 PolarHBondContact O-N 3Å; L217-L278 HydrophobicContact CD1-CD1 3.63Å; L217-L278 HydrophobicContact CD1-CD2 3.96Å; L217-L278 HydrophobicContact CD1-CG 3.73Å; L217-L278 HydrophobicContact CG-CD1 4.44Å
218I94.4Very high86.9Confident114 Ų11467.7 Ų67.759%0.58538%0.38SS*.Hα-helixtrans-61.7-45.3175.3-70.3165.7000110.8S214 L215 T220 I221 A222S214-I218 VanDerWaalsContact O-CG1 3.29Å; S214-I218 WeakPolarHBondContact O-CG1 3.5Å; S214-I218 PolarHBondContact O-N 3.14Å; L215-I218 PolarHBondContact O-N 3.06Å; L215-I218 VanDerWaalsContact O-N 3.12Å; I218-T220 VanDerWaalsContact C-N 3.29Å; I218-T220 PolarHBondContact O-N 3.34Å; I218-I221 PolarHBondContact O-N 3.47Å; I218-A222 WeakPolarHBondContact O-CB 3.29Å; I218-A222 PolarHBondContact O-N 2.68Å
219E93.6Very high89.6Confident63 Ų6365.7 Ų65.729%0.29437%0.368SS..Hα-helixtrans-57.3-44.7175.1-70.7171.7168.300111.1L215 A222 L223 Y268L215-E219 WeakPolarHBondContact O-CG 3.48Å; L215-E219 PolarHBondContact O-N 3.38Å; E219-A222 WeakPolarHBondContact O-CB 3.41Å; E219-A222 PolarHBondContact O-N 2.99Å; E219-L223 WeakPolarHBondContact O-CG 3.36Å; E219-L223 PolarHBondContact O-N 2.86Å; E219-Y268 WeakPolarHBondContact CB-OH 3.23Å; E219-Y268 VanDerWaalsContact OE2-CE2 3.27Å; E219-Y268 WeakPolarHBondContact OE2-CE2 3.36Å; E219-Y268 PolarHBondContact OE2-OH 3.45Å
220T94.5Very high91.9Very high0 Ų065.8 Ų65.80%036%0.357CS..Hα-helixtrans-66.3-43178.7-54.10000111.9V216 L217 I218 A222 L223 I224 A274 V275 L278V216-T220 WeakPolarHBondContact O-CB 3.38Å; V216-T220 PolarHBondContact O-N 3.02Å; V216-T220 PolarHBondContact O-OG1 2.93Å; L217-T220 PolarHBondContact O-N 3.28Å; I218-T220 VanDerWaalsContact C-N 3.29Å; I218-T220 PolarHBondContact O-N 3.34Å; T220-A222 VanDerWaalsContact C-N 3.31Å; T220-A222 PolarHBondContact O-N 2.99Å; T220-L223 PolarHBondContact O-N 3.41Å; T220-I224 HydrophobicContact CG2-CD1 4.14Å; T220-I224 WeakPolarHBondContact O-CG1 3.28Å; T220-I224 PolarHBondContact O-N 2.86Å; T220-A274 HydrophobicContact CG2-CB 4.45Å; T220-A274 WeakPolarHBondContact OG1-CB 3.44Å; T220-V275 HydrophobicContact CG2-CB 4.27Å; T220-V275 HydrophobicContact CG2-CG2 3.62Å; T220-L278 HydrophobicContact CG2-CD1 3.57Å
221I96.4Very high93.8Very high86 Ų8657.5 Ų57.544%0.44133%0.325SS..Hα-helixtrans-61.9-40.7175.4-70.1167.5000110.4L217 I218 I224 A225 L278L217-I221 HydrophobicContact CG-CD1 4.13Å; L217-I221 WeakPolarHBondContact O-CB 2.8Å; L217-I221 VanDerWaalsContact O-CG1 3.27Å; L217-I221 WeakPolarHBondContact O-CG1 3.37Å; L217-I221 PolarHBondContact O-N 3Å; I218-I221 PolarHBondContact O-N 3.47Å; I221-I224 PolarHBondContact O-N 3.22Å; I221-A225 VanDerWaalsContact O-CB 3.31Å; I221-A225 WeakPolarHBondContact O-CB 3.48Å; I221-A225 PolarHBondContact O-N 3.13Å; I221-L278 HydrophobicContact CG1-CD1 3.72Å; I221-L278 HydrophobicContact CG1-CD2 4.48Å
222A96.4Very high94.9Very high45 Ų4555.8 Ų55.837%0.37231%0.314SS..Hα-helixtrans-60.8-46.2175.300000111.7I218 E219 T220 I224 A225 I226I218-A222 WeakPolarHBondContact O-CB 3.29Å; I218-A222 PolarHBondContact O-N 2.68Å; E219-A222 WeakPolarHBondContact O-CB 3.41Å; E219-A222 PolarHBondContact O-N 2.99Å; T220-A222 VanDerWaalsContact C-N 3.31Å; T220-A222 PolarHBondContact O-N 2.99Å; A222-I224 PolarHBondContact O-N 2.93Å; A222-A225 PolarHBondContact O-N 2.89Å; A222-I226 VanDerWaalsContact O-CG1 3.25Å; A222-I226 WeakPolarHBondContact O-CG1 3.44Å; A222-I226 PolarHBondContact O-N 2.65Å
223L96.7Very high95.5Very high14 Ų1456.5 Ų56.57%0.07332%0.317CS..Hα-helixtrans-59.8-44.9175.3-68.1173.5000111.9L80 E219 T220 I226 C227 L258 L262 Y268 V270L80-L223 HydrophobicContact CD1-CB 4.03Å; L80-L223 HydrophobicContact CD2-CB 4.2Å; E219-L223 WeakPolarHBondContact O-CG 3.36Å; E219-L223 PolarHBondContact O-N 2.86Å; T220-L223 PolarHBondContact O-N 3.41Å; L223-I226 PolarHBondContact O-N 3.21Å; L223-C227 PolarHBondContact O-N 2.71Å; L223-C227 PolarHBondContact O-SG 3.28Å; L223-L258 HydrophobicContact CB-CD2 4.36Å; L223-L258 HydrophobicContact CD2-CD2 3.7Å; L223-L258 HydrophobicContact CD2-CG 4.09Å; L223-L262 HydrophobicContact CD2-CD1 3.58Å; L223-Y268 HydrophobicContact CD1-CD1 4.22Å; L223-Y268 HydrophobicContact CD1-CE1 3.85Å; L223-V270 HydrophobicContact CD1-CG2 4.17Å
224I97.6Very high95.8Very high13 Ų1355.6 Ų55.67%0.06731%0.312CS..Hα-helixtrans-60.7-48.4176-69.7169.6000110.2A73 A76 T77 L80 T220 I221 A222 I226 C227 L228 L278A73-I224 HydrophobicContact CB-CG2 3.74Å; A76-I224 HydrophobicContact CB-CG1 4.48Å; A76-I224 HydrophobicContact CB-CG2 4.27Å; T77-I224 HydrophobicContact CG2-CD1 3.66Å; T77-I224 HydrophobicContact CG2-CG1 4.15Å; L80-I224 HydrophobicContact CD1-CG1 3.84Å; T220-I224 HydrophobicContact CG2-CD1 4.14Å; T220-I224 WeakPolarHBondContact O-CG1 3.28Å; T220-I224 PolarHBondContact O-N 2.86Å; I221-I224 PolarHBondContact O-N 3.22Å; A222-I224 PolarHBondContact O-N 2.93Å; I224-I226 VanDerWaalsContact C-N 3.32Å; I224-I226 PolarHBondContact O-N 3.44Å; I224-C227 WeakPolarHBondContact O-CA 3.17Å; I224-C227 WeakPolarHBondContact O-CB 3.37Å; I224-C227 PolarHBondContact O-N 2.84Å; I224-L228 HydrophobicContact CG2-CD1 3.72Å; I224-L228 WeakPolarHBondContact O-CD1 3.36Å; I224-L228 PolarHBondContact O-N 3.32Å; I224-L278 HydrophobicContact CD1-CB 4.01Å; I224-L278 HydrophobicContact CD1-CD1 4.01Å
225A97.6Very high96Very high44 Ų4451.5 Ų51.536%0.36428%0.284SS..Hα-helixtrans-61-38.4179.800000112.7I221 A222 L228 T229I221-A225 VanDerWaalsContact O-CB 3.31Å; I221-A225 WeakPolarHBondContact O-CB 3.48Å; I221-A225 PolarHBondContact O-N 3.13Å; A222-A225 PolarHBondContact O-N 2.89Å; A225-L228 PolarHBondContact O-N 3.14Å; A225-T229 WeakPolarHBondContact O-CB 3.27Å; A225-T229 PolarHBondContact O-N 3.36Å; A225-T229 PolarHBondContact O-OG1 2.94Å
226I97.5Very high96.1Very high78 Ų7852 Ų5240%0.428%0.283SS..Hα-helixtrans-61.5-48.7171.6-68.6164.3000109.8A222 L223 I224 L228 T229 V230 L258A222-I226 VanDerWaalsContact O-CG1 3.25Å; A222-I226 WeakPolarHBondContact O-CG1 3.44Å; A222-I226 PolarHBondContact O-N 2.65Å; L223-I226 PolarHBondContact O-N 3.21Å; I224-I226 VanDerWaalsContact C-N 3.32Å; I224-I226 PolarHBondContact O-N 3.44Å; I226-L228 VanDerWaalsContact C-N 3.32Å; I226-L228 PolarHBondContact O-N 2.86Å; I226-T229 PolarHBondContact O-N 2.92Å; I226-V230 HydrophobicContact CG2-CG2 4.09Å; I226-V230 WeakPolarHBondContact O-CB 3.16Å; I226-V230 WeakPolarHBondContact O-CG2 3.34Å; I226-V230 PolarHBondContact O-N 3.47Å; I226-L258 HydrophobicContact CB-CD2 4.3Å; I226-L258 HydrophobicContact CG2-CD2 3.98Å
227C98.2Very high96.3Very high0 Ų057.7 Ų57.70%031%0.312CS..Hα-helixtrans-58.7-42.9178.5-64.50000112.3A76 L223 I224 G231 V251 V254 G255A76-C227 HydrophobicContact CB-CB 3.68Å; L223-C227 PolarHBondContact O-N 2.71Å; L223-C227 PolarHBondContact O-SG 3.28Å; I224-C227 WeakPolarHBondContact O-CA 3.17Å; I224-C227 WeakPolarHBondContact O-CB 3.37Å; I224-C227 PolarHBondContact O-N 2.84Å; C227-G231 VanDerWaalsContact O-CA 3.3Å; C227-G231 WeakPolarHBondContact O-CA 3.46Å; C227-G231 PolarHBondContact O-N 3.14Å; C227-V251 HydrophobicContact CB-CG1 4.22Å; C227-V254 HydrophobicContact CB-CG1 4.3Å; C227-G255 VanDerWaalsContact SG-CA 3.53Å
228L97.7Very high96.4Very high36 Ų3657 Ų5719%0.18831%0.309CS..Hα-helixtrans-62.5-48.3177.6-92.662.2000111.4L72 A76 I224 A225 I226 K232 V251L72-L228 HydrophobicContact CB-CD1 4.09Å; L72-L228 HydrophobicContact CB-CD2 4.32Å; L72-L228 HydrophobicContact CB-CG 3.87Å; A76-L228 HydrophobicContact CB-CD1 3.94Å; I224-L228 HydrophobicContact CG2-CD1 3.72Å; I224-L228 WeakPolarHBondContact O-CD1 3.36Å; I224-L228 PolarHBondContact O-N 3.32Å; A225-L228 PolarHBondContact O-N 3.14Å; I226-L228 VanDerWaalsContact C-N 3.32Å; I226-L228 PolarHBondContact O-N 2.86Å; L228-K232 VanDerWaalsContact O-CB 3.26Å; L228-K232 WeakPolarHBondContact O-CB 3.42Å; L228-K232 PolarHBondContact O-N 3.25Å; L228-V251 HydrophobicContact CD1-CG1 3.99Å
229T97.6Very high96.3Very high86 Ų8654.1 Ų54.153%0.52830%0.302SS..Hα-helixtrans-67.8-53.4-176.2-55.90000111A225 I226 K232 I233A225-T229 WeakPolarHBondContact O-CB 3.27Å; A225-T229 PolarHBondContact O-N 3.36Å; A225-T229 PolarHBondContact O-OG1 2.94Å; I226-T229 PolarHBondContact O-N 2.92Å; T229-K232 PolarHBondContact O-N 3.45Å; T229-I233 HydrophobicContact CG2-CD1 4.27Å; T229-I233 WeakPolarHBondContact O-CG1 3.45Å; T229-I233 PolarHBondContact O-N 3.1Å; T229-I233 VanDerWaalsContact O-N 3.07Å
230V98Very high96.1Very high61 Ų6154.5 Ų54.537%0.3732%0.322SS..Hα-helixtrans-66.6-41.6-179.7177.30000110.4I226 K232 I233 V234 V254I226-V230 HydrophobicContact CG2-CG2 4.09Å; I226-V230 WeakPolarHBondContact O-CB 3.16Å; I226-V230 WeakPolarHBondContact O-CG2 3.34Å; I226-V230 PolarHBondContact O-N 3.47Å; V230-K232 VanDerWaalsContact C-N 3.32Å; V230-K232 PolarHBondContact O-N 2.92Å; V230-I233 PolarHBondContact O-N 2.96Å; V230-V234 HydrophobicContact CG1-CG2 4.3Å; V230-V234 VanDerWaalsContact O-CG2 3.31Å; V230-V234 WeakPolarHBondContact O-CG2 3.31Å; V230-V234 PolarHBondContact O-N 3.47Å; V230-V254 HydrophobicContact CB-CG1 3.99Å; V230-V254 HydrophobicContact CB-CG2 4.43Å; V230-V254 HydrophobicContact CG1-CG1 3.98Å; V230-V254 HydrophobicContact CG1-CG2 3.9Å
231G97.7Very high96Very high0 Ų057.3 Ų57.30%034%0.34CS..Hα-helixtrans-62.4-36.717700000113C227 A235 C250C227-G231 VanDerWaalsContact O-CA 3.3Å; C227-G231 WeakPolarHBondContact O-CA 3.46Å; C227-G231 PolarHBondContact O-N 3.14Å; G231-A235 WeakPolarHBondContact O-CB 3.32Å; G231-A235 PolarHBondContact O-N 2.96Å; G231-C250 WeakPolarHBondContact O-CB 3.25Å
232K96.4Very high95.7Very high118 Ų11858.2 Ų58.251%0.51336%0.36SS..Hα-helixtrans-66-43.6172.5-174178.1-179.8-179.70112L228 T229 V230 A235 Q236 T247L228-K232 VanDerWaalsContact O-CB 3.26Å; L228-K232 WeakPolarHBondContact O-CB 3.42Å; L228-K232 PolarHBondContact O-N 3.25Å; T229-K232 PolarHBondContact O-N 3.45Å; V230-K232 VanDerWaalsContact C-N 3.32Å; V230-K232 PolarHBondContact O-N 2.92Å; K232-A235 PolarHBondContact O-N 3.23Å; K232-Q236 VanDerWaalsContact O-CG 3.31Å; K232-Q236 WeakPolarHBondContact O-CG 3.32Å; K232-Q236 PolarHBondContact O-N 3.42Å; K232-T247 HydrophobicContact CB-CG2 4.49Å
233I97.3Very high95.3Very high83 Ų8363.6 Ų63.643%0.42638%0.376SS..Hα-helixtrans-60.5-47.6175.4-66.8165.4000110T229 V230 A235 Q236 L237T229-I233 HydrophobicContact CG2-CD1 4.27Å; T229-I233 WeakPolarHBondContact O-CG1 3.45Å; T229-I233 PolarHBondContact O-N 3.1Å; T229-I233 VanDerWaalsContact O-N 3.07Å; V230-I233 PolarHBondContact O-N 2.96Å; I233-A235 PolarHBondContact O-N 2.98Å; I233-Q236 PolarHBondContact O-N 3.31Å; I233-L237 HydrophobicContact CG2-CD1 3.94Å; I233-L237 HydrophobicContact CG2-CG 4.34Å; I233-L237 VanDerWaalsContact O-CG 3.31Å; I233-L237 WeakPolarHBondContact O-CG 3.25Å; I233-L237 PolarHBondContact O-N 3.38Å
234V96.8Very high95.1Very high50 Ų5066.2 Ų66.230%0.30339%0.387SS..Hα-helixtrans-58.4-46.7176.8171.30000111V230 Q236 L237 L238 C250 V254V230-V234 HydrophobicContact CG1-CG2 4.3Å; V230-V234 VanDerWaalsContact O-CG2 3.31Å; V230-V234 WeakPolarHBondContact O-CG2 3.31Å; V230-V234 PolarHBondContact O-N 3.47Å; V234-Q236 VanDerWaalsContact C-N 3.31Å; V234-Q236 PolarHBondContact O-N 3.08Å; V234-L237 PolarHBondContact O-N 3Å; V234-L238 HydrophobicContact CG1-CD1 3.81Å; V234-L238 HydrophobicContact CG1-CG 4.37Å; V234-L238 VanDerWaalsContact O-CG 3.3Å; V234-L238 WeakPolarHBondContact O-CG 3.32Å; V234-L238 PolarHBondContact O-N 3.23Å; V234-C250 HydrophobicContact CB-CB 4.39Å; V234-C250 HydrophobicContact CG1-CB 4.15Å; V234-V254 HydrophobicContact CG2-CG2 4.4Å
235A95.4Very high94.7Very high9 Ų969 Ų697%0.07440%0.402CS..Hα-helixtrans-61.3-38.9177.600000112.4G231 K232 I233 L238 A239 T247 C250G231-A235 WeakPolarHBondContact O-CB 3.32Å; G231-A235 PolarHBondContact O-N 2.96Å; K232-A235 PolarHBondContact O-N 3.23Å; I233-A235 PolarHBondContact O-N 2.98Å; A235-L238 PolarHBondContact O-N 2.99Å; A235-A239 PolarHBondContact O-N 3.37Å; A235-T247 HydrophobicContact CB-CG2 4.12Å; A235-C250 HydrophobicContact CB-CB 4.13Å
236Q94.8Very high94.5Very high123 Ų12367.9 Ų67.958%0.57539%0.391SS*.Hα-helixtrans-67.1-38.9175.7-74.2175.3-23.100112.5K232 I233 V234 L238 A239K232-Q236 VanDerWaalsContact O-CG 3.31Å; K232-Q236 WeakPolarHBondContact O-CG 3.32Å; K232-Q236 PolarHBondContact O-N 3.42Å; I233-Q236 PolarHBondContact O-N 3.31Å; V234-Q236 VanDerWaalsContact C-N 3.31Å; V234-Q236 PolarHBondContact O-N 3.08Å; Q236-L238 VanDerWaalsContact C-N 3.32Å; Q236-A239 WeakPolarHBondContact O-CB 3.47Å; Q236-A239 PolarHBondContact O-N 3.47Å
237L95.6Very high94.3Very high130 Ų13066.9 Ų66.968%0.68139%0.388SS*.Hα-helixtrans-69-30.5176.6-69.1172.9000112.6I233 V234I233-L237 HydrophobicContact CG2-CD1 3.94Å; I233-L237 HydrophobicContact CG2-CG 4.34Å; I233-L237 VanDerWaalsContact O-CG 3.31Å; I233-L237 WeakPolarHBondContact O-CG 3.25Å; I233-L237 PolarHBondContact O-N 3.38Å; V234-L237 PolarHBondContact O-N 3Å
238L94.8Very high94.2Very high45 Ų4567.4 Ų67.424%0.23639%0.391CS..Hα-helixtrans-85.3-14.9177.4-65.7175000113.3V234 A235 Q236 G240 T241 F243 E244 L245V234-L238 HydrophobicContact CG1-CD1 3.81Å; V234-L238 HydrophobicContact CG1-CG 4.37Å; V234-L238 VanDerWaalsContact O-CG 3.3Å; V234-L238 WeakPolarHBondContact O-CG 3.32Å; V234-L238 PolarHBondContact O-N 3.23Å; A235-L238 PolarHBondContact O-N 2.99Å; Q236-L238 VanDerWaalsContact C-N 3.32Å; L238-G240 PolarHBondContact O-N 2.92Å; L238-T241 WeakPolarHBondContact O-CB 3.25Å; L238-T241 PolarHBondContact O-N 3.24Å; L238-T241 VanDerWaalsContact O-N 3.07Å; L238-T241 PolarHBondContact O-OG1 3.44Å; L238-F243 HydrophobicContact CD2-CB 4.14Å; L238-E244 WeakPolarHBondContact O-CA 3.39Å; L238-L245 HydrophobicContact CD1-CD1 4.48Å
239A91.5Very high94Very high52 Ų5267 Ų6743%0.4339%0.39SS..THydrogen-bonded Turntrans-60.2131.5-177.900000111.4A235 Q236 T241A235-A239 PolarHBondContact O-N 3.37Å; Q236-A239 WeakPolarHBondContact O-CB 3.47Å; Q236-A239 PolarHBondContact O-N 3.47Å; A239-T241 PolarHBondContact O-N 3.35Å
240G89Confident94Very high71 Ų7163 Ų6373%0.73237%0.366SS*.THydrogen-bonded Turntrans76.6-1.4-176.900000115L238 E244L238-G240 PolarHBondContact O-N 2.92Å; G240-E244 PolarHBondContact N-OE2 2.77Å
241T93Very high94Very high60 Ų6060.1 Ų60.137%0.36835%0.348SS..SBendtrans-90166.3172.476.70000111L238 A239 F243 E244L238-T241 WeakPolarHBondContact O-CB 3.25Å; L238-T241 PolarHBondContact O-N 3.24Å; L238-T241 VanDerWaalsContact O-N 3.07Å; L238-T241 PolarHBondContact O-OG1 3.44Å; A239-T241 PolarHBondContact O-N 3.35Å; T241-F243 PolarHBondContact O-N 2.9Å; T241-F243 VanDerWaalsContact O-N 3.12Å; T241-F243 PolarHBondContact OG1-N 2.9Å; T241-E244 WeakPolarHBondContact O-CB 3.25Å; T241-E244 PolarHBondContact O-N 3.4Å; T241-E244 VanDerWaalsContact O-N 3.16Å
242A90.1Very high93.9Very high105 Ų10562.1 Ų62.187%0.86836%0.358SS*.THydrogen-bonded Turntrans-63-15.1172.300000113.6
243F89Confident93.9Very high158 Ų15861.8 Ų61.869%0.69336%0.357SS*.THydrogen-bonded Turntrans-104.222.3178.8-57.9-76000112.2L238 T241 L245L238-F243 HydrophobicContact CD2-CB 4.14Å; T241-F243 PolarHBondContact O-N 2.9Å; T241-F243 VanDerWaalsContact O-N 3.12Å; T241-F243 PolarHBondContact OG1-N 2.9Å; F243-L245 PolarHBondContact O-N 3.39Å
244E90.6Very high94Very high68 Ų6858.7 Ų58.732%0.31834%0.342SS..  trans-59121.5177.6-177.3165.1-175.800111.1R151 L238 G240 T241R151-E244 IonicContact CZ-OE1 2.81Å; R151-E244 IonicContact NH1-OE1 3.08Å; R151-E244 PolarHBondContact NH1-OE1 3.48Å; R151-E244 IonicContact NH1-OE2 3.67Å; R151-E244 IonicContact NH2-OE1 3.81Å; R151-E244 PolarHBondContact NH2-OE1 2.77Å; L238-E244 WeakPolarHBondContact O-CA 3.39Å; G240-E244 PolarHBondContact N-OE2 2.77Å; T241-E244 WeakPolarHBondContact O-CB 3.25Å; T241-E244 PolarHBondContact O-N 3.4Å; T241-E244 VanDerWaalsContact O-N 3.16Å
245L90.9Very high94Very high73 Ų7356.3 Ų56.338%0.38233%0.328SS..  trans-123.3147.5-178.5-71.3173000110.7L238 F243 V249L238-L245 HydrophobicContact CD1-CD1 4.48Å; F243-L245 PolarHBondContact O-N 3.39Å; L245-V249 HydrophobicContact CD1-CG1 4.31Å; L245-V249 HydrophobicContact CD2-CG1 4.46Å
246P92.3Very high94Very high20 Ų2057.2 Ų57.213%0.1333%0.332CS..  trans-58.8143.5172.6-21.932.7000111.6W144 L147 F248 V249 C250W144-P246 HydrophobicContact CH2-CG 3.92Å; W144-P246 HydrophobicContact CZ2-CG 4.36Å; W144-P246 HydrophobicContact CZ3-CG 4.19Å; L147-P246 HydrophobicContact CD2-CB 4.41Å; L147-P246 HydrophobicContact CD2-CG 3.82Å; P246-F248 HydrophobicContact CB-CD1 3.66Å; P246-F248 HydrophobicContact CB-CE1 3.28Å; P246-F248 HydrophobicContact CB-CZ 3.86Å; P246-F248 HydrophobicContact CG-CE1 4Å; P246-F248 HydrophobicContact CG-CZ 4.19Å; P246-F248 PolarHBondContact O-N 3.07Å; P246-F248 VanDerWaalsContact O-N 3.13Å; P246-V249 HydrophobicContact CB-CG2 4.15Å; P246-V249 HydrophobicContact CG-CG2 4.18Å; P246-V249 WeakPolarHBondContact O-CA 3.45Å; P246-V249 WeakPolarHBondContact O-CB 3.29Å; P246-V249 PolarHBondContact O-N 3.28Å; P246-C250 PolarHBondContact O-N 3.38Å
247T94.4Very high94Very high56 Ų5657.3 Ų57.334%0.34434%0.335SS..Hα-helixtrans-55.8-37.6-175.4-51.60000113.3L72 K232 A235 V249 C250 V251L72-T247 HydrophobicContact CD1-CG2 4.28Å; L72-T247 HydrophobicContact CD2-CG2 4.13Å; K232-T247 HydrophobicContact CB-CG2 4.49Å; A235-T247 HydrophobicContact CB-CG2 4.12Å; T247-V249 VanDerWaalsContact C-N 3.27Å; T247-V249 PolarHBondContact O-N 3.1Å; T247-C250 PolarHBondContact O-N 3.41Å; T247-V251 HydrophobicContact CG2-CG2 4.28Å; T247-V251 VanDerWaalsContact O-CG2 3.29Å; T247-V251 WeakPolarHBondContact O-CG2 3.45Å; T247-V251 PolarHBondContact O-N 2.92Å
248F94.4Very high94Very high11 Ų1152.8 Ų52.85%0.04831%0.312CS..Hα-helixtrans-65-30.9178.369.8-95.4000112.8L72 F75 A143 W144 P246 L252L72-F248 HydrophobicContact CD2-CB 3.8Å; F75-F248 HydrophobicContact CB-CB 4.29Å; F75-F248 AromaticContact CD1-CD2 3.89Å; F75-F248 HydrophobicContact CD1-CD2 3.89Å; F75-F248 HydrophobicContact CD2-CB 3.75Å; F75-F248 HydrophobicContact CD2-CD2 4.16Å; F75-F248 HydrophobicContact CD2-CG 4.25Å; F75-F248 AromaticContact CE1-CD2 3.77Å; F75-F248 HydrophobicContact CE1-CD2 3.77Å; F75-F248 HydrophobicContact CE1-CE2 4.24Å; F75-F248 HydrophobicContact CE2-CB 4.27Å; F75-F248 HydrophobicContact CE2-CD2 4.06Å; F75-F248 HydrophobicContact CE2-CG 4.31Å; F75-F248 HydrophobicContact CG-CB 3.94Å; F75-F248 HydrophobicContact CG-CD2 4.1Å; F75-F248 HydrophobicContact CG-CG 4.46Å; F75-F248 AromaticContact CZ-CD2 3.87Å; F75-F248 HydrophobicContact CZ-CD2 3.87Å; F75-F248 HydrophobicContact CZ-CE2 4.29Å; A143-F248 HydrophobicContact CB-CD1 3.79Å; A143-F248 HydrophobicContact CB-CD2 4.27Å; A143-F248 HydrophobicContact CB-CE1 3.84Å; A143-F248 HydrophobicContact CB-CE2 4.33Å; A143-F248 HydrophobicContact CB-CG 4.02Å; A143-F248 HydrophobicContact CB-CZ 4.14Å; W144-F248 AromaticContact CD1-CZ 3.81Å; W144-F248 HydrophobicContact CD2-CZ 4.1Å; W144-F248 AromaticContact CE2-CZ 3.71Å; W144-F248 HydrophobicContact CG-CZ 4.19Å; W144-F248 HydrophobicContact CZ2-CZ 4.2Å; W144-F248 AromaticContact NE1-CZ 3.54Å; P246-F248 HydrophobicContact CB-CD1 3.66Å; P246-F248 HydrophobicContact CB-CE1 3.28Å; P246-F248 HydrophobicContact CB-CZ 3.86Å; P246-F248 HydrophobicContact CG-CE1 4Å; P246-F248 HydrophobicContact CG-CZ 4.19Å; P246-F248 PolarHBondContact O-N 3.07Å; P246-F248 VanDerWaalsContact O-N 3.13Å; F248-L252 WeakPolarHBondContact O-CB 3.27Å; F248-L252 PolarHBondContact O-N 3.13Å
249V94.8Very high93.9Very high28 Ų2851 Ų5117%0.1730%0.303CS..Hα-helixtrans-69.6-45.5174.9179.60000109.7L245 P246 T247 V251 L252 F253L245-V249 HydrophobicContact CD1-CG1 4.31Å; L245-V249 HydrophobicContact CD2-CG1 4.46Å; P246-V249 HydrophobicContact CB-CG2 4.15Å; P246-V249 HydrophobicContact CG-CG2 4.18Å; P246-V249 WeakPolarHBondContact O-CA 3.45Å; P246-V249 WeakPolarHBondContact O-CB 3.29Å; P246-V249 PolarHBondContact O-N 3.28Å; T247-V249 VanDerWaalsContact C-N 3.27Å; T247-V249 PolarHBondContact O-N 3.1Å; V249-V251 PolarHBondContact O-N 3.48Å; V249-L252 PolarHBondContact O-N 3.19Å; V249-F253 HydrophobicContact CG1-CD2 3.68Å; V249-F253 HydrophobicContact CG1-CE2 3.48Å; V249-F253 VanDerWaalsContact CG1-CE2 3.48Å; V249-F253 VanDerWaalsContact O-CD2 3.23Å; V249-F253 WeakPolarHBondContact O-CD2 3.32Å; V249-F253 PolarHBondContact O-N 3.5Å
250C96.8Very high93.9Very high3 Ų349.4 Ų49.42%0.0229%0.287CS..Hα-helixtrans-59.9-44.6174.9-600000111.8G231 V234 A235 P246 T247 F253 V254G231-C250 WeakPolarHBondContact O-CB 3.25Å; V234-C250 HydrophobicContact CB-CB 4.39Å; V234-C250 HydrophobicContact CG1-CB 4.15Å; A235-C250 HydrophobicContact CB-CB 4.13Å; P246-C250 PolarHBondContact O-N 3.38Å; T247-C250 PolarHBondContact O-N 3.41Å; C250-F253 PolarHBondContact O-N 2.91Å; C250-V254 VanDerWaalsContact O-CG2 3.32Å; C250-V254 WeakPolarHBondContact O-CG2 3.16Å; C250-V254 PolarHBondContact O-N 3.33Å
251V97.8Very high94.1Very high0 Ų047.3 Ų47.30%027%0.265CS..Hα-helixtrans-61.9-43177170.50000111.7L72 A76 C227 L228 T247 V249 V254 G255L72-V251 HydrophobicContact CD2-CG2 4.17Å; L72-V251 WeakPolarHBondContact O-CG1 3.36Å; A76-V251 HydrophobicContact CB-CG1 3.7Å; C227-V251 HydrophobicContact CB-CG1 4.22Å; L228-V251 HydrophobicContact CD1-CG1 3.99Å; T247-V251 HydrophobicContact CG2-CG2 4.28Å; T247-V251 VanDerWaalsContact O-CG2 3.29Å; T247-V251 WeakPolarHBondContact O-CG2 3.45Å; T247-V251 PolarHBondContact O-N 2.92Å; V249-V251 PolarHBondContact O-N 3.48Å; V251-V254 PolarHBondContact O-N 2.87Å; V251-G255 PolarHBondContact O-N 3.24Å
252L96.9Very high93.9Very high41 Ų4146.1 Ų46.122%0.21526%0.257CS..Hα-helixtrans-59-49.9174.1178.9155.1000111.1F75 I78 G79 F248 V249 V254 G255 V256F75-L252 HydrophobicContact CB-CB 4.41Å; F75-L252 HydrophobicContact CD1-CD1 4.01Å; I78-L252 HydrophobicContact CB-CD1 4.12Å; I78-L252 HydrophobicContact CG2-CD1 3.71Å; I78-L252 HydrophobicContact CG2-CG 4.4Å; G79-L252 WeakPolarHBondContact CA-O 3.43Å; F248-L252 WeakPolarHBondContact O-CB 3.27Å; F248-L252 PolarHBondContact O-N 3.13Å; V249-L252 PolarHBondContact O-N 3.19Å; L252-V254 VanDerWaalsContact C-N 3.34Å; L252-V254 PolarHBondContact O-N 3.24Å; L252-G255 WeakPolarHBondContact O-CA 3.37Å; L252-G255 PolarHBondContact O-N 3.29Å; L252-V256 HydrophobicContact CD2-CG2 4.01Å; L252-V256 WeakPolarHBondContact O-CG2 3.4Å; L252-V256 PolarHBondContact O-N 2.89Å
253F96.4Very high93.8Very high112 Ų11243.9 Ų43.949%0.49124%0.235SC..Hα-helixtrans-62.1-40.1-179.7-83.4-62.9000112.7V249 C250 G255 V256 I257V249-F253 HydrophobicContact CG1-CD2 3.68Å; V249-F253 HydrophobicContact CG1-CE2 3.48Å; V249-F253 VanDerWaalsContact CG1-CE2 3.48Å; V249-F253 VanDerWaalsContact O-CD2 3.23Å; V249-F253 WeakPolarHBondContact O-CD2 3.32Å; V249-F253 PolarHBondContact O-N 3.5Å; C250-F253 PolarHBondContact O-N 2.91Å; F253-G255 VanDerWaalsContact C-N 3.26Å; F253-G255 PolarHBondContact O-N 3.4Å; F253-V256 WeakPolarHBondContact O-CB 3.28Å; F253-V256 PolarHBondContact O-N 2.95Å; F253-I257 WeakPolarHBondContact O-CG1 3.34Å; F253-I257 PolarHBondContact O-N 2.92Å
254V97.6Very high93.6Very high18 Ų1843 Ų4311%0.10924%0.236CC..Hα-helixtrans-60-40.8172.41730000110.6C227 V230 V234 C250 V251 L252 V256 I257 L258C227-V254 HydrophobicContact CB-CG1 4.3Å; V230-V254 HydrophobicContact CB-CG1 3.99Å; V230-V254 HydrophobicContact CB-CG2 4.43Å; V230-V254 HydrophobicContact CG1-CG1 3.98Å; V230-V254 HydrophobicContact CG1-CG2 3.9Å; V234-V254 HydrophobicContact CG2-CG2 4.4Å; C250-V254 VanDerWaalsContact O-CG2 3.32Å; C250-V254 WeakPolarHBondContact O-CG2 3.16Å; C250-V254 PolarHBondContact O-N 3.33Å; V251-V254 PolarHBondContact O-N 2.87Å; L252-V254 VanDerWaalsContact C-N 3.34Å; L252-V254 PolarHBondContact O-N 3.24Å; V254-V256 PolarHBondContact O-N 3.08Å; V254-I257 PolarHBondContact O-N 3.07Å; V254-L258 WeakPolarHBondContact O-CB 3.38Å; V254-L258 PolarHBondContact O-N 3.46Å
255G97.2Very high93.3Very high0 Ų045.7 Ų45.70%025%0.25CC..Hα-helixtrans-56.7-45.9172.600000113.1G79 C227 V251 L252 F253 L258 S259G79-G255 CarbonylContact O-C 3.31Å; C227-G255 VanDerWaalsContact SG-CA 3.53Å; V251-G255 PolarHBondContact O-N 3.24Å; L252-G255 WeakPolarHBondContact O-CA 3.37Å; L252-G255 PolarHBondContact O-N 3.29Å; F253-G255 VanDerWaalsContact C-N 3.26Å; F253-G255 PolarHBondContact O-N 3.4Å; G255-L258 PolarHBondContact O-N 3.26Å; G255-S259 WeakPolarHBondContact O-CB 3.14Å; G255-S259 PolarHBondContact O-N 2.84Å; G255-S259 PolarHBondContact O-OG 3.23Å; G255-S259 VanDerWaalsContact O-OG 3.08Å
256V95.5Very high92.8Very high28 Ų2845.3 Ų45.317%0.1726%0.263CS..Hα-helixtrans-61.6-46.5176.81800000111.3G79 A82 I84 L252 F253 V254 L258 S259 N260G79-V256 WeakPolarHBondContact O-CA 3.35Å; G79-V256 PolarHBondContact O-N 3.45Å; A82-V256 HydrophobicContact CB-CB 4.42Å; A82-V256 HydrophobicContact CB-CG1 4.24Å; A82-V256 HydrophobicContact CB-CG2 3.77Å; I84-V256 HydrophobicContact CD1-CG1 4.17Å; I84-V256 HydrophobicContact CG1-CG1 4.5Å; L252-V256 HydrophobicContact CD2-CG2 4.01Å; L252-V256 WeakPolarHBondContact O-CG2 3.4Å; L252-V256 PolarHBondContact O-N 2.89Å; F253-V256 WeakPolarHBondContact O-CB 3.28Å; F253-V256 PolarHBondContact O-N 2.95Å; V254-V256 PolarHBondContact O-N 3.08Å; V256-L258 VanDerWaalsContact C-N 3.34Å; V256-S259 PolarHBondContact O-OG 2.83Å; V256-N260 WeakPolarHBondContact O-CB 3.14Å; V256-N260 PolarHBondContact O-N 3.44Å; V256-N260 VanDerWaalsContact O-N 3.17Å; V256-N260 PolarHBondContact O-ND2 2.85Å
257I95.5Very high92Very high124 Ų12451.5 Ų51.564%0.63629%0.289SS*.Hα-helixtrans-63.6-44.1179.5-67.7165.8000110.1F253 V254 G261F253-I257 WeakPolarHBondContact O-CG1 3.34Å; F253-I257 PolarHBondContact O-N 2.92Å; V254-I257 PolarHBondContact O-N 3.07Å; I257-G261 WeakPolarHBondContact O-CA 3.41Å; I257-G261 PolarHBondContact O-N 3.2Å
258L94.7Very high91.2Very high35 Ų3551.5 Ų51.518%0.18328%0.283CS..Hα-helixtrans-66.7-48.3-177.3-173.261000111.5L80 L223 I226 V254 G255 V256 L262L80-L258 HydrophobicContact CD2-CB 4.43Å; L80-L258 HydrophobicContact CD2-CD2 4.23Å; L80-L258 HydrophobicContact CD2-CG 4.47Å; L223-L258 HydrophobicContact CB-CD2 4.36Å; L223-L258 HydrophobicContact CD2-CD2 3.7Å; L223-L258 HydrophobicContact CD2-CG 4.09Å; I226-L258 HydrophobicContact CB-CD2 4.3Å; I226-L258 HydrophobicContact CG2-CD2 3.98Å; V254-L258 WeakPolarHBondContact O-CB 3.38Å; V254-L258 PolarHBondContact O-N 3.46Å; G255-L258 PolarHBondContact O-N 3.26Å; V256-L258 VanDerWaalsContact C-N 3.34Å; L258-L262 HydrophobicContact CD1-CD1 3.8Å; L258-L262 HydrophobicContact CD1-CG 4.06Å; L258-L262 HydrophobicContact CG-CD1 3.91Å; L258-L262 VanDerWaalsContact O-CB 3.31Å; L258-L262 WeakPolarHBondContact O-CB 3.42Å; L258-L262 WeakPolarHBondContact O-CG 3.33Å; L258-L262 PolarHBondContact O-N 2.64Å
259S93.2Very high90.4Very high7 Ų761.1 Ų61.15%0.04932%0.318CS..Hα-helixtrans-63.3-47.9-179.259.40000112.5G79 L80 A82 G255 V256 S263G79-S259 PolarHBondContact O-OG 2.87Å; L80-S259 WeakPolarHBondContact O-CB 3.27Å; A82-S259 PolarHBondContact O-OG 3.31Å; G255-S259 WeakPolarHBondContact O-CB 3.14Å; G255-S259 PolarHBondContact O-N 2.84Å; G255-S259 PolarHBondContact O-OG 3.23Å; G255-S259 VanDerWaalsContact O-OG 3.08Å; V256-S259 PolarHBondContact O-OG 2.83Å; S259-S263 WeakPolarHBondContact O-CB 3.44Å; S259-S263 PolarHBondContact O-N 3.46Å; S259-S263 VanDerWaalsContact O-N 3.12Å
260N92.5Very high89.7Confident19 Ų1960.8 Ų60.810%0.10232%0.317CS..Hα-helixtrans-73.5-37.2-178.6-69.2-89.6000111.3A82 I84 V256 S263 I264A82-N260 PolarHBondContact O-ND2 2.87Å; I84-N260 WeakPolarHBondContact CB-OD1 3.39Å; I84-N260 HydrophobicContact CD1-CB 3.95Å; I84-N260 WeakPolarHBondContact CG1-OD1 3.33Å; I84-N260 PolarHBondContact N-OD1 3.36Å; V256-N260 WeakPolarHBondContact O-CB 3.14Å; V256-N260 PolarHBondContact O-N 3.44Å; V256-N260 VanDerWaalsContact O-N 3.17Å; V256-N260 PolarHBondContact O-ND2 2.85Å; N260-S263 PolarHBondContact O-N 2.9Å; N260-I264 WeakPolarHBondContact O-CB 3.5Å; N260-I264 WeakPolarHBondContact O-CD1 3.34Å; N260-I264 WeakPolarHBondContact O-CG1 3.5Å; N260-I264 PolarHBondContact O-N 3.12Å
261G91.7Very high89.1Confident27 Ų2762.5 Ų62.528%0.27832%0.324SS..Hα-helixtrans-62-51.1175.400000112.4I257 S263 I264 M265I257-G261 WeakPolarHBondContact O-CA 3.41Å; I257-G261 PolarHBondContact O-N 3.2Å; G261-S263 VanDerWaalsContact C-N 3.3Å; G261-S263 PolarHBondContact O-N 2.95Å; G261-I264 PolarHBondContact O-N 3.34Å; G261-M265 VanDerWaalsContact O-CG 3.26Å; G261-M265 WeakPolarHBondContact O-CG 3.43Å; G261-M265 PolarHBondContact O-N 2.96Å
262L90.1Very high88.5Confident35 Ų3568 Ų6818%0.18335%0.349CS..Hα-helixtrans-60.9-39177.2-71.5172.5000112.3L223 L258 G266 F267 Y268L223-L262 HydrophobicContact CD2-CD1 3.58Å; L258-L262 HydrophobicContact CD1-CD1 3.8Å; L258-L262 HydrophobicContact CD1-CG 4.06Å; L258-L262 HydrophobicContact CG-CD1 3.91Å; L258-L262 VanDerWaalsContact O-CB 3.31Å; L258-L262 WeakPolarHBondContact O-CB 3.42Å; L258-L262 WeakPolarHBondContact O-CG 3.33Å; L258-L262 PolarHBondContact O-N 2.64Å; L262-G266 PolarHBondContact O-N 3.2Å; L262-F267 HydrophobicContact CD2-CB 4.36Å; L262-F267 PolarHBondContact O-N 3.17Å; L262-Y268 CarbonylContact C-O 2.88Å
263S86.4Confident88.1Confident58 Ų5870.4 Ų70.441%0.40636%0.356SS..Hα-helixtrans-68.1-39.3177.7-173.90000112.6S259 N260 G261 G266S259-S263 WeakPolarHBondContact O-CB 3.44Å; S259-S263 PolarHBondContact O-N 3.46Å; S259-S263 VanDerWaalsContact O-N 3.12Å; N260-S263 PolarHBondContact O-N 2.9Å; G261-S263 VanDerWaalsContact C-N 3.3Å; G261-S263 PolarHBondContact O-N 2.95Å; S263-G266 PolarHBondContact O-N 3.41Å
264I85.3Confident87.9Confident140 Ų14065 Ų6572%0.71833%0.332SS*.Hα-helixtrans-69.1-39.9178.3-71.5164.5000110.9N260 G261 G266N260-I264 WeakPolarHBondContact O-CB 3.5Å; N260-I264 WeakPolarHBondContact O-CD1 3.34Å; N260-I264 WeakPolarHBondContact O-CG1 3.5Å; N260-I264 PolarHBondContact O-N 3.12Å; G261-I264 PolarHBondContact O-N 3.34Å; I264-G266 PolarHBondContact O-N 3.45Å
265M85.9Confident87.7Confident125 Ų12564.2 Ų64.262%0.61633%0.327SS*.Hα-helixtrans-72.5-11.9177.5-63.3176.589.700113G261 F267G261-M265 VanDerWaalsContact O-CG 3.26Å; G261-M265 WeakPolarHBondContact O-CG 3.43Å; G261-M265 PolarHBondContact O-N 2.96Å; M265-F267 HydrophobicContact CB-CD2 3.59Å; M265-F267 HydrophobicContact CB-CE2 3.95Å; M265-F267 HydrophobicContact CB-CG 4.19Å; M265-F267 HydrophobicContact CE-CD2 4.02Å; M265-F267 HydrophobicContact CE-CE2 3.31Å; M265-F267 HydrophobicContact CE-CZ 4.16Å; M265-F267 HydrophobicContact CG-CD2 4.38Å; M265-F267 HydrophobicContact CG-CE2 4.46Å; M265-F267 PolarHBondContact O-N 2.91Å; M265-F267 HydrophobicContact SD-CD2 3.94Å; M265-F267 HydrophobicContact SD-CE2 3.87Å
266G79Confident87.4Confident64 Ų6466.2 Ų66.266%0.6634%0.341SS*.THydrogen-bonded Turntrans71.87.6-177.800000114.5L262 S263 I264L262-G266 PolarHBondContact O-N 3.2Å; S263-G266 PolarHBondContact O-N 3.41Å; I264-G266 PolarHBondContact O-N 3.45Å
267F75Confident87.3Confident151 Ų15167.9 Ų67.966%0.66235%0.351SS*.SBendtrans-72.1-40.7-177.3-73.5-42.8000113.1L262 M265L262-F267 HydrophobicContact CD2-CB 4.36Å; L262-F267 PolarHBondContact O-N 3.17Å; M265-F267 HydrophobicContact CB-CD2 3.59Å; M265-F267 HydrophobicContact CB-CE2 3.95Å; M265-F267 HydrophobicContact CB-CG 4.19Å; M265-F267 HydrophobicContact CE-CD2 4.02Å; M265-F267 HydrophobicContact CE-CE2 3.31Å; M265-F267 HydrophobicContact CE-CZ 4.16Å; M265-F267 HydrophobicContact CG-CD2 4.38Å; M265-F267 HydrophobicContact CG-CE2 4.46Å; M265-F267 PolarHBondContact O-N 2.91Å; M265-F267 HydrophobicContact SD-CD2 3.94Å; M265-F267 HydrophobicContact SD-CE2 3.87Å
268Y77.8Confident87.3Confident56 Ų5663.3 Ų63.322%0.2233%0.328CS..  trans-157.2133.3-175.8-170.6-100.8000110E219 L223 L262E219-Y268 WeakPolarHBondContact CB-OH 3.23Å; E219-Y268 VanDerWaalsContact OE2-CE2 3.27Å; E219-Y268 WeakPolarHBondContact OE2-CE2 3.36Å; E219-Y268 PolarHBondContact OE2-OH 3.45Å; L223-Y268 HydrophobicContact CD1-CD1 4.22Å; L223-Y268 HydrophobicContact CD1-CE1 3.85Å; L262-Y268 CarbonylContact C-O 2.88Å
269R77.9Confident87.3Confident212 Ų21261.7 Ų61.780%0.832%0.32SS*.  trans-98.9118.8167.1-71.5-171.4179.2-175.70.6108.2F271R269-F271 PolarHBondContact O-N 2.82Å
270V80.4Confident87.3Confident22 Ų2266 Ų6613%0.13334%0.342CS..  trans-54.5125.3177.71770000109.7L80 L223 E272 V275L80-V270 HydrophobicContact CB-CG1 4.45Å; L223-V270 HydrophobicContact CD1-CG2 4.17Å; V270-E272 PolarHBondContact O-N 2.69Å; V270-E272 VanDerWaalsContact O-N 3.08Å; V270-V275 HydrophobicContact CG1-CG2 3.38Å
271F84.4Confident87.5Confident39 Ų3968.5 Ų68.517%0.17136%0.358CS..  trans-81.191.8177.1-171.6-117.9000110.3R210 I212 V216 R269 R273 A274 V275R210-F271 HydrophobicContact CB-CE2 4.04Å; R210-F271 HydrophobicContact CB-CZ 3.96Å; R210-F271 HydrophobicContact CG-CE2 4.37Å; R210-F271 HydrophobicContact CG-CZ 4.38Å; I212-F271 HydrophobicContact CG1-CE1 4.26Å; V216-F271 HydrophobicContact CG1-CB 3.88Å; V216-F271 HydrophobicContact CG1-CD1 3.35Å; V216-F271 HydrophobicContact CG1-CE1 4.13Å; V216-F271 HydrophobicContact CG1-CG 3.89Å; R269-F271 PolarHBondContact O-N 2.82Å; F271-R273 HydrophobicContact CD1-CB 4.27Å; F271-R273 HydrophobicContact CE1-CB 3.74Å; F271-R273 HydrophobicContact CE2-CB 4.47Å; F271-R273 HydrophobicContact CZ-CB 3.85Å; F271-R273 PolarHBondContact O-N 3.37Å; F271-A274 HydrophobicContact CD1-CB 3.6Å; F271-A274 HydrophobicContact CE1-CB 4.3Å; F271-A274 PolarHBondContact O-N 3.46Å; F271-V275 PolarHBondContact O-N 3.33Å; F271-V275 VanDerWaalsContact O-N 3.16Å
272E85.5Confident87.7Confident114 Ų11467.7 Ų67.753%0.53335%0.348SS..Hα-helixtrans-49.5-36.4-173.4-63.5179.2-175.200113.5V270 S276V270-E272 PolarHBondContact O-N 2.69Å; V270-E272 VanDerWaalsContact O-N 3.08Å; E272-S276 VanDerWaalsContact O-CB 3.22Å; E272-S276 WeakPolarHBondContact O-CB 3.39Å; E272-S276 PolarHBondContact O-N 2.62Å; E272-S276 PolarHBondContact O-OG 3.32Å
273R87.6Confident87.9Confident92 Ų9267.6 Ų67.635%0.34735%0.347SS..Hα-helixtrans-66.6-42.7179.6-167.9-179.3-67.4165.8-0112.3D207 R210 I212 F271 V277D207-R273 PolarHBondContact O-NH2 3.14Å; R210-R273 PolarHBondContact O-NH1 2.99Å; I212-R273 HydrophobicContact CD1-CG 4.48Å; F271-R273 HydrophobicContact CD1-CB 4.27Å; F271-R273 HydrophobicContact CE1-CB 3.74Å; F271-R273 HydrophobicContact CE2-CB 4.47Å; F271-R273 HydrophobicContact CZ-CB 3.85Å; F271-R273 PolarHBondContact O-N 3.37Å; R273-V277 WeakPolarHBondContact O-CG2 3.13Å; R273-V277 PolarHBondContact O-N 3Å
274A91.9Very high88.3Confident0 Ų066.2 Ų66.20%034%0.338CS..Hα-helixtrans-70.8-40.2176.900000111.8V216 T220 F271 S276 V277 L278V216-A274 HydrophobicContact CG1-CB 3.76Å; T220-A274 HydrophobicContact CG2-CB 4.45Å; T220-A274 WeakPolarHBondContact OG1-CB 3.44Å; F271-A274 HydrophobicContact CD1-CB 3.6Å; F271-A274 HydrophobicContact CE1-CB 4.3Å; F271-A274 PolarHBondContact O-N 3.46Å; A274-S276 VanDerWaalsContact C-N 3.33Å; A274-S276 PolarHBondContact O-N 3.04Å; A274-V277 PolarHBondContact O-N 2.84Å; A274-L278 PolarHBondContact O-N 3.45Å
275V93.8Very high88.8Confident0 Ų060.6 Ų60.60%031%0.309CS..Hα-helixtrans-57.1-48.5173.2173.90000110.5T77 L80 N81 T220 V270 F271 V277 L278 G279T77-V275 HydrophobicContact CG2-CG1 4.01Å; T77-V275 WeakPolarHBondContact CG2-O 3.26Å; T77-V275 WeakPolarHBondContact O-CG1 3.49Å; L80-V275 HydrophobicContact CB-CG1 3.93Å; L80-V275 HydrophobicContact CB-CG2 4.36Å; N81-V275 WeakPolarHBondContact OD1-CG1 3.27Å; T220-V275 HydrophobicContact CG2-CB 4.27Å; T220-V275 HydrophobicContact CG2-CG2 3.62Å; V270-V275 HydrophobicContact CG1-CG2 3.38Å; F271-V275 PolarHBondContact O-N 3.33Å; F271-V275 VanDerWaalsContact O-N 3.16Å; V275-V277 PolarHBondContact O-N 3Å; V275-L278 PolarHBondContact O-N 3.37Å; V275-G279 PolarHBondContact O-N 2.86Å
276S92Very high89.2Confident42 Ų4254.7 Ų54.729%0.29428%0.28SS..Hα-helixtrans-65.1-39.6-179-58.80000112.5N81 E272 A274 G279 N280N81-S276 PolarHBondContact ND2-OG 3.02Å; N81-S276 VanDerWaalsContact ND2-OG 3.12Å; E272-S276 VanDerWaalsContact O-CB 3.22Å; E272-S276 WeakPolarHBondContact O-CB 3.39Å; E272-S276 PolarHBondContact O-N 2.62Å; E272-S276 PolarHBondContact O-OG 3.32Å; A274-S276 VanDerWaalsContact C-N 3.33Å; A274-S276 PolarHBondContact O-N 3.04Å; S276-G279 PolarHBondContact O-N 3.39Å; S276-N280 WeakPolarHBondContact O-CB 3.36Å; S276-N280 PolarHBondContact O-N 3.48Å; S276-N280 PolarHBondContact O-ND2 3.17Å; S276-N280 VanDerWaalsContact O-ND2 3.17Å
277V93.4Very high89.8Confident63 Ų6351.8 Ų51.838%0.38225%0.25SC..Hα-helixtrans-63.4-49175.3168.30000111.1I212 R273 A274 V275 G279 N280 V281I212-V277 HydrophobicContact CD1-CB 4.14Å; I212-V277 HydrophobicContact CD1-CG1 4.41Å; I212-V277 HydrophobicContact CD1-CG2 3.69Å; R273-V277 WeakPolarHBondContact O-CG2 3.13Å; R273-V277 PolarHBondContact O-N 3Å; A274-V277 PolarHBondContact O-N 2.84Å; V275-V277 PolarHBondContact O-N 3Å; V277-G279 VanDerWaalsContact C-N 3.32Å; V277-G279 PolarHBondContact O-N 2.56Å; V277-N280 PolarHBondContact O-N 3.42Å; V277-V281 HydrophobicContact CG1-CG2 4.5Å; V277-V281 VanDerWaalsContact O-CG2 3.31Å; V277-V281 WeakPolarHBondContact O-CG2 3.24Å; V277-V281 PolarHBondContact O-N 3.22Å
278L95.7Very high90.7Very high29 Ų2944.6 Ų44.615%0.15222%0.218CC..Hα-helixtrans-64.1-37.9177.6-79.5172.2000112.3L217 T220 I221 I224 A274 V275 S282L217-L278 HydrophobicContact CD1-CD1 3.63Å; L217-L278 HydrophobicContact CD1-CD2 3.96Å; L217-L278 HydrophobicContact CD1-CG 3.73Å; L217-L278 HydrophobicContact CG-CD1 4.44Å; T220-L278 HydrophobicContact CG2-CD1 3.57Å; I221-L278 HydrophobicContact CG1-CD1 3.72Å; I221-L278 HydrophobicContact CG1-CD2 4.48Å; I224-L278 HydrophobicContact CD1-CB 4.01Å; I224-L278 HydrophobicContact CD1-CD1 4.01Å; A274-L278 PolarHBondContact O-N 3.45Å; V275-L278 PolarHBondContact O-N 3.37Å; L278-S282 VanDerWaalsContact O-CB 3.24Å; L278-S282 WeakPolarHBondContact O-CB 3.35Å; L278-S282 PolarHBondContact O-N 3.25Å; L278-S282 PolarHBondContact O-OG 3.34Å
279G94.8Very high91.5Very high1 Ų142 Ų421%0.0121%0.208CC..Hα-helixtrans-60.4-48.8174.100000112.3T77 V275 S276 V277 S282 L283T77-G279 VanDerWaalsContact CG2-CA 3.48Å; T77-G279 WeakPolarHBondContact OG1-CA 3.38Å; V275-G279 PolarHBondContact O-N 2.86Å; S276-G279 PolarHBondContact O-N 3.39Å; V277-G279 VanDerWaalsContact C-N 3.32Å; V277-G279 PolarHBondContact O-N 2.56Å; G279-S282 PolarHBondContact O-N 3.15Å; G279-L283 WeakPolarHBondContact O-CB 3.35Å; G279-L283 PolarHBondContact O-N 2.86Å
280N93.1Very high92.1Very high96 Ų9632.1 Ų32.151%0.51317%0.171SC..Hα-helixtrans-65.6-40.6179.1-72.9-27.4000112.6S276 V277 S284S276-N280 WeakPolarHBondContact O-CB 3.36Å; S276-N280 PolarHBondContact O-N 3.48Å; S276-N280 PolarHBondContact O-ND2 3.17Å; S276-N280 VanDerWaalsContact O-ND2 3.17Å; V277-N280 PolarHBondContact O-N 3.42Å; N280-S284 VanDerWaalsContact O-CB 3.25Å; N280-S284 WeakPolarHBondContact O-CB 3.34Å; N280-S284 PolarHBondContact O-N 3.47Å; N280-S284 PolarHBondContact O-OG 2.92Å
281V95.9Very high92.6Very high72 Ų7231.2 Ų31.244%0.43617%0.166SC..Hα-helixtrans-63.6-45.7174.5170.70000110.4V277 S284 L285V277-V281 HydrophobicContact CG1-CG2 4.5Å; V277-V281 VanDerWaalsContact O-CG2 3.31Å; V277-V281 WeakPolarHBondContact O-CG2 3.24Å; V277-V281 PolarHBondContact O-N 3.22Å; V281-S284 PolarHBondContact O-N 2.98Å; V281-L285 HydrophobicContact CG1-CD1 3.9Å; V281-L285 WeakPolarHBondContact O-CG 3.24Å; V281-L285 PolarHBondContact O-N 2.95Å
282S96.4Very high92.8Very high11 Ų1129.5 Ų29.58%0.07716%0.159CC..Hα-helixtrans-63.4-47.5-179.8-57.30000111.5L70 L278 G279 S284 L285 F286L70-S282 WeakPolarHBondContact O-CB 3.17Å; L278-S282 VanDerWaalsContact O-CB 3.24Å; L278-S282 WeakPolarHBondContact O-CB 3.35Å; L278-S282 PolarHBondContact O-N 3.25Å; L278-S282 PolarHBondContact O-OG 3.34Å; G279-S282 PolarHBondContact O-N 3.15Å; S282-S284 VanDerWaalsContact C-N 3.33Å; S282-S284 PolarHBondContact O-N 2.9Å; S282-L285 PolarHBondContact O-N 3.34Å; S282-F286 WeakPolarHBondContact O-CB 3.48Å; S282-F286 PolarHBondContact O-N 3.5Å
283L93.9Very high92.8Very high32 Ų3225.8 Ų25.817%0.16815%0.15CC..Hα-helixtrans-57.4-46.5173.9179.964.3000111.3F74 G279 F286 L287F74-L283 HydrophobicContact CB-CB 4.36Å; F74-L283 HydrophobicContact CD1-CD1 3.93Å; F74-L283 HydrophobicContact CD2-CB 3.62Å; F74-L283 HydrophobicContact CD2-CD1 4.21Å; F74-L283 HydrophobicContact CD2-CD2 4.25Å; F74-L283 HydrophobicContact CD2-CG 4.23Å; F74-L283 HydrophobicContact CE1-CD1 3.84Å; F74-L283 HydrophobicContact CE2-CB 3.98Å; F74-L283 HydrophobicContact CE2-CD1 4.12Å; F74-L283 HydrophobicContact CE2-CD2 3.71Å; F74-L283 HydrophobicContact CE2-CG 4.14Å; F74-L283 HydrophobicContact CG-CB 3.95Å; F74-L283 HydrophobicContact CG-CD1 4.08Å; F74-L283 HydrophobicContact CZ-CD1 3.91Å; F74-L283 HydrophobicContact CZ-CD2 3.94Å; F74-L283 HydrophobicContact CZ-CG 4.37Å; G279-L283 WeakPolarHBondContact O-CB 3.35Å; G279-L283 PolarHBondContact O-N 2.86Å; L283-F286 HydrophobicContact CD1-CD1 4.28Å; L283-F286 PolarHBondContact O-N 2.97Å; L283-L287 HydrophobicContact CD1-CD1 3.74Å; L283-L287 HydrophobicContact CD1-CD2 4.47Å; L283-L287 HydrophobicContact CD1-CG 3.88Å; L283-L287 HydrophobicContact CD2-CD1 4.48Å; L283-L287 HydrophobicContact CG-CD1 3.83Å; L283-L287 HydrophobicContact CG-CG 4.27Å; L283-L287 WeakPolarHBondContact O-CB 3.4Å; L283-L287 VanDerWaalsContact O-CG 3.24Å; L283-L287 WeakPolarHBondContact O-CG 3.5Å; L283-L287 PolarHBondContact O-N 3.3Å
284S94.9Very high92.6Very high30 Ų3022 Ų2221%0.2114%0.137CC..Hα-helixtrans-63-48.3-176.9-62.90000111.7N280 V281 S282 L287 A288N280-S284 VanDerWaalsContact O-CB 3.25Å; N280-S284 WeakPolarHBondContact O-CB 3.34Å; N280-S284 PolarHBondContact O-N 3.47Å; N280-S284 PolarHBondContact O-OG 2.92Å; V281-S284 PolarHBondContact O-N 2.98Å; S282-S284 VanDerWaalsContact C-N 3.33Å; S282-S284 PolarHBondContact O-N 2.9Å; S284-L287 PolarHBondContact O-N 3.25Å; S284-A288 VanDerWaalsContact O-CB 3.31Å; S284-A288 WeakPolarHBondContact O-CB 3.41Å; S284-A288 PolarHBondContact O-N 3.36Å
285L95.8Very high92.2Very high22 Ų2226.4 Ų26.412%0.11516%0.156CC..Hα-helixtrans-64.8-44.5177.8-71.5169.8000111.8L10 A13 T14 L17 L70 V281 S282 A288 M289L10-L285 HydrophobicContact CD1-CD1 4.39Å; L10-L285 HydrophobicContact CD1-CD2 4.03Å; A13-L285 HydrophobicContact CB-CD2 4.43Å; T14-L285 HydrophobicContact CG2-CD2 3.71Å; L17-L285 HydrophobicContact CD1-CD2 3.69Å; L17-L285 HydrophobicContact CD1-CG 4.1Å; L70-L285 HydrophobicContact CD1-CB 3.62Å; L70-L285 HydrophobicContact CD2-CB 4.25Å; L70-L285 HydrophobicContact CD2-CD1 4.1Å; V281-L285 HydrophobicContact CG1-CD1 3.9Å; V281-L285 WeakPolarHBondContact O-CG 3.24Å; V281-L285 PolarHBondContact O-N 2.95Å; S282-L285 PolarHBondContact O-N 3.34Å; L285-A288 PolarHBondContact O-N 3.36Å; L285-M289 WeakPolarHBondContact O-CG 3.47Å; L285-M289 PolarHBondContact O-N 2.9Å
286F93.6Very high91.6Very high0 Ų027.5 Ų27.50%016%0.162CC..Hα-helixtrans-56.6-50.7175.7160.9-121.8000111.9R67 L70 M71 A142 S282 L283 M289 A290R67-F286 HydrophobicContact CG-CD2 3.52Å; R67-F286 HydrophobicContact CG-CE2 3.69Å; R67-F286 WeakPolarHBondContact O-CD2 3.36Å; L70-F286 HydrophobicContact CB-CB 3.94Å; M71-F286 HydrophobicContact CB-CD1 4.23Å; M71-F286 HydrophobicContact CB-CD2 3.71Å; M71-F286 HydrophobicContact CB-CE1 4.15Å; M71-F286 HydrophobicContact CB-CE2 3.65Å; M71-F286 HydrophobicContact CB-CG 3.99Å; M71-F286 HydrophobicContact CB-CZ 3.84Å; M71-F286 HydrophobicContact CG-CD1 4.37Å; M71-F286 HydrophobicContact CG-CD2 4.36Å; M71-F286 HydrophobicContact CG-CE1 3.85Å; M71-F286 HydrophobicContact CG-CE2 3.87Å; M71-F286 HydrophobicContact CG-CZ 3.55Å; M71-F286 HydrophobicContact SD-CE1 4.46Å; M71-F286 HydrophobicContact SD-CE2 3.92Å; M71-F286 HydrophobicContact SD-CZ 3.65Å; A142-F286 HydrophobicContact CB-CE1 3.39Å; A142-F286 HydrophobicContact CB-CE2 4.25Å; A142-F286 HydrophobicContact CB-CZ 3.17Å; S282-F286 WeakPolarHBondContact O-CB 3.48Å; S282-F286 PolarHBondContact O-N 3.5Å; L283-F286 HydrophobicContact CD1-CD1 4.28Å; L283-F286 PolarHBondContact O-N 2.97Å; F286-M289 PolarHBondContact O-N 3.32Å; F286-A290 WeakPolarHBondContact O-CB 3.41Å; F286-A290 PolarHBondContact O-N 3.43Å
287L92.6Very high91.1Very high4 Ų430.6 Ų30.62%0.02117%0.167CC..Hα-helixtrans-64.9-43.2179-70.7179.1000111P38 H138 A142 M162 L283 S284 M289 A290 L291P38-L287 HydrophobicContact CB-CB 3.64Å; P38-L287 HydrophobicContact CB-CD1 4.45Å; P38-L287 HydrophobicContact CG-CB 4.28Å; P38-L287 HydrophobicContact CG-CD1 4.43Å; H138-L287 HydrophobicContact CB-CD1 3.79Å; H138-L287 HydrophobicContact CB-CD2 3.87Å; A142-L287 HydrophobicContact CB-CD2 4.16Å; M162-L287 HydrophobicContact CE-CD2 4.16Å; M162-L287 HydrophobicContact SD-CD2 3.96Å; L283-L287 HydrophobicContact CD1-CD1 3.74Å; L283-L287 HydrophobicContact CD1-CD2 4.47Å; L283-L287 HydrophobicContact CD1-CG 3.88Å; L283-L287 HydrophobicContact CD2-CD1 4.48Å; L283-L287 HydrophobicContact CG-CD1 3.83Å; L283-L287 HydrophobicContact CG-CG 4.27Å; L283-L287 WeakPolarHBondContact O-CB 3.4Å; L283-L287 VanDerWaalsContact O-CG 3.24Å; L283-L287 WeakPolarHBondContact O-CG 3.5Å; L283-L287 PolarHBondContact O-N 3.3Å; S284-L287 PolarHBondContact O-N 3.25Å; L287-M289 PolarHBondContact O-N 3.19Å; L287-A290 PolarHBondContact O-N 3.25Å; L287-L291 HydrophobicContact CB-CD1 4.3Å; L287-L291 VanDerWaalsContact O-CB 3.25Å; L287-L291 WeakPolarHBondContact O-CB 3.47Å; L287-L291 VanDerWaalsContact O-CD1 3.26Å; L287-L291 WeakPolarHBondContact O-CD1 3.34Å; L287-L291 WeakPolarHBondContact O-CG 3.43Å; L287-L291 PolarHBondContact O-N 2.81Å
288A94.3Very high90.3Very high0 Ų029.8 Ų29.80%016%0.159CC..Hα-helixtrans-57.7-48.317700000111.4A13 L17 S284 L285 A290 L291 M292A13-A288 HydrophobicContact CB-CB 4.26Å; L17-A288 HydrophobicContact CD2-CB 3.89Å; L17-A288 HydrophobicContact CG-CB 3.92Å; S284-A288 VanDerWaalsContact O-CB 3.31Å; S284-A288 WeakPolarHBondContact O-CB 3.41Å; S284-A288 PolarHBondContact O-N 3.36Å; L285-A288 PolarHBondContact O-N 3.36Å; A288-A290 PolarHBondContact O-N 3.5Å; A288-L291 PolarHBondContact O-N 3.05Å; A288-M292 WeakPolarHBondContact O-CB 3.2Å; A288-M292 WeakPolarHBondContact O-CG 3.24Å; A288-M292 PolarHBondContact O-N 2.91Å
289M93.2Very high89.7Confident1 Ų129.6 Ų29.61%0.00516%0.158CC..Hα-helixtrans-59.9-45.6175.8-69.9177.1-169.300111.9T9 L10 A13 M64 L66 L70 L285 F286 L287 L291 G293T9-M289 HydrophobicContact CG2-CG 4.48Å; L10-M289 HydrophobicContact CD1-CE 3.87Å; A13-M289 HydrophobicContact CB-CE 4.16Å; A13-M289 HydrophobicContact CB-CG 3.88Å; M64-M289 WeakPolarHBondContact CE-O 3.35Å; M64-M289 HydrophobicContact SD-CB 3.99Å; L66-M289 HydrophobicContact CB-CE 3.85Å; L66-M289 HydrophobicContact CB-SD 4.02Å; L66-M289 HydrophobicContact CD1-CE 4.19Å; L70-M289 HydrophobicContact CD1-CE 3.75Å; L70-M289 HydrophobicContact CD1-SD 3.94Å; L285-M289 WeakPolarHBondContact O-CG 3.47Å; L285-M289 PolarHBondContact O-N 2.9Å; F286-M289 PolarHBondContact O-N 3.32Å; L287-M289 PolarHBondContact O-N 3.19Å; M289-L291 VanDerWaalsContact C-N 3.32Å; M289-L291 PolarHBondContact O-N 3.43Å; M289-G293 PolarHBondContact O-N 3.41Å
290A89.9Confident89.1Confident4 Ų433 Ų333%0.03319%0.186CC..Hα-helixtrans-61.9-40.417800000112.2T158 F286 L287 A288T158-A290 HydrophobicContact CG2-CB 4.38Å; F286-A290 WeakPolarHBondContact O-CB 3.41Å; F286-A290 PolarHBondContact O-N 3.43Å; L287-A290 PolarHBondContact O-N 3.25Å; A288-A290 PolarHBondContact O-N 3.5Å
291L91.4Very high88.8Confident3 Ų332.7 Ų32.72%0.01619%0.191CC..Hα-helixtrans-76-39.5-176.6-71.4162.2000113.1P38 V39 M162 L287 A288 M289 G293 L294P38-L291 VanDerWaalsContact C-CD1 3.42Å; P38-L291 HydrophobicContact CB-CD1 4.37Å; P38-L291 WeakPolarHBondContact O-CD1 3.31Å; V39-L291 HydrophobicContact CB-CD1 4.26Å; V39-L291 HydrophobicContact CG2-CD1 4.04Å; M162-L291 HydrophobicContact CB-CD2 3.9Å; M162-L291 HydrophobicContact CG-CD2 3.58Å; M162-L291 HydrophobicContact CG-CG 4.38Å; M162-L291 HydrophobicContact SD-CD2 3.88Å; M162-L291 HydrophobicContact SD-CG 4.23Å; L287-L291 HydrophobicContact CB-CD1 4.3Å; L287-L291 VanDerWaalsContact O-CB 3.25Å; L287-L291 WeakPolarHBondContact O-CB 3.47Å; L287-L291 VanDerWaalsContact O-CD1 3.26Å; L287-L291 WeakPolarHBondContact O-CD1 3.34Å; L287-L291 WeakPolarHBondContact O-CG 3.43Å; L287-L291 PolarHBondContact O-N 2.81Å; A288-L291 PolarHBondContact O-N 3.05Å; M289-L291 VanDerWaalsContact C-N 3.32Å; M289-L291 PolarHBondContact O-N 3.43Å; L291-G293 PolarHBondContact O-N 3.18Å; L291-L294 HydrophobicContact CB-CD1 4.49Å; L291-L294 HydrophobicContact CD2-CD1 3.51Å; L291-L294 HydrophobicContact CD2-CG 4.42Å; L291-L294 HydrophobicContact CG-CD1 4.49Å; L291-L294 VanDerWaalsContact O-CB 3.28Å; L291-L294 WeakPolarHBondContact O-CB 3.32Å; L291-L294 WeakPolarHBondContact O-CG 3.39Å; L291-L294 PolarHBondContact O-N 3.43Å; L291-L294 VanDerWaalsContact O-N 3.09Å
292M89.9Confident88.4Confident4 Ų430.2 Ų30.22%0.0218%0.176CC..Hα-helixtrans-61.9-31.1176.3-71.6161.854.300112.4A12 A13 T16 V45 F62 A288 L294A12-M292 HydrophobicContact CB-CE 3.49Å; A12-M292 VanDerWaalsContact CB-CE 3.49Å; A13-M292 VanDerWaalsContact CA-SD 3.53Å; A13-M292 HydrophobicContact CB-SD 4.05Å; T16-M292 HydrophobicContact CG2-CG 3.97Å; T16-M292 HydrophobicContact CG2-SD 4.12Å; T16-M292 PolarHBondContact OG1-SD 3.21Å; T16-M292 VanDerWaalsContact OG1-SD 3.37Å; V45-M292 HydrophobicContact CB-CG 4.28Å; V45-M292 HydrophobicContact CG1-CB 4.44Å; V45-M292 HydrophobicContact CG1-CG 4.01Å; F62-M292 HydrophobicContact CD1-CE 3.8Å; F62-M292 HydrophobicContact CE1-CE 3.34Å; F62-M292 HydrophobicContact CE2-CB 4.2Å; F62-M292 HydrophobicContact CE2-CE 4.44Å; F62-M292 HydrophobicContact CZ-CB 4.34Å; F62-M292 HydrophobicContact CZ-CE 3.72Å; A288-M292 WeakPolarHBondContact O-CB 3.2Å; A288-M292 WeakPolarHBondContact O-CG 3.24Å; A288-M292 PolarHBondContact O-N 2.91Å; M292-L294 VanDerWaalsContact C-N 3.34Å
293G83.8Confident88Confident35 Ų3531.7 Ų31.736%0.36119%0.188SC..THydrogen-bonded Turntrans-85.11.8175.900000114.9M289 L291M289-G293 PolarHBondContact O-N 3.41Å; L291-G293 PolarHBondContact O-N 3.18Å
294L85.4Confident88Confident12 Ų1237.1 Ų37.16%0.06322%0.217CC..  trans-66.2139.7-174.6-81-179.8000113.4A46 T158 E159 M162 L291 M292 L296A46-L294 HydrophobicContact CB-CB 4.36Å; T158-L294 HydrophobicContact CG2-CD2 3.86Å; E159-L294 HydrophobicContact CB-CD2 4.19Å; E159-L294 HydrophobicContact CG-CD2 3.74Å; E159-L294 WeakPolarHBondContact OE1-CD2 3.38Å; M162-L294 HydrophobicContact CB-CD1 4.42Å; M162-L294 HydrophobicContact CG-CD1 4.41Å; L291-L294 HydrophobicContact CB-CD1 4.49Å; L291-L294 HydrophobicContact CD2-CD1 3.51Å; L291-L294 HydrophobicContact CD2-CG 4.42Å; L291-L294 HydrophobicContact CG-CD1 4.49Å; L291-L294 VanDerWaalsContact O-CB 3.28Å; L291-L294 WeakPolarHBondContact O-CB 3.32Å; L291-L294 WeakPolarHBondContact O-CG 3.39Å; L291-L294 PolarHBondContact O-N 3.43Å; L291-L294 VanDerWaalsContact O-N 3.09Å; M292-L294 VanDerWaalsContact C-N 3.34Å; L294-L296 PolarHBondContact O-N 2.69Å
295K82.4Confident87.9Confident94 Ų9437.1 Ų37.141%0.40922%0.216SC..  trans-96.775.7177.4-61.5-170.4175.8172.30112.2E159 W297 E298E159-K295 PolarHBondContact OE1-N 3.38Å; K295-W297 VanDerWaalsContact C-CE3 3.43Å; K295-W297 VanDerWaalsContact CA-CH2 3.43Å; K295-W297 HydrophobicContact CB-CD2 4.16Å; K295-W297 HydrophobicContact CB-CE3 4.15Å; K295-W297 HydrophobicContact CB-CH2 3.45Å; K295-W297 VanDerWaalsContact CB-CH2 3.45Å; K295-W297 HydrophobicContact CB-CZ2 3.41Å; K295-W297 VanDerWaalsContact CB-CZ2 3.41Å; K295-W297 HydrophobicContact CB-CZ3 3.83Å; K295-W297 HydrophobicContact CD-CH2 4.05Å; K295-W297 HydrophobicContact CD-CZ2 3.56Å; K295-W297 HydrophobicContact CG-CH2 3.39Å; K295-W297 HydrophobicContact CG-CZ2 3.42Å; K295-W297 VanDerWaalsContact CG-CZ2 3.42Å; K295-W297 HydrophobicContact CG-CZ3 4.2Å; K295-W297 PolarHBondContact O-N 3.33Å; K295-E298 HydrophobicContact CB-CB 4.33Å; K295-E298 HydrophobicContact CB-CG 4.15Å; K295-E298 WeakPolarHBondContact CD-OE1 3.36Å; K295-E298 WeakPolarHBondContact CD-OE2 3.39Å; K295-E298 IonicContact NZ-OE1 2.64Å; K295-E298 WeakPolarHBondContact O-CB 3.3Å; K295-E298 PolarHBondContact O-N 3.16Å
296L81.9Confident87.8Confident22 Ų2236.3 Ų36.312%0.11521%0.212CC..Hα-helixtrans-55.3-26.1-171.5-66176.5000116L43 A46 L47 L50 L294 E298 L299 A300L43-L296 HydrophobicContact CD1-CD1 4.19Å; L43-L296 HydrophobicContact CD1-CD2 3.58Å; A46-L296 HydrophobicContact CB-CD1 3.89Å; A46-L296 HydrophobicContact CB-CG 4.16Å; L47-L296 HydrophobicContact CB-CD1 4.28Å; L47-L296 HydrophobicContact CD2-CD1 3.5Å; L47-L296 VanDerWaalsContact CD2-CD1 3.5Å; L47-L296 HydrophobicContact CG-CD1 3.6Å; L50-L296 HydrophobicContact CD2-CB 4.13Å; L50-L296 HydrophobicContact CD2-CD1 4.46Å; L294-L296 PolarHBondContact O-N 2.69Å; L296-E298 VanDerWaalsContact C-N 3.34Å; L296-L299 PolarHBondContact O-N 3.2Å; L296-A300 PolarHBondContact O-N 3.07Å
297W80.6Confident87.8Confident107 Ų10740.2 Ų40.241%0.40523%0.232SC..Hα-helixtrans-70.8-30.2177.157.5102.1000112.3L50 K295 L299 A300L50-W297 HydrophobicContact CD1-CE3 3.7Å; L50-W297 HydrophobicContact CD1-CZ3 4.21Å; K295-W297 VanDerWaalsContact C-CE3 3.43Å; K295-W297 VanDerWaalsContact CA-CH2 3.43Å; K295-W297 HydrophobicContact CB-CD2 4.16Å; K295-W297 HydrophobicContact CB-CE3 4.15Å; K295-W297 HydrophobicContact CB-CH2 3.45Å; K295-W297 VanDerWaalsContact CB-CH2 3.45Å; K295-W297 HydrophobicContact CB-CZ2 3.41Å; K295-W297 VanDerWaalsContact CB-CZ2 3.41Å; K295-W297 HydrophobicContact CB-CZ3 3.83Å; K295-W297 HydrophobicContact CD-CH2 4.05Å; K295-W297 HydrophobicContact CD-CZ2 3.56Å; K295-W297 HydrophobicContact CG-CH2 3.39Å; K295-W297 HydrophobicContact CG-CZ2 3.42Å; K295-W297 VanDerWaalsContact CG-CZ2 3.42Å; K295-W297 HydrophobicContact CG-CZ3 4.2Å; K295-W297 PolarHBondContact O-N 3.33Å; W297-L299 VanDerWaalsContact C-N 3.3Å; W297-A300 PolarHBondContact O-N 3.04Å
298E77.8Confident88Confident46 Ų4642 Ų4222%0.21525%0.247CC..Hα-helixtrans-73.8-25.3175.9-67.2176.1-170.900111.6N156 K295 L296 S301N156-E298 PolarHBondContact ND2-O 3.31Å; N156-E298 VanDerWaalsContact ND2-O 3.11Å; N156-E298 PolarHBondContact OD1-OE2 2.95Å; K295-E298 HydrophobicContact CB-CB 4.33Å; K295-E298 HydrophobicContact CB-CG 4.15Å; K295-E298 WeakPolarHBondContact CD-OE1 3.36Å; K295-E298 WeakPolarHBondContact CD-OE2 3.39Å; K295-E298 IonicContact NZ-OE1 2.64Å; K295-E298 WeakPolarHBondContact O-CB 3.3Å; K295-E298 PolarHBondContact O-N 3.16Å; L296-E298 VanDerWaalsContact C-N 3.34Å; E298-S301 PolarHBondContact O-OG 3.36Å
299L81.8Confident88.1Confident26 Ų2642 Ų4214%0.13625%0.247CC..Hα-helixtrans-76.7-31.5174.7-174.158.7000112.9E159 V160 A163 L296 W297 S301 L302 A303 M306E159-L299 HydrophobicContact CB-CB 4Å; E159-L299 HydrophobicContact CB-CD1 3.98Å; E159-L299 HydrophobicContact CB-CD2 4.39Å; E159-L299 HydrophobicContact CB-CG 4.33Å; E159-L299 HydrophobicContact CG-CB 4.3Å; V160-L299 HydrophobicContact CG2-CD1 4.39Å; A163-L299 HydrophobicContact CB-CD1 4.27Å; A163-L299 HydrophobicContact CB-CD2 4.01Å; L296-L299 PolarHBondContact O-N 3.2Å; W297-L299 VanDerWaalsContact C-N 3.3Å; L299-S301 VanDerWaalsContact C-N 3.29Å; L299-S301 PolarHBondContact O-N 3.47Å; L299-L302 PolarHBondContact O-N 2.71Å; L299-A303 PolarHBondContact O-N 3.47Å; L299-A303 VanDerWaalsContact O-N 3.09Å; L299-M306 HydrophobicContact CD1-CE 4.25Å; L299-M306 HydrophobicContact CD1-SD 4.34Å
300A83Confident88.3Confident71 Ų7142 Ų4259%0.58725%0.248SC*.Hα-helixtrans-60.8-36.5-171.900000113L296 W297 L302 A303L296-A300 PolarHBondContact O-N 3.07Å; W297-A300 PolarHBondContact O-N 3.04Å; A300-L302 VanDerWaalsContact C-N 3.26Å; A300-L302 PolarHBondContact O-N 3.12Å; A300-A303 PolarHBondContact O-N 2.98Å
301S85.4Confident88.6Confident90 Ų9045.2 Ų45.263%0.62927%0.267SS*.THydrogen-bonded Turntrans-68.4-25.3176.356.20000113.2E298 L299E298-S301 PolarHBondContact O-OG 3.36Å; L299-S301 VanDerWaalsContact C-N 3.29Å; L299-S301 PolarHBondContact O-N 3.47Å
302L88.4Confident88.9Confident21 Ų2147.6 Ų47.611%0.1128%0.281CS..THydrogen-bonded Turntrans-95.7-8.8-178.6-61.6178.5000113.1L121 M125 N156 V160 L299 A300 L304 P305 M306L121-L302 HydrophobicContact CD2-CD2 4.12Å; M125-L302 HydrophobicContact CE-CB 3.92Å; M125-L302 HydrophobicContact CE-CD2 4.41Å; M125-L302 HydrophobicContact SD-CD1 4.37Å; M125-L302 HydrophobicContact SD-CD2 4.03Å; N156-L302 HydrophobicContact CB-CD1 4.07Å; V160-L302 HydrophobicContact CG2-CD1 3.76Å; L299-L302 PolarHBondContact O-N 2.71Å; A300-L302 VanDerWaalsContact C-N 3.26Å; A300-L302 PolarHBondContact O-N 3.12Å; L302-L304 PolarHBondContact O-N 2.82Å; L302-P305 WeakPolarHBondContact O-CD 3.15Å; L302-M306 WeakPolarHBondContact O-CB 3.43Å; L302-M306 PolarHBondContact O-N 2.85Å
303A89.1Confident89.2Confident41 Ų4147.4 Ų47.434%0.33928%0.28SS..Hα-helixtrans-61.2-47.5-170.400000113.5L299 A300 L307L299-A303 PolarHBondContact O-N 3.47Å; L299-A303 VanDerWaalsContact O-N 3.09Å; A300-A303 PolarHBondContact O-N 2.98Å; A303-L307 WeakPolarHBondContact O-CB 3.15Å; A303-L307 PolarHBondContact O-N 3.16Å
304L92.4Very high89.9Confident146 Ų14646.5 Ų46.576%0.76427%0.268SS*.Hα-helixtrans-66.1-50.8179.8-76.2173.4000112.3L302 M306 L307 A308L302-L304 PolarHBondContact O-N 2.82Å; L304-M306 VanDerWaalsContact C-N 3.33Å; L304-M306 PolarHBondContact O-N 3.33Å; L304-L307 PolarHBondContact O-N 2.87Å; L304-A308 PolarHBondContact O-N 2.97Å; L304-A308 VanDerWaalsContact O-N 3.08Å
305P92.9Very high90.4Very high31 Ų3150.7 Ų50.720%0.20129%0.289CS..Hα-helixtrans-58.1-42.6174.5-24.631.5000113.5L119 L121 L302 L307 A308 I309L119-P305 HydrophobicContact CD1-CB 4.15Å; L121-P305 HydrophobicContact CD1-CB 3.33Å; L121-P305 HydrophobicContact CD1-CG 4.21Å; L121-P305 HydrophobicContact CG-CB 4.37Å; L302-P305 WeakPolarHBondContact O-CD 3.15Å; P305-L307 PolarHBondContact O-N 3.42Å; P305-A308 WeakPolarHBondContact O-CB 3.22Å; P305-A308 PolarHBondContact O-N 3.41Å; P305-I309 WeakPolarHBondContact O-CG1 3.5Å; P305-I309 PolarHBondContact O-N 3.41Å; P305-I309 VanDerWaalsContact O-N 3.07Å
306M93.8Very high91.2Very high5 Ų547.8 Ų47.83%0.02528%0.277CS..Hα-helixtrans-60.8-45.5177.2-175.517966.400111.7M125 V160 A163 C164 F167 L299 L302 L304 A308 I309 L310M125-M306 HydrophobicContact CE-CB 3.59Å; M125-M306 HydrophobicContact CE-CG 4.24Å; V160-M306 HydrophobicContact CG1-SD 4.42Å; A163-M306 HydrophobicContact CB-CE 3.52Å; A163-M306 HydrophobicContact CB-SD 3.75Å; C164-M306 VanDerWaalsContact SG-CG 3.53Å; C164-M306 PolarHBondContact SG-SD 3.13Å; F167-M306 HydrophobicContact CD2-CE 4.41Å; F167-M306 HydrophobicContact CE2-CE 4.27Å; L299-M306 HydrophobicContact CD1-CE 4.25Å; L299-M306 HydrophobicContact CD1-SD 4.34Å; L302-M306 WeakPolarHBondContact O-CB 3.43Å; L302-M306 PolarHBondContact O-N 2.85Å; L304-M306 VanDerWaalsContact C-N 3.33Å; L304-M306 PolarHBondContact O-N 3.33Å; M306-A308 VanDerWaalsContact C-N 3.28Å; M306-A308 PolarHBondContact O-N 3.04Å; M306-I309 PolarHBondContact O-N 3.44Å; M306-L310 HydrophobicContact CG-CD1 3.94Å; M306-L310 HydrophobicContact CG-CG 4.43Å; M306-L310 VanDerWaalsContact O-CG 3.24Å; M306-L310 WeakPolarHBondContact O-CG 3.43Å; M306-L310 PolarHBondContact O-N 3.45Å
307L94.2Very high91.9Very high81 Ų8146.7 Ų46.742%0.42427%0.271SS..Hα-helixtrans-58.3-42.4176.3-171.380.1000111.2F167 A303 L304 P305 L310 V311F167-L307 HydrophobicContact CE1-CD1 4.4Å; A303-L307 WeakPolarHBondContact O-CB 3.15Å; A303-L307 PolarHBondContact O-N 3.16Å; L304-L307 PolarHBondContact O-N 2.87Å; P305-L307 PolarHBondContact O-N 3.42Å; L307-L310 PolarHBondContact O-N 3.36Å; L307-V311 WeakPolarHBondContact O-CG2 3.43Å; L307-V311 PolarHBondContact O-N 2.88Å
308A95.8Very high92.7Very high41 Ų4142.5 Ų42.534%0.33926%0.259SS..Hα-helixtrans-60.7-45.8177.200000112L119 L304 P305 M306 L310 V311 V312L119-A308 HydrophobicContact CD1-CB 4.46Å; L304-A308 PolarHBondContact O-N 2.97Å; L304-A308 VanDerWaalsContact O-N 3.08Å; P305-A308 WeakPolarHBondContact O-CB 3.22Å; P305-A308 PolarHBondContact O-N 3.41Å; M306-A308 VanDerWaalsContact C-N 3.28Å; M306-A308 PolarHBondContact O-N 3.04Å; A308-L310 PolarHBondContact O-N 3.33Å; A308-V311 PolarHBondContact O-N 3.06Å; A308-V312 WeakPolarHBondContact O-CG2 3.35Å; A308-V312 PolarHBondContact O-N 2.84Å
309I96.8Very high93.6Very high0 Ų044.3 Ų44.30%027%0.27CS..Hα-helixtrans-59.7-47.4175.5-61.1170.7000110.2M115 A116 L119 A129 P305 M306 V311 V312 Q313M115-I309 HydrophobicContact CB-CG1 3.85Å; M115-I309 HydrophobicContact CB-CG2 4.44Å; A116-I309 HydrophobicContact CB-CD1 4.23Å; L119-I309 HydrophobicContact CD1-CD1 4.38Å; L119-I309 HydrophobicContact CD1-CG1 3.99Å; A129-I309 HydrophobicContact CB-CB 4.33Å; A129-I309 HydrophobicContact CB-CD1 4.46Å; A129-I309 HydrophobicContact CB-CG2 3.73Å; P305-I309 WeakPolarHBondContact O-CG1 3.5Å; P305-I309 PolarHBondContact O-N 3.41Å; P305-I309 VanDerWaalsContact O-N 3.07Å; M306-I309 PolarHBondContact O-N 3.44Å; I309-V311 VanDerWaalsContact C-N 3.34Å; I309-V311 PolarHBondContact O-N 3.46Å; I309-V312 PolarHBondContact O-N 3.28Å; I309-Q313 HydrophobicContact CG2-CG 4.13Å; I309-Q313 VanDerWaalsContact O-CG 3.27Å; I309-Q313 WeakPolarHBondContact O-CG 3.45Å; I309-Q313 PolarHBondContact O-N 2.8Å
310L96.6Very high94.4Very high2 Ų244.2 Ų44.21%0.0127%0.268CS..Hα-helixtrans-64-36.1-178-68.8170.5000113.1L134 C164 F167 L171 M306 L307 A308 Q313 T314L134-L310 HydrophobicContact CD1-CD2 4.32Å; L134-L310 HydrophobicContact CD2-CD2 3.77Å; L134-L310 HydrophobicContact CG-CD2 4.48Å; C164-L310 HydrophobicContact CB-CD2 4.25Å; F167-L310 HydrophobicContact CB-CD1 3.68Å; F167-L310 HydrophobicContact CD2-CD1 4.12Å; F167-L310 HydrophobicContact CG-CD1 4.03Å; L171-L310 HydrophobicContact CD1-CB 4.24Å; M306-L310 HydrophobicContact CG-CD1 3.94Å; M306-L310 HydrophobicContact CG-CG 4.43Å; M306-L310 VanDerWaalsContact O-CG 3.24Å; M306-L310 WeakPolarHBondContact O-CG 3.43Å; M306-L310 PolarHBondContact O-N 3.45Å; L307-L310 PolarHBondContact O-N 3.36Å; A308-L310 PolarHBondContact O-N 3.33Å; L310-Q313 PolarHBondContact O-N 3.01Å; L310-T314 WeakPolarHBondContact O-CB 3.42Å; L310-T314 PolarHBondContact O-N 3.34Å; L310-T314 PolarHBondContact O-OG1 2.82Å
311V96.6Very high95Very high72 Ų7240.8 Ų40.844%0.43624%0.24SC..Hα-helixtrans-63-46.3173.5168.90000110.5L307 A308 I309 T314 I315L307-V311 WeakPolarHBondContact O-CG2 3.43Å; L307-V311 PolarHBondContact O-N 2.88Å; A308-V311 PolarHBondContact O-N 3.06Å; I309-V311 VanDerWaalsContact C-N 3.34Å; I309-V311 PolarHBondContact O-N 3.46Å; V311-T314 WeakPolarHBondContact O-CB 3.29Å; V311-T314 PolarHBondContact O-N 2.99Å; V311-I315 HydrophobicContact CG1-CD1 4.04Å; V311-I315 WeakPolarHBondContact O-CG1 3.34Å; V311-I315 PolarHBondContact O-N 3.46Å
312V97.5Very high95.5Very high53 Ų5337.6 Ų37.632%0.32122%0.215SC..Hα-helixtrans-61.9-45.3176.7174.80000110.9I111 M115 A308 I309 T314 I315 F316I111-V312 HydrophobicContact CG2-CG1 3.82Å; M115-V312 HydrophobicContact CE-CG2 3.88Å; M115-V312 HydrophobicContact CG-CG1 4.35Å; M115-V312 HydrophobicContact SD-CG1 4.46Å; M115-V312 HydrophobicContact SD-CG2 4.31Å; A308-V312 WeakPolarHBondContact O-CG2 3.35Å; A308-V312 PolarHBondContact O-N 2.84Å; I309-V312 PolarHBondContact O-N 3.28Å; V312-T314 VanDerWaalsContact C-N 3.27Å; V312-T314 PolarHBondContact O-N 3.42Å; V312-I315 PolarHBondContact O-N 3.22Å; V312-F316 WeakPolarHBondContact O-CB 3.37Å; V312-F316 PolarHBondContact O-N 2.88Å
313Q98Very high95.9Very high0 Ų041.7 Ų41.70%023%0.232CC..Hα-helixtrans-59.5-38.5176-68.2-74.821.200112.1Q108 A129 L134 I309 L310 F316 M317 L347Q108-Q313 PolarHBondContact O-NE2 3.32Å; A129-Q313 PolarHBondContact O-NE2 2.88Å; L134-Q313 HydrophobicContact CD1-CB 3.66Å; L134-Q313 HydrophobicContact CD1-CG 3.75Å; I309-Q313 HydrophobicContact CG2-CG 4.13Å; I309-Q313 VanDerWaalsContact O-CG 3.27Å; I309-Q313 WeakPolarHBondContact O-CG 3.45Å; I309-Q313 PolarHBondContact O-N 2.8Å; L310-Q313 PolarHBondContact O-N 3.01Å; Q313-F316 PolarHBondContact O-N 3.29Å; Q313-M317 WeakPolarHBondContact O-CB 3.49Å; Q313-M317 PolarHBondContact O-N 3.27Å; Q313-L347 HydrophobicContact CB-CD2 4.49Å
314T97.1Very high96.3Very high15 Ų1541.8 Ų41.89%0.09223%0.229CC..Hα-helixtrans-66.9-46.3179.2-61.20000111.8L171 I175 L310 V311 V312 F316 M317 A318 L347L171-T314 HydrophobicContact CB-CG2 4.26Å; L171-T314 WeakPolarHBondContact CD1-OG1 3.23Å; L171-T314 HydrophobicContact CD2-CG2 4.36Å; I175-T314 HydrophobicContact CD1-CG2 4.4Å; I175-T314 HydrophobicContact CG2-CG2 3.49Å; I175-T314 VanDerWaalsContact CG2-CG2 3.49Å; L310-T314 WeakPolarHBondContact O-CB 3.42Å; L310-T314 PolarHBondContact O-N 3.34Å; L310-T314 PolarHBondContact O-OG1 2.82Å; V311-T314 WeakPolarHBondContact O-CB 3.29Å; V311-T314 PolarHBondContact O-N 2.99Å; V312-T314 VanDerWaalsContact C-N 3.27Å; V312-T314 PolarHBondContact O-N 3.42Å; T314-F316 VanDerWaalsContact C-N 3.35Å; T314-M317 PolarHBondContact O-N 3.02Å; T314-A318 PolarHBondContact O-N 2.99Å; T314-A318 VanDerWaalsContact O-N 3.07Å; T314-L347 HydrophobicContact CG2-CD1 4.05Å
315I97.3Very high96.4Very high100 Ų10034.8 Ų34.851%0.51319%0.192SC..Hα-helixtrans-61.4-48175.4-65.5167.2000109.5V311 V312 M317 A318 L319V311-I315 HydrophobicContact CG1-CD1 4.04Å; V311-I315 WeakPolarHBondContact O-CG1 3.34Å; V311-I315 PolarHBondContact O-N 3.46Å; V312-I315 PolarHBondContact O-N 3.22Å; I315-M317 VanDerWaalsContact C-N 3.35Å; I315-M317 PolarHBondContact O-N 3.27Å; I315-A318 PolarHBondContact O-N 3.18Å; I315-L319 HydrophobicContact CG2-CD1 3.92Å; I315-L319 HydrophobicContact CG2-CG 4.35Å; I315-L319 VanDerWaalsContact O-CG 3.3Å; I315-L319 WeakPolarHBondContact O-CG 3.48Å; I315-L319 PolarHBondContact O-N 3.43Å
316F97.7Very high96.5Very high33 Ų3334.3 Ų34.315%0.14519%0.186CC..Hα-helixtrans-57.4-46177.8170.7-110.1000111.9L104 M107 Q108 I111 V312 Q313 T314 A318 L319 Y320L104-F316 HydrophobicContact CD1-CD1 4.4Å; L104-F316 HydrophobicContact CD1-CE1 3.64Å; L104-F316 HydrophobicContact CD1-CZ 4.27Å; M107-F316 HydrophobicContact CB-CE1 3.82Å; M107-F316 HydrophobicContact CB-CE2 4.26Å; M107-F316 HydrophobicContact CB-CZ 3.35Å; M107-F316 HydrophobicContact CE-CE2 4.44Å; M107-F316 HydrophobicContact CG-CZ 4.14Å; Q108-F316 HydrophobicContact CG-CD1 4.26Å; Q108-F316 HydrophobicContact CG-CE1 4.01Å; I111-F316 HydrophobicContact CD1-CB 3.95Å; I111-F316 HydrophobicContact CD1-CD1 3.48Å; I111-F316 VanDerWaalsContact CD1-CD1 3.48Å; I111-F316 HydrophobicContact CD1-CD2 3.45Å; I111-F316 VanDerWaalsContact CD1-CD2 3.45Å; I111-F316 HydrophobicContact CD1-CE1 3.79Å; I111-F316 HydrophobicContact CD1-CE2 3.78Å; I111-F316 HydrophobicContact CD1-CG 3.3Å; I111-F316 HydrophobicContact CD1-CZ 3.96Å; V312-F316 WeakPolarHBondContact O-CB 3.37Å; V312-F316 PolarHBondContact O-N 2.88Å; Q313-F316 PolarHBondContact O-N 3.29Å; T314-F316 VanDerWaalsContact C-N 3.35Å; F316-A318 PolarHBondContact O-N 2.98Å; F316-L319 PolarHBondContact O-N 2.94Å; F316-Y320 HydrophobicContact CE1-CD2 4.41Å; F316-Y320 HydrophobicContact CE2-CD2 4.01Å; F316-Y320 AromaticContact CZ-CD2 3.58Å; F316-Y320 HydrophobicContact CZ-CD2 3.58Å; F316-Y320 HydrophobicContact CZ-CE2 4.33Å; F316-Y320 HydrophobicContact CZ-CG 4.18Å; F316-Y320 VanDerWaalsContact O-CB 3.31Å; F316-Y320 WeakPolarHBondContact O-CB 3.4Å; F316-Y320 PolarHBondContact O-N 3.39Å
317M97.4Very high96.6Very high0 Ų039.2 Ų39.20%020%0.204CC..Hα-helixtrans-59.2-46.9177.5-177.469.1-12100111.6L104 I175 Q313 T314 I315 L319 Y320 A321 H342 L347L104-M317 HydrophobicContact CD1-CE 4.16Å; L104-M317 HydrophobicContact CD1-SD 3.68Å; L104-M317 HydrophobicContact CD2-CE 3.98Å; L104-M317 HydrophobicContact CD2-SD 3.5Å; L104-M317 VanDerWaalsContact CD2-SD 3.5Å; L104-M317 HydrophobicContact CG-SD 4.26Å; I175-M317 HydrophobicContact CD1-CB 4.26Å; I175-M317 HydrophobicContact CD1-CG 4.1Å; Q313-M317 WeakPolarHBondContact O-CB 3.49Å; Q313-M317 PolarHBondContact O-N 3.27Å; T314-M317 PolarHBondContact O-N 3.02Å; I315-M317 VanDerWaalsContact C-N 3.35Å; I315-M317 PolarHBondContact O-N 3.27Å; M317-L319 VanDerWaalsContact C-N 3.32Å; M317-L319 PolarHBondContact O-N 2.99Å; M317-Y320 HydrophobicContact CE-CD1 4.4Å; M317-Y320 PolarHBondContact O-N 3.37Å; M317-A321 HydrophobicContact CE-CB 4.04Å; M317-A321 WeakPolarHBondContact O-CB 3.31Å; M317-A321 PolarHBondContact O-N 2.82Å; M317-H342 HydrophobicContact CE-CB 4.46Å; M317-L347 HydrophobicContact CB-CD1 3.88Å; M317-L347 HydrophobicContact CB-CD2 4.09Å; M317-L347 HydrophobicContact CB-CG 3.89Å; M317-L347 HydrophobicContact CG-CD1 4Å; M317-L347 HydrophobicContact CG-CD2 4.49Å; M317-L347 HydrophobicContact CG-CG 3.83Å
318A96.8Very high96.5Very high19 Ų1939.7 Ų39.716%0.15721%0.206CC..Hα-helixtrans-59.4-45178.100000111.2I175 V179 T314 I315 F316 I322I175-A318 HydrophobicContact CD1-CB 4.22Å; V179-A318 HydrophobicContact CG2-CB 3.89Å; T314-A318 PolarHBondContact O-N 2.99Å; T314-A318 VanDerWaalsContact O-N 3.07Å; I315-A318 PolarHBondContact O-N 3.18Å; F316-A318 PolarHBondContact O-N 2.98Å; A318-I322 WeakPolarHBondContact O-CD1 3.34Å; A318-I322 WeakPolarHBondContact O-CG1 3.38Å; A318-I322 PolarHBondContact O-N 3.46Å; A318-I322 VanDerWaalsContact O-N 3.13Å
319L97.3Very high96.4Very high84 Ų8438.6 Ų38.644%0.4419%0.194SC..Hα-helixtrans-63.4-44.1175.5-64173.8000111.4I315 F316 M317 A321 I322 F323I315-L319 HydrophobicContact CG2-CD1 3.92Å; I315-L319 HydrophobicContact CG2-CG 4.35Å; I315-L319 VanDerWaalsContact O-CG 3.3Å; I315-L319 WeakPolarHBondContact O-CG 3.48Å; I315-L319 PolarHBondContact O-N 3.43Å; F316-L319 PolarHBondContact O-N 2.94Å; M317-L319 VanDerWaalsContact C-N 3.32Å; M317-L319 PolarHBondContact O-N 2.99Å; L319-A321 PolarHBondContact O-N 3.31Å; L319-I322 PolarHBondContact O-N 3.42Å; L319-F323 HydrophobicContact CB-CD2 4.14Å; L319-F323 HydrophobicContact CD2-CD2 4.15Å; L319-F323 HydrophobicContact CD2-CE2 3.68Å; L319-F323 WeakPolarHBondContact O-CB 3.38Å; L319-F323 WeakPolarHBondContact O-CD2 3.22Å; L319-F323 PolarHBondContact O-N 2.95Å
320Y97.7Very high96.1Very high23 Ų2340.8 Ų40.89%0.0922%0.217CC..Hα-helixtrans-62.8-42.8-179.8-166.8-88.5000111.7V100 L104 F316 M317 I322 V324 T325 H342V100-Y320 HydrophobicContact CG1-CE1 3.7Å; V100-Y320 PolarHBondContact O-OH 3.48Å; L104-Y320 HydrophobicContact CB-CD1 4.09Å; L104-Y320 HydrophobicContact CB-CE1 3.69Å; L104-Y320 HydrophobicContact CD1-CD1 3.69Å; L104-Y320 HydrophobicContact CD1-CD2 4.25Å; L104-Y320 HydrophobicContact CD1-CE1 4.18Å; L104-Y320 HydrophobicContact CD1-CG 3.73Å; L104-Y320 HydrophobicContact CG-CD1 4.41Å; L104-Y320 HydrophobicContact CG-CE1 4.5Å; L104-Y320 PolarHBondContact N-OH 3.19Å; F316-Y320 HydrophobicContact CE1-CD2 4.41Å; F316-Y320 HydrophobicContact CE2-CD2 4.01Å; F316-Y320 AromaticContact CZ-CD2 3.58Å; F316-Y320 HydrophobicContact CZ-CD2 3.58Å; F316-Y320 HydrophobicContact CZ-CE2 4.33Å; F316-Y320 HydrophobicContact CZ-CG 4.18Å; F316-Y320 VanDerWaalsContact O-CB 3.31Å; F316-Y320 WeakPolarHBondContact O-CB 3.4Å; F316-Y320 PolarHBondContact O-N 3.39Å; M317-Y320 HydrophobicContact CE-CD1 4.4Å; M317-Y320 PolarHBondContact O-N 3.37Å; Y320-I322 VanDerWaalsContact C-N 3.33Å; Y320-I322 PolarHBondContact O-N 2.84Å; Y320-V324 HydrophobicContact CD1-CB 4.18Å; Y320-V324 HydrophobicContact CD2-CB 4.15Å; Y320-V324 HydrophobicContact CD2-CG2 3.83Å; Y320-V324 HydrophobicContact CE1-CB 3.99Å; Y320-V324 HydrophobicContact CE1-CG1 4.01Å; Y320-V324 HydrophobicContact CE2-CB 3.97Å; Y320-V324 HydrophobicContact CE2-CG1 4.05Å; Y320-V324 HydrophobicContact CE2-CG2 3.79Å; Y320-V324 HydrophobicContact CG-CB 4.25Å; Y320-V324 HydrophobicContact CG-CG2 4.3Å; Y320-V324 WeakPolarHBondContact O-CA 3.48Å; Y320-V324 VanDerWaalsContact O-CB 3.31Å; Y320-V324 WeakPolarHBondContact O-CB 3.32Å; Y320-V324 PolarHBondContact O-N 3.18Å; Y320-T325 PolarHBondContact O-N 3.07Å; Y320-H342 AromaticContact CE1-CE1 3.99Å
321A96.6Very high95.8Very high0 Ų045 Ų450%024%0.235CC..Iπ-helixtrans-60.9-42.5175.300000111.8V179 M317 L319 W326 A339 C343V179-A321 HydrophobicContact CG1-CB 4.22Å; M317-A321 HydrophobicContact CE-CB 4.04Å; M317-A321 WeakPolarHBondContact O-CB 3.31Å; M317-A321 PolarHBondContact O-N 2.82Å; L319-A321 PolarHBondContact O-N 3.31Å; A321-W326 VanDerWaalsContact O-CB 3.28Å; A321-W326 WeakPolarHBondContact O-CB 3.44Å; A321-W326 PolarHBondContact O-N 3.34Å; A321-A339 HydrophobicContact CB-CB 4.39Å; A321-C343 WeakPolarHBondContact CB-SG 3.46Å
322I96Very high95.5Very high23 Ų2343.1 Ų43.112%0.11822%0.222CC..Iπ-helixtrans-73.7-45.6-179.1-65.7164.8000112.4V179 Y182 L183 A318 L319 Y320 R327V179-I322 HydrophobicContact CG1-CG1 4.04Å; Y182-I322 HydrophobicContact CD1-CD1 4.16Å; Y182-I322 HydrophobicContact CD1-CG1 4.23Å; Y182-I322 HydrophobicContact CD1-CG2 4.36Å; Y182-I322 HydrophobicContact CE1-CD1 4.39Å; Y182-I322 HydrophobicContact CE1-CG1 4.45Å; Y182-I322 HydrophobicContact CE1-CG2 3.77Å; L183-I322 HydrophobicContact CD2-CB 4.31Å; L183-I322 HydrophobicContact CD2-CG1 4Å; L183-I322 HydrophobicContact CD2-CG2 4.28Å; L183-I322 HydrophobicContact CG-CG1 4.47Å; A318-I322 WeakPolarHBondContact O-CD1 3.34Å; A318-I322 WeakPolarHBondContact O-CG1 3.38Å; A318-I322 PolarHBondContact O-N 3.46Å; A318-I322 VanDerWaalsContact O-N 3.13Å; L319-I322 PolarHBondContact O-N 3.42Å; Y320-I322 VanDerWaalsContact C-N 3.33Å; Y320-I322 PolarHBondContact O-N 2.84Å; I322-R327 PolarHBondContact O-NH1 3.23Å
323F96.5Very high95.1Very high106 Ų10640.7 Ų40.747%0.46521%0.207SC..Iπ-helixtrans-91.8-29.1-170.3-66.7-71.5000113.9L319 R327L319-F323 HydrophobicContact CB-CD2 4.14Å; L319-F323 HydrophobicContact CD2-CD2 4.15Å; L319-F323 HydrophobicContact CD2-CE2 3.68Å; L319-F323 WeakPolarHBondContact O-CB 3.38Å; L319-F323 WeakPolarHBondContact O-CD2 3.22Å; L319-F323 PolarHBondContact O-N 2.95Å; F323-R327 VanDerWaalsContact O-CD 3.25Å; F323-R327 WeakPolarHBondContact O-CD 3.49Å; F323-R327 WeakPolarHBondContact O-CG 3.38Å
324V96.9Very high94.6Very high43 Ų4341.5 Ų41.526%0.26121%0.212SC..Iπ-helixtrans-111-63.8-177.1-172.80000110.6Y320 R327 M328Y320-V324 HydrophobicContact CD1-CB 4.18Å; Y320-V324 HydrophobicContact CD2-CB 4.15Å; Y320-V324 HydrophobicContact CD2-CG2 3.83Å; Y320-V324 HydrophobicContact CE1-CB 3.99Å; Y320-V324 HydrophobicContact CE1-CG1 4.01Å; Y320-V324 HydrophobicContact CE2-CB 3.97Å; Y320-V324 HydrophobicContact CE2-CG1 4.05Å; Y320-V324 HydrophobicContact CE2-CG2 3.79Å; Y320-V324 HydrophobicContact CG-CB 4.25Å; Y320-V324 HydrophobicContact CG-CG2 4.3Å; Y320-V324 WeakPolarHBondContact O-CA 3.48Å; Y320-V324 VanDerWaalsContact O-CB 3.31Å; Y320-V324 WeakPolarHBondContact O-CB 3.32Å; Y320-V324 PolarHBondContact O-N 3.18Å; V324-R327 PolarHBondContact O-N 3.5Å; V324-M328 HydrophobicContact CG1-CG 4.39Å; V324-M328 HydrophobicContact CG1-SD 3.68Å; V324-M328 WeakPolarHBondContact O-CB 3.31Å; V324-M328 WeakPolarHBondContact O-CG 3.24Å; V324-M328 PolarHBondContact O-N 3.43Å
325T96Very high94.4Very high0 Ų040.8 Ų40.80%021%0.207CC..Iπ-helixtrans-58.9-58.3-172-51.60000112F97 V100 Y320 R327 M328 M329 A339 H342F97-T325 HydrophobicContact CD2-CG2 4.45Å; F97-T325 HydrophobicContact CE2-CG2 3.9Å; V100-T325 HydrophobicContact CG1-CG2 4.08Å; V100-T325 WeakPolarHBondContact CG1-OG1 3.42Å; Y320-T325 PolarHBondContact O-N 3.07Å; T325-R327 VanDerWaalsContact C-N 3.26Å; T325-R327 PolarHBondContact O-N 3.44Å; T325-M328 PolarHBondContact O-N 2.98Å; T325-M329 HydrophobicContact CG2-CG 4.3Å; T325-M329 WeakPolarHBondContact O-CB 3.37Å; T325-M329 VanDerWaalsContact O-CG 3.24Å; T325-M329 WeakPolarHBondContact O-CG 3.38Å; T325-M329 PolarHBondContact O-N 3.34Å; T325-A339 HydrophobicContact CG2-CB 4.08Å; T325-H342 HydrophobicContact CG2-CB 4.17Å; T325-H342 PolarHBondContact OG1-ND1 2.85Å
326W95Very high94.1Very high20 Ų2036 Ų368%0.07618%0.183CC..Hα-helixtrans-59.9-36.4-178177.566.8000112.9L183 H186 A321 G330 K331 N332 A339L183-W326 HydrophobicContact CD1-CB 4.05Å; L183-W326 HydrophobicContact CD1-CG 4.17Å; L183-W326 HydrophobicContact CD2-CB 3.96Å; L183-W326 HydrophobicContact CD2-CD2 3.62Å; L183-W326 HydrophobicContact CD2-CE3 3.86Å; L183-W326 HydrophobicContact CD2-CG 3.67Å; L183-W326 HydrophobicContact CG-CG 4.36Å; H186-W326 HydrophobicContact CB-CH2 4.14Å; H186-W326 HydrophobicContact CB-CZ2 4.47Å; H186-W326 WeakPolarHBondContact O-CH2 3.37Å; H186-W326 VanDerWaalsContact O-CZ2 3.29Å; H186-W326 WeakPolarHBondContact O-CZ2 3.25Å; A321-W326 VanDerWaalsContact O-CB 3.28Å; A321-W326 WeakPolarHBondContact O-CB 3.44Å; A321-W326 PolarHBondContact O-N 3.34Å; W326-G330 PolarHBondContact O-N 2.98Å; W326-K331 HydrophobicContact CD2-CB 4.29Å; W326-K331 HydrophobicContact CD2-CG 4.24Å; W326-K331 VanDerWaalsContact CE2-CA 3.49Å; W326-K331 HydrophobicContact CE3-CG 4.18Å; W326-K331 HydrophobicContact CH2-CB 4.04Å; W326-K331 HydrophobicContact CH2-CD 4.44Å; W326-K331 HydrophobicContact CH2-CG 4.21Å; W326-K331 HydrophobicContact CZ2-CB 3.69Å; W326-K331 HydrophobicContact CZ2-CG 4.26Å; W326-K331 WeakPolarHBondContact CZ2-O 3.39Å; W326-K331 HydrophobicContact CZ3-CB 4.47Å; W326-K331 HydrophobicContact CZ3-CD 4.41Å; W326-K331 HydrophobicContact CZ3-CG 4.17Å; W326-K331 WeakPolarHBondContact O-CA 3.41Å; W326-K331 PolarHBondContact O-N 3.1Å; W326-N332 PolarHBondContact NE1-O 3.2Å; W326-A339 HydrophobicContact CB-CB 4.1Å
327R94.1Very high93.9Very high108 Ų10834.5 Ų34.541%0.40818%0.176SC..Hα-helixtrans-70.5-44.7178.5-67.9-163.4163.665.1-13112.4I322 F323 V324 T325 M329 G330 K331I322-R327 PolarHBondContact O-NH1 3.23Å; F323-R327 VanDerWaalsContact O-CD 3.25Å; F323-R327 WeakPolarHBondContact O-CD 3.49Å; F323-R327 WeakPolarHBondContact O-CG 3.38Å; V324-R327 PolarHBondContact O-N 3.5Å; T325-R327 VanDerWaalsContact C-N 3.26Å; T325-R327 PolarHBondContact O-N 3.44Å; R327-M329 VanDerWaalsContact C-N 3.3Å; R327-G330 PolarHBondContact O-N 3.39Å; R327-K331 HydrophobicContact CG-CG 4.38Å
328M93.9Very high93.6Very high91 Ų9135 Ų3545%0.44818%0.178SC..Hα-helixtrans-70.1-29.4179.9-70.9-172.863.400112.4I96 V100 V324 T325 G330I96-M328 HydrophobicContact CG2-CB 4.34Å; I96-M328 HydrophobicContact CG2-CE 4.26Å; V100-M328 HydrophobicContact CG2-CB 3.88Å; V100-M328 HydrophobicContact CG2-CE 3.71Å; V100-M328 HydrophobicContact CG2-CG 4.29Å; V100-M328 HydrophobicContact CG2-SD 3.56Å; V100-M328 VanDerWaalsContact CG2-SD 3.56Å; V324-M328 HydrophobicContact CG1-CG 4.39Å; V324-M328 HydrophobicContact CG1-SD 3.68Å; V324-M328 WeakPolarHBondContact O-CB 3.31Å; V324-M328 WeakPolarHBondContact O-CG 3.24Å; V324-M328 PolarHBondContact O-N 3.43Å; T325-M328 PolarHBondContact O-N 2.98Å; M328-G330 VanDerWaalsContact C-N 3.3Å; M328-G330 PolarHBondContact O-N 2.94Å
329M92.6Very high93.5Very high19 Ų1934 Ų349%0.09417%0.171CC..THydrogen-bonded Turntrans-83.50.8176.5-60.5-47.8-73.900114V93 I96 F97 T325 R327 A335 L338 M369V93-M329 HydrophobicContact CG1-CE 3.58Å; I96-M329 HydrophobicContact CB-SD 4.5Å; I96-M329 HydrophobicContact CG2-SD 3.91Å; F97-M329 HydrophobicContact CB-CE 3.99Å; F97-M329 HydrophobicContact CB-SD 4.11Å; F97-M329 HydrophobicContact CD2-CE 4.27Å; F97-M329 HydrophobicContact CD2-CG 4.35Å; F97-M329 HydrophobicContact CD2-SD 4.03Å; F97-M329 HydrophobicContact CG-CE 4.49Å; T325-M329 HydrophobicContact CG2-CG 4.3Å; T325-M329 WeakPolarHBondContact O-CB 3.37Å; T325-M329 VanDerWaalsContact O-CG 3.24Å; T325-M329 WeakPolarHBondContact O-CG 3.38Å; T325-M329 PolarHBondContact O-N 3.34Å; R327-M329 VanDerWaalsContact C-N 3.3Å; M329-A335 HydrophobicContact CB-CB 3.63Å; M329-L338 HydrophobicContact CE-CD1 3.42Å; M329-L338 VanDerWaalsContact CE-CD1 3.42Å; M329-L338 HydrophobicContact CG-CD1 4.29Å; M329-M369 HydrophobicContact CE-CE 4.36Å; M329-M369 HydrophobicContact CE-SD 4.5Å
330G91.1Very high93.2Very high46 Ų4630 Ų3047%0.47415%0.15SC..THydrogen-bonded Turntrans108.44.216900000117W326 R327 M328 N332W326-G330 PolarHBondContact O-N 2.98Å; R327-G330 PolarHBondContact O-N 3.39Å; M328-G330 VanDerWaalsContact C-N 3.3Å; M328-G330 PolarHBondContact O-N 2.94Å; G330-N332 PolarHBondContact O-N 3.25Å
331K90.2Very high93Very high90 Ų9029.1 Ų29.139%0.39115%0.147SC..SBendtrans58.614.4176.4-53.6177.6-172.5167.30116.3S187 T188 W326 R327S187-K331 WeakPolarHBondContact CA-O 3.21Å; T188-K331 PolarHBondContact N-O 2.87Å; T188-K331 VanDerWaalsContact N-O 3.1Å; T188-K331 PolarHBondContact OG1-O 3.18Å; W326-K331 HydrophobicContact CD2-CB 4.29Å; W326-K331 HydrophobicContact CD2-CG 4.24Å; W326-K331 VanDerWaalsContact CE2-CA 3.49Å; W326-K331 HydrophobicContact CE3-CG 4.18Å; W326-K331 HydrophobicContact CH2-CB 4.04Å; W326-K331 HydrophobicContact CH2-CD 4.44Å; W326-K331 HydrophobicContact CH2-CG 4.21Å; W326-K331 HydrophobicContact CZ2-CB 3.69Å; W326-K331 HydrophobicContact CZ2-CG 4.26Å; W326-K331 WeakPolarHBondContact CZ2-O 3.39Å; W326-K331 HydrophobicContact CZ3-CB 4.47Å; W326-K331 HydrophobicContact CZ3-CD 4.41Å; W326-K331 HydrophobicContact CZ3-CG 4.17Å; W326-K331 WeakPolarHBondContact O-CA 3.41Å; W326-K331 PolarHBondContact O-N 3.1Å; R327-K331 HydrophobicContact CG-CG 4.38Å
332N89.9Confident92.9Very high32 Ų3229.1 Ų29.117%0.17115%0.147CC..SBendtrans-89.1-177.4175.264.74.6000111.1W326 G330 D334 A335 A336W326-N332 PolarHBondContact NE1-O 3.2Å; G330-N332 PolarHBondContact O-N 3.25Å; N332-D334 PolarHBondContact OD1-N 2.96Å; N332-A335 PolarHBondContact O-N 3Å; N332-A335 VanDerWaalsContact OD1-CB 3.24Å; N332-A335 WeakPolarHBondContact OD1-CB 3.36Å; N332-A335 PolarHBondContact OD1-N 2.86Å; N332-A336 PolarHBondContact O-N 3.27Å
333Y89.7Confident92.8Very high3 Ų328 Ų281%0.01214%0.142CC..Hα-helixtrans-59.8-44.7177174.7-108.2000112.8V184 T189 A335 A336 V337 I360 F364 G365 P366V184-Y333 HydrophobicContact CG1-CD2 4.18Å; V184-Y333 HydrophobicContact CG1-CE2 4.32Å; V184-Y333 HydrophobicContact CG2-CD2 3.96Å; V184-Y333 HydrophobicContact CG2-CE2 3.9Å; T189-Y333 WeakPolarHBondContact O-CB 3.34Å; T189-Y333 PolarHBondContact OG1-N 2.99Å; T189-Y333 VanDerWaalsContact OG1-N 3.15Å; Y333-A335 VanDerWaalsContact C-N 3.31Å; Y333-A335 PolarHBondContact O-N 2.9Å; Y333-A336 WeakPolarHBondContact O-CA 3.42Å; Y333-A336 VanDerWaalsContact O-CB 3.26Å; Y333-A336 WeakPolarHBondContact O-CB 3.26Å; Y333-A336 PolarHBondContact O-N 3.02Å; Y333-V337 HydrophobicContact CD1-CG2 4.26Å; Y333-V337 HydrophobicContact CD2-CG2 4.47Å; Y333-V337 HydrophobicContact CE1-CG2 3.83Å; Y333-V337 HydrophobicContact CE2-CG2 4.03Å; Y333-V337 WeakPolarHBondContact O-CG2 3.3Å; Y333-V337 PolarHBondContact O-N 3.3Å; Y333-I360 HydrophobicContact CE2-CG2 4.08Å; Y333-F364 HydrophobicContact CE2-CB 3.56Å; Y333-F364 HydrophobicContact CE2-CG 4.35Å; Y333-F364 WeakPolarHBondContact OH-CB 3.35Å; Y333-G365 PolarHBondContact OH-O 2.72Å; Y333-P366 WeakPolarHBondContact CE1-O 3.39Å
334D87.9Confident92.6Very high17 Ų1723 Ų239%0.09112%0.119CC..Hα-helixtrans-58.4-42.4177.2-65.7-47000112.6N332 A336 V337 L338 S367 H368 M369N332-D334 PolarHBondContact OD1-N 2.96Å; D334-A336 PolarHBondContact O-N 2.93Å; D334-V337 PolarHBondContact O-N 3.11Å; D334-L338 PolarHBondContact O-N 3.04Å; D334-S367 WeakPolarHBondContact OD1-CA 3.18Å; D334-S367 VanDerWaalsContact OD1-CB 3.3Å; D334-S367 WeakPolarHBondContact OD1-CB 3.42Å; D334-S367 PolarHBondContact OD1-OG 3.26Å; D334-H368 PolarHBondContact OD1-N 3.12Å; D334-M369 HydrophobicContact CB-CB 3.99Å; D334-M369 HydrophobicContact CB-CE 3.49Å; D334-M369 VanDerWaalsContact CB-CE 3.49Å; D334-M369 HydrophobicContact CB-CG 3.84Å; D334-M369 HydrophobicContact CB-SD 4.46Å
335A91.3Very high92.3Very high0 Ų022.9 Ų22.90%012%0.116CC..Hα-helixtrans-61.1-33.3173.600000112.1M329 N332 Y333 A339M329-A335 HydrophobicContact CB-CB 3.63Å; N332-A335 PolarHBondContact O-N 3Å; N332-A335 VanDerWaalsContact OD1-CB 3.24Å; N332-A335 WeakPolarHBondContact OD1-CB 3.36Å; N332-A335 PolarHBondContact OD1-N 2.86Å; Y333-A335 VanDerWaalsContact C-N 3.31Å; Y333-A335 PolarHBondContact O-N 2.9Å; A335-A339 WeakPolarHBondContact O-CB 3.47Å; A335-A339 PolarHBondContact O-N 3.08Å
336A92.3Very high92.2Very high0 Ų022.9 Ų22.90%012%0.116CC..Hα-helixtrans-71-41.1176.700000111.3L183 V184 N332 Y333 D334 A339 A340L183-A336 HydrophobicContact CB-CB 3.58Å; V184-A336 HydrophobicContact CG2-CB 3.99Å; N332-A336 PolarHBondContact O-N 3.27Å; Y333-A336 WeakPolarHBondContact O-CA 3.42Å; Y333-A336 VanDerWaalsContact O-CB 3.26Å; Y333-A336 WeakPolarHBondContact O-CB 3.26Å; Y333-A336 PolarHBondContact O-N 3.02Å; D334-A336 PolarHBondContact O-N 2.93Å; A336-A339 PolarHBondContact O-N 3.36Å; A336-A340 PolarHBondContact O-N 3.28Å
337V91.8Very high92.1Very high0 Ų022 Ų220%011%0.112CC..Hα-helixtrans-63.2-48.2174.9-1760000110.3Y333 D334 A339 A340 G341 M357 I360 T361 A370Y333-V337 HydrophobicContact CD1-CG2 4.26Å; Y333-V337 HydrophobicContact CD2-CG2 4.47Å; Y333-V337 HydrophobicContact CE1-CG2 3.83Å; Y333-V337 HydrophobicContact CE2-CG2 4.03Å; Y333-V337 WeakPolarHBondContact O-CG2 3.3Å; Y333-V337 PolarHBondContact O-N 3.3Å; D334-V337 PolarHBondContact O-N 3.11Å; V337-A339 PolarHBondContact O-N 2.73Å; V337-A340 PolarHBondContact O-N 3.29Å; V337-G341 PolarHBondContact O-N 2.96Å; V337-M357 HydrophobicContact CG1-CB 3.88Å; V337-M357 HydrophobicContact CG1-CG 3.85Å; V337-I360 HydrophobicContact CG2-CG2 3.8Å; V337-T361 HydrophobicContact CG1-CG2 4.08Å; V337-T361 HydrophobicContact CG2-CG2 4.46Å; V337-A370 HydrophobicContact CG1-CB 3.67Å
338L91.8Very high91.4Very high10 Ų1016.8 Ų16.85%0.0529%0.093CC..Hα-helixtrans-59.9-42.7174.9-78.6-176.1000112.9M329 D334 A340 G341 H342 M369M329-L338 HydrophobicContact CE-CD1 3.42Å; M329-L338 VanDerWaalsContact CE-CD1 3.42Å; M329-L338 HydrophobicContact CG-CD1 4.29Å; D334-L338 PolarHBondContact O-N 3.04Å; L338-A340 VanDerWaalsContact C-N 3.29Å; L338-A340 PolarHBondContact O-N 2.97Å; L338-G341 CarbonylContact O-C 3.4Å; L338-G341 PolarHBondContact O-N 3.41Å; L338-H342 WeakPolarHBondContact O-CB 3.42Å; L338-H342 PolarHBondContact O-N 3Å; L338-M369 HydrophobicContact CD1-CB 3.86Å; L338-M369 HydrophobicContact CD1-CE 3.44Å; L338-M369 VanDerWaalsContact CD1-CE 3.44Å; L338-M369 HydrophobicContact CD1-SD 3.92Å; L338-M369 HydrophobicContact CD2-CB 4.37Å; L338-M369 WeakPolarHBondContact CD2-O 3.37Å; L338-M369 HydrophobicContact CG-CB 3.97Å; L338-M369 HydrophobicContact CG-CE 4.32Å
339A93.8Very high90.7Very high0 Ų013.5 Ų13.50%08%0.08CC..Hα-helixtrans-64.9-33.8178.500000112.3L183 A321 T325 W326 A335 A336 V337 H342 C343L183-A339 HydrophobicContact CD1-CB 3.44Å; L183-A339 VanDerWaalsContact CD1-CB 3.44Å; A321-A339 HydrophobicContact CB-CB 4.39Å; T325-A339 HydrophobicContact CG2-CB 4.08Å; W326-A339 HydrophobicContact CB-CB 4.1Å; A335-A339 WeakPolarHBondContact O-CB 3.47Å; A335-A339 PolarHBondContact O-N 3.08Å; A336-A339 PolarHBondContact O-N 3.36Å; V337-A339 PolarHBondContact O-N 2.73Å; A339-H342 WeakPolarHBondContact O-CB 3.5Å; A339-H342 PolarHBondContact O-N 3.32Å; A339-C343 PolarHBondContact O-N 2.87Å; A339-C343 PolarHBondContact O-SG 3.27Å
340A92.2Very high90.2Very high0 Ų017.1 Ų17.10%010%0.103CC..Hα-helixtrans-74-37.4173.800000112.8A180 A336 V337 L338 H342 C343 G344 N356 I360A180-A340 HydrophobicContact CB-CB 3.82Å; A336-A340 PolarHBondContact O-N 3.28Å; V337-A340 PolarHBondContact O-N 3.29Å; L338-A340 VanDerWaalsContact C-N 3.29Å; L338-A340 PolarHBondContact O-N 2.97Å; A340-H342 VanDerWaalsContact C-N 3.27Å; A340-H342 PolarHBondContact O-N 3.46Å; A340-C343 WeakPolarHBondContact O-CB 3.3Å; A340-C343 PolarHBondContact O-N 3.12Å; A340-G344 PolarHBondContact O-N 2.91Å; A340-G344 VanDerWaalsContact O-N 3.1Å; A340-N356 WeakPolarHBondContact O-CB 3.25Å; A340-N356 PolarHBondContact O-ND2 3.04Å; A340-N356 VanDerWaalsContact O-ND2 3.08Å; A340-I360 HydrophobicContact CB-CD1 3.14Å
341G92.8Very high89.5Confident3 Ų318.2 Ų18.23%0.03110%0.102CC..Hα-helixtrans-56.8-44.1166.400000111.2V337 L338 C343 G344 F345 A353V337-G341 PolarHBondContact O-N 2.96Å; L338-G341 CarbonylContact O-C 3.4Å; L338-G341 PolarHBondContact O-N 3.41Å; G341-C343 PolarHBondContact O-N 2.98Å; G341-G344 WeakPolarHBondContact O-CA 3.31Å; G341-G344 PolarHBondContact O-N 3.16Å; G341-F345 WeakPolarHBondContact O-CD1 3.35Å; G341-F345 PolarHBondContact O-N 2.98Å; G341-A353 WeakPolarHBondContact O-CB 3.32Å
342H94.9Very high89.3Confident0 Ų014.1 Ų14.10%09%0.085CC..Hα-helixtrans-63.2-38.2176.7-164-168.6000112.8F97 L104 M317 Y320 T325 L338 A339 A340 G344 F345 G346F97-H342 HydrophobicContact CE2-CB 4.24Å; F97-H342 HydrophobicContact CZ-CB 4.09Å; L104-H342 WeakPolarHBondContact CD2-NE2 3.46Å; M317-H342 HydrophobicContact CE-CB 4.46Å; Y320-H342 AromaticContact CE1-CE1 3.99Å; T325-H342 HydrophobicContact CG2-CB 4.17Å; T325-H342 PolarHBondContact OG1-ND1 2.85Å; L338-H342 WeakPolarHBondContact O-CB 3.42Å; L338-H342 PolarHBondContact O-N 3Å; A339-H342 WeakPolarHBondContact O-CB 3.5Å; A339-H342 PolarHBondContact O-N 3.32Å; A340-H342 VanDerWaalsContact C-N 3.27Å; A340-H342 PolarHBondContact O-N 3.46Å; H342-G344 PolarHBondContact O-N 3.08Å; H342-F345 HydrophobicContact CB-CE1 4.08Å; H342-F345 AromaticContact CD2-CE1 3.48Å; H342-F345 VanDerWaalsContact CD2-CE1 3.48Å; H342-F345 WeakPolarHBondContact CD2-CE1 3.37Å; H342-F345 AromaticContact CD2-CE2 3.76Å; H342-F345 AromaticContact CD2-CZ 3.17Å; H342-F345 WeakPolarHBondContact CD2-CZ 3.33Å; H342-F345 AromaticContact NE2-CZ 3.73Å; H342-G346 VanDerWaalsContact O-CA 3.27Å; H342-G346 WeakPolarHBondContact O-CA 3.31Å; H342-G346 PolarHBondContact O-N 3.36Å
343C94.6Very high89.3Confident0 Ų012.9 Ų12.90%08%0.078CC..Hα-helixtrans-59.8-37.2169.5-65.90000111.9I175 A321 A339 A340 G341 L347I175-C343 HydrophobicContact CD1-CB 4Å; I175-C343 HydrophobicContact CG1-CB 4.09Å; A321-C343 WeakPolarHBondContact CB-SG 3.46Å; A339-C343 PolarHBondContact O-N 2.87Å; A339-C343 PolarHBondContact O-SG 3.27Å; A340-C343 WeakPolarHBondContact O-CB 3.3Å; A340-C343 PolarHBondContact O-N 3.12Å; G341-C343 PolarHBondContact O-N 2.98Å; C343-L347 PolarHBondContact O-N 3.39Å
344G91.6Very high89.1Confident0 Ų016.3 Ų16.30%010%0.096CC..Hα-helixtrans-68.6-52.9-178.500000113A340 G341 H342 G348 A349 T352 N356A340-G344 PolarHBondContact O-N 2.91Å; A340-G344 VanDerWaalsContact O-N 3.1Å; G341-G344 WeakPolarHBondContact O-CA 3.31Å; G341-G344 PolarHBondContact O-N 3.16Å; H342-G344 PolarHBondContact O-N 3.08Å; G344-G348 WeakPolarHBondContact O-CA 3.39Å; G344-G348 PolarHBondContact O-N 3.08Å; G344-A349 PolarHBondContact O-N 3.29Å; G344-T352 WeakPolarHBondContact O-CB 3.48Å; G344-N356 VanDerWaalsContact CA-ND2 3.32Å; G344-N356 WeakPolarHBondContact CA-ND2 3.47Å; G344-N356 PolarHBondContact N-ND2 3.41Å
345F91.7Very high88.9Confident41 Ų4117.4 Ų17.418%0.1811%0.108CC..Hα-helixtrans-82.8-23.4178.581.3-94.2000113.4F97 V101 S135 G341 H342 L347 A349 A353F97-F345 AromaticContact CE1-CE1 3.89Å; F97-F345 HydrophobicContact CE1-CE1 3.89Å; F97-F345 AromaticContact CE1-CZ 3.89Å; F97-F345 HydrophobicContact CE1-CZ 3.89Å; F97-F345 AromaticContact CZ-CE1 3.68Å; F97-F345 HydrophobicContact CZ-CE1 3.68Å; F97-F345 AromaticContact CZ-CZ 3.85Å; F97-F345 HydrophobicContact CZ-CZ 3.85Å; V101-F345 HydrophobicContact CG1-CE2 4.08Å; V101-F345 HydrophobicContact CG1-CZ 4.42Å; V101-F345 HydrophobicContact CG2-CE2 4.09Å; V101-F345 HydrophobicContact CG2-CZ 3.59Å; S135-F345 WeakPolarHBondContact CA-O 3.39Å; G341-F345 WeakPolarHBondContact O-CD1 3.35Å; G341-F345 PolarHBondContact O-N 2.98Å; H342-F345 HydrophobicContact CB-CE1 4.08Å; H342-F345 AromaticContact CD2-CE1 3.48Å; H342-F345 VanDerWaalsContact CD2-CE1 3.48Å; H342-F345 WeakPolarHBondContact CD2-CE1 3.37Å; H342-F345 AromaticContact CD2-CE2 3.76Å; H342-F345 AromaticContact CD2-CZ 3.17Å; H342-F345 WeakPolarHBondContact CD2-CZ 3.33Å; H342-F345 AromaticContact NE2-CZ 3.73Å; F345-L347 VanDerWaalsContact C-N 3.25Å; F345-L347 PolarHBondContact O-N 3.43Å; F345-A349 WeakPolarHBondContact CA-O 3.35Å; F345-A353 HydrophobicContact CB-CB 3.9Å; F345-A353 HydrophobicContact CD1-CB 4.1Å
346G93.7Very high88.8Confident0 Ų018.1 Ų18.10%011%0.112CC..Hα-helixtrans-73.4-15.8177.400000113.8Q108 L134 H342Q108-G346 PolarHBondContact NE2-O 2.82Å; L134-G346 CarbonylContact C-O 3.4Å; L134-G346 CarbonylContact O-C 3.57Å; H342-G346 VanDerWaalsContact O-CA 3.27Å; H342-G346 WeakPolarHBondContact O-CA 3.31Å; H342-G346 PolarHBondContact O-N 3.36Å
347L92.9Very high88.6Confident1 Ų119.7 Ų19.71%0.00512%0.119CC..Hα-helixtrans-116.9-25.9169.3-70.7174.4000114.4L134 G168 L169 L171 I175 Q313 T314 M317 C343 F345L134-L347 HydrophobicContact CB-CD2 4.48Å; L134-L347 HydrophobicContact CD1-CD2 3.98Å; L134-L347 HydrophobicContact CD2-CD2 4.38Å; L134-L347 CarbonylContact O-C 3.51Å; L134-L347 WeakPolarHBondContact O-CA 3.27Å; L134-L347 PolarHBondContact O-N 3.12Å; G168-L347 VanDerWaalsContact C-C 3.47Å; G168-L347 CarbonylContact C-O 3.25Å; G168-L347 WeakPolarHBondContact CA-O 3.29Å; G168-L347 CarbonylContact O-C 3.44Å; G168-L347 VanDerWaalsContact O-C 3.31Å; G168-L347 WeakPolarHBondContact O-CB 3.5Å; L169-L347 PolarHBondContact N-O 3.24Å; L171-L347 HydrophobicContact CB-CD1 4.34Å; I175-L347 HydrophobicContact CD1-CD1 3.4Å; I175-L347 HydrophobicContact CG1-CD1 4.05Å; Q313-L347 HydrophobicContact CB-CD2 4.49Å; T314-L347 HydrophobicContact CG2-CD1 4.05Å; M317-L347 HydrophobicContact CB-CD1 3.88Å; M317-L347 HydrophobicContact CB-CD2 4.09Å; M317-L347 HydrophobicContact CB-CG 3.89Å; M317-L347 HydrophobicContact CG-CD1 4Å; M317-L347 HydrophobicContact CG-CD2 4.49Å; M317-L347 HydrophobicContact CG-CG 3.83Å; C343-L347 PolarHBondContact O-N 3.39Å; F345-L347 VanDerWaalsContact C-N 3.25Å; F345-L347 PolarHBondContact O-N 3.43Å
348G79.3Confident88.3Confident0 Ų024.5 Ų24.50%014%0.142CC..THydrogen-bonded Turntrans-116.6-82.5-173.400000114.3L134 L169 G344L134-G348 PolarHBondContact O-N 3.15Å; L169-G348 VanDerWaalsContact CA-CA 3.48Å; G344-G348 WeakPolarHBondContact O-CA 3.39Å; G344-G348 PolarHBondContact O-N 3.08Å
349A78.7Confident87.9Confident21 Ų2126.9 Ų26.917%0.17416%0.163CC..  trans179.7179.6179.500000108.7G344 F345 P351 T352 A353G344-A349 PolarHBondContact O-N 3.29Å; F345-A349 WeakPolarHBondContact CA-O 3.35Å; A349-P351 VanDerWaalsContact C-CD 3.42Å; A349-T352 PolarHBondContact O-N 2.83Å; A349-A353 PolarHBondContact O-N 3.38Å
350T82.3Confident87.4Confident96 Ų9627.2 Ų27.259%0.58917%0.165SC*.Hα-helixtrans-50.9-42.2175.8-42.30000114.8T352 A353 I354T350-T352 VanDerWaalsContact C-N 3.29Å; T350-T352 PolarHBondContact O-N 2.94Å; T350-A353 WeakPolarHBondContact O-CB 3.4Å; T350-A353 PolarHBondContact O-N 3.18Å; T350-A353 VanDerWaalsContact O-N 3.15Å; T350-I354 HydrophobicContact CG2-CD1 3.98Å; T350-I354 HydrophobicContact CG2-CG1 4.39Å; T350-I354 WeakPolarHBondContact O-CG1 3.41Å; T350-I354 PolarHBondContact O-N 3.05Å
351P76.6Confident87Confident68 Ų6828.9 Ų28.944%0.44218%0.175SC..Hα-helixtrans-60.3-37.6179.4-24.735.5000113.3T34 A349 I354 A355T34-P351 HydrophobicContact CG2-CB 4.41Å; A349-P351 VanDerWaalsContact C-CD 3.42Å; P351-I354 PolarHBondContact O-N 3.37Å; P351-A355 WeakPolarHBondContact O-CB 3.1Å; P351-A355 PolarHBondContact O-N 3.45Å
352T85.5Confident86.4Confident5 Ų536.6 Ų36.63%0.03121%0.21CC..Hα-helixtrans-70.7-36.8177.4-51.60000111.5L169 G173 G344 A349 T350 N356L169-T352 WeakPolarHBondContact CG-OG1 3.33Å; G173-T352 VanDerWaalsContact N-CG2 3.3Å; G344-T352 WeakPolarHBondContact O-CB 3.48Å; A349-T352 PolarHBondContact O-N 2.83Å; T350-T352 VanDerWaalsContact C-N 3.29Å; T350-T352 PolarHBondContact O-N 2.94Å; T352-N356 WeakPolarHBondContact O-CB 3.31Å; T352-N356 VanDerWaalsContact O-CG 3.22Å; T352-N356 PolarHBondContact O-N 3.14Å
353A89.3Confident85.6Confident5 Ų544.5 Ų44.54%0.04124%0.24CC..Hα-helixtrans-61.1-49.2172.500000111.6G341 F345 A349 T350 A355 N356 M357G341-A353 WeakPolarHBondContact O-CB 3.32Å; F345-A353 HydrophobicContact CB-CB 3.9Å; F345-A353 HydrophobicContact CD1-CB 4.1Å; A349-A353 PolarHBondContact O-N 3.38Å; T350-A353 WeakPolarHBondContact O-CB 3.4Å; T350-A353 PolarHBondContact O-N 3.18Å; T350-A353 VanDerWaalsContact O-N 3.15Å; A353-A355 PolarHBondContact O-N 3.4Å; A353-N356 PolarHBondContact O-N 2.96Å; A353-M357 HydrophobicContact CB-CE 4.35Å; A353-M357 WeakPolarHBondContact O-CG 3.37Å; A353-M357 PolarHBondContact O-N 2.96Å
354I86.2Confident84.9Confident75 Ų7548 Ų4839%0.38526%0.255SS..Hα-helixtrans-59.4-47.8178.6-66.2168.4000110.2T350 P351 N356 M357 Q358T350-I354 HydrophobicContact CG2-CD1 3.98Å; T350-I354 HydrophobicContact CG2-CG1 4.39Å; T350-I354 WeakPolarHBondContact O-CG1 3.41Å; T350-I354 PolarHBondContact O-N 3.05Å; P351-I354 PolarHBondContact O-N 3.37Å; I354-N356 VanDerWaalsContact C-N 3.34Å; I354-N356 PolarHBondContact O-N 3.37Å; I354-M357 HydrophobicContact CG1-CE 4.43Å; I354-M357 PolarHBondContact O-N 2.83Å; I354-Q358 HydrophobicContact CG2-CG 4.16Å; I354-Q358 WeakPolarHBondContact O-CB 3.47Å; I354-Q358 VanDerWaalsContact O-CG 3.27Å; I354-Q358 WeakPolarHBondContact O-CG 3.41Å; I354-Q358 PolarHBondContact O-N 2.83Å
355A83.6Confident84.2Confident41 Ų4149.2 Ų49.234%0.33927%0.268SS..Hα-helixtrans-60.4-41.4177.900000112.5P351 A353 A359P351-A355 WeakPolarHBondContact O-CB 3.1Å; P351-A355 PolarHBondContact O-N 3.45Å; A353-A355 PolarHBondContact O-N 3.4Å; A355-A359 VanDerWaalsContact O-CB 3.26Å; A355-A359 WeakPolarHBondContact O-CB 3.33Å; A355-A359 PolarHBondContact O-N 3.2Å
356N88.9Confident83.4Confident15 Ų1550.4 Ų50.48%0.0828%0.28CS..Hα-helixtrans-64.1-45.2176.4-76.3-9.9000111.7G172 G176 A340 G344 T352 A353 I354 I360G172-N356 PolarHBondContact O-ND2 3.49Å; G172-N356 VanDerWaalsContact O-ND2 3.08Å; G176-N356 WeakPolarHBondContact CA-ND2 3.47Å; A340-N356 WeakPolarHBondContact O-CB 3.25Å; A340-N356 PolarHBondContact O-ND2 3.04Å; A340-N356 VanDerWaalsContact O-ND2 3.08Å; G344-N356 VanDerWaalsContact CA-ND2 3.32Å; G344-N356 WeakPolarHBondContact CA-ND2 3.47Å; G344-N356 PolarHBondContact N-ND2 3.41Å; T352-N356 WeakPolarHBondContact O-CB 3.31Å; T352-N356 VanDerWaalsContact O-CG 3.22Å; T352-N356 PolarHBondContact O-N 3.14Å; A353-N356 PolarHBondContact O-N 2.96Å; I354-N356 VanDerWaalsContact C-N 3.34Å; I354-N356 PolarHBondContact O-N 3.37Å; N356-I360 WeakPolarHBondContact O-CD1 3.39Å; N356-I360 VanDerWaalsContact O-CG1 3.23Å; N356-I360 WeakPolarHBondContact O-CG1 3.42Å; N356-I360 PolarHBondContact O-N 3.26Å
357M89.2Confident82.1Confident32 Ų3250.8 Ų50.816%0.15828%0.282CS..Hα-helixtrans-65.2-46.9179.3-68.4-176.3-66.200111.3V337 A353 I354 A359 I360 T361 A370V337-M357 HydrophobicContact CG1-CB 3.88Å; V337-M357 HydrophobicContact CG1-CG 3.85Å; A353-M357 HydrophobicContact CB-CE 4.35Å; A353-M357 WeakPolarHBondContact O-CG 3.37Å; A353-M357 PolarHBondContact O-N 2.96Å; I354-M357 HydrophobicContact CG1-CE 4.43Å; I354-M357 PolarHBondContact O-N 2.83Å; M357-A359 PolarHBondContact O-N 2.89Å; M357-I360 WeakPolarHBondContact O-CB 3.34Å; M357-I360 PolarHBondContact O-N 2.61Å; M357-I360 VanDerWaalsContact O-N 3.14Å; M357-T361 WeakPolarHBondContact O-CG2 3.21Å; M357-T361 PolarHBondContact O-N 3.17Å; M357-T361 PolarHBondContact O-OG1 3.12Å; M357-A370 HydrophobicContact SD-CB 4.47Å
358Q85.3Confident80.8Confident102 Ų10255.7 Ų55.748%0.47731%0.305SS..Hα-helixtrans-59-45.9176.7-73.8175.6-27.200112.1I354 I360 T361 E362I354-Q358 HydrophobicContact CG2-CG 4.16Å; I354-Q358 WeakPolarHBondContact O-CB 3.47Å; I354-Q358 VanDerWaalsContact O-CG 3.27Å; I354-Q358 WeakPolarHBondContact O-CG 3.41Å; I354-Q358 PolarHBondContact O-N 2.83Å; Q358-I360 PolarHBondContact O-N 3.31Å; Q358-I360 VanDerWaalsContact O-N 3.13Å; Q358-T361 WeakPolarHBondContact CA-OG1 3.37Å; Q358-T361 PolarHBondContact O-N 2.85Å; Q358-T361 PolarHBondContact O-OG1 3.35Å; Q358-E362 VanDerWaalsContact O-CB 3.29Å; Q358-E362 WeakPolarHBondContact O-CB 3.48Å; Q358-E362 VanDerWaalsContact O-CG 3.25Å; Q358-E362 WeakPolarHBondContact O-CG 3.27Å; Q358-E362 PolarHBondContact O-N 3.38Å
359A82.8Confident79.9Confident59 Ų5956.7 Ų56.749%0.48831%0.31SS..Hα-helixtrans-62.1-23.8179.100000113.4A355 M357A355-A359 VanDerWaalsContact O-CB 3.26Å; A355-A359 WeakPolarHBondContact O-CB 3.33Å; A355-A359 PolarHBondContact O-N 3.2Å; M357-A359 PolarHBondContact O-N 2.89Å
360I84.1Confident78.7Confident8 Ų856.6 Ų56.64%0.04131%0.309CS..Hα-helixtrans-84.2-49175.5-62.9159.9000109.7A180 V184 Y333 V337 A340 N356 M357 Q358 E362 R363 F364A180-I360 HydrophobicContact CB-CD1 3.23Å; A180-I360 HydrophobicContact CB-CG1 3.53Å; V184-I360 HydrophobicContact CG2-CG2 4.27Å; Y333-I360 HydrophobicContact CE2-CG2 4.08Å; V337-I360 HydrophobicContact CG2-CG2 3.8Å; A340-I360 HydrophobicContact CB-CD1 3.14Å; N356-I360 WeakPolarHBondContact O-CD1 3.39Å; N356-I360 VanDerWaalsContact O-CG1 3.23Å; N356-I360 WeakPolarHBondContact O-CG1 3.42Å; N356-I360 PolarHBondContact O-N 3.26Å; M357-I360 WeakPolarHBondContact O-CB 3.34Å; M357-I360 PolarHBondContact O-N 2.61Å; M357-I360 VanDerWaalsContact O-N 3.14Å; Q358-I360 PolarHBondContact O-N 3.31Å; Q358-I360 VanDerWaalsContact O-N 3.13Å; I360-E362 VanDerWaalsContact C-N 3.31Å; I360-E362 PolarHBondContact O-N 3.44Å; I360-R363 PolarHBondContact O-N 2.96Å; I360-F364 HydrophobicContact CG2-CD2 3.94Å; I360-F364 WeakPolarHBondContact O-CD2 3.21Å; I360-F364 PolarHBondContact O-N 3.28Å
361T84.1Confident77.1Confident35 Ų3555.4 Ų55.422%0.21530%0.304CS..Hα-helixtrans-67.1-33.2-176.555.20000112.6V337 M357 Q358 R363 G365 A370V337-T361 HydrophobicContact CG1-CG2 4.08Å; V337-T361 HydrophobicContact CG2-CG2 4.46Å; M357-T361 WeakPolarHBondContact O-CG2 3.21Å; M357-T361 PolarHBondContact O-N 3.17Å; M357-T361 PolarHBondContact O-OG1 3.12Å; Q358-T361 WeakPolarHBondContact CA-OG1 3.37Å; Q358-T361 PolarHBondContact O-N 2.85Å; Q358-T361 PolarHBondContact O-OG1 3.35Å; T361-R363 PolarHBondContact O-N 2.83Å; T361-G365 CarbonylContact C-O 3.57Å; T361-G365 WeakPolarHBondContact CA-O 3.41Å; T361-G365 WeakPolarHBondContact CB-O 3.31Å; T361-G365 CarbonylContact O-C 3.39Å; T361-G365 VanDerWaalsContact O-C 3.25Å; T361-G365 WeakPolarHBondContact O-CA 3.37Å; T361-G365 PolarHBondContact O-N 3.26Å; T361-A370 HydrophobicContact CG2-CB 4.38Å
362E80.1Confident75.6Confident164 Ų16458.2 Ų58.277%0.76631%0.314SS*.Hα-helixtrans-62.8-29.1170.6-75.1175.8-178.800112.9Q358 I360Q358-E362 VanDerWaalsContact O-CB 3.29Å; Q358-E362 WeakPolarHBondContact O-CB 3.48Å; Q358-E362 VanDerWaalsContact O-CG 3.25Å; Q358-E362 WeakPolarHBondContact O-CG 3.27Å; Q358-E362 PolarHBondContact O-N 3.38Å; I360-E362 VanDerWaalsContact C-N 3.31Å; I360-E362 PolarHBondContact O-N 3.44Å
363R77.7Confident75.1Confident167 Ų16760.9 Ų60.963%0.6333%0.328SS*.Hα-helixtrans-96-35-174.5-175.8172.2179.5168.93.2113.8I360 T361I360-R363 PolarHBondContact O-N 2.96Å; T361-R363 PolarHBondContact O-N 2.83Å
364F79.4Confident74.3Confident73 Ų7363.8 Ų63.832%0.3234%0.343SS..Hα-helixtrans-118.4-6.3-171-63.5-79.6000113.6V184 Y333 I360V184-F364 HydrophobicContact CG1-CD1 3.79Å; V184-F364 HydrophobicContact CG1-CD2 4.46Å; V184-F364 HydrophobicContact CG1-CE1 3.89Å; V184-F364 HydrophobicContact CG1-CG 4.09Å; V184-F364 HydrophobicContact CG1-CZ 4.27Å; V184-F364 HydrophobicContact CG2-CD2 4.44Å; Y333-F364 HydrophobicContact CE2-CB 3.56Å; Y333-F364 HydrophobicContact CE2-CG 4.35Å; Y333-F364 WeakPolarHBondContact OH-CB 3.35Å; I360-F364 HydrophobicContact CG2-CD2 3.94Å; I360-F364 WeakPolarHBondContact O-CD2 3.21Å; I360-F364 PolarHBondContact O-N 3.28Å
365G75.9Confident73.7Confident26 Ų2663.2 Ų63.227%0.26834%0.341SS..  trans110.5165.6-178.700000113.3Y333 T361Y333-G365 PolarHBondContact OH-O 2.72Å; T361-G365 CarbonylContact C-O 3.57Å; T361-G365 WeakPolarHBondContact CA-O 3.41Å; T361-G365 WeakPolarHBondContact CB-O 3.31Å; T361-G365 CarbonylContact O-C 3.39Å; T361-G365 VanDerWaalsContact O-C 3.25Å; T361-G365 WeakPolarHBondContact O-CA 3.37Å; T361-G365 PolarHBondContact O-N 3.26Å
366P74.9Confident73.1Confident66 Ų6664.5 Ų64.543%0.42934%0.341SS..  trans-61.4157.4-178.428.1-35000112.2Y333Y333-P366 WeakPolarHBondContact CE1-O 3.39Å
367S67.8Low72.1Confident8 Ų867.6 Ų67.66%0.05636%0.357CS..  trans-131.4128.8175166.20000109.3D334 M369 A370D334-S367 WeakPolarHBondContact OD1-CA 3.18Å; D334-S367 VanDerWaalsContact OD1-CB 3.3Å; D334-S367 WeakPolarHBondContact OD1-CB 3.42Å; D334-S367 PolarHBondContact OD1-OG 3.26Å; S367-M369 VanDerWaalsContact C-N 3.3Å; S367-M369 PolarHBondContact O-N 3.31Å; S367-A370 PolarHBondContact O-N 2.94Å; S367-A370 PolarHBondContact OG-N 3.35Å
368H64.7Low71Confident104 Ų10469.9 Ų69.948%0.48137%0.37SS..SBendtrans-65.7-33.5-180-99.7-119.2000112.2D334D334-H368 PolarHBondContact OD1-N 3.12Å
369M60.2Low69.9Low21 Ų2167.6 Ų67.610%0.10336%0.363CS..G310 helixtrans-85.3-15.7-178.2-60.9-150.3-68.500113.8V93 M329 D334 L338 S367 C371 I372V93-M369 HydrophobicContact CB-SD 4.39Å; V93-M369 HydrophobicContact CG1-SD 3.42Å; V93-M369 WeakPolarHBondContact CG1-SD 3.26Å; V93-M369 HydrophobicContact CG2-SD 4.01Å; M329-M369 HydrophobicContact CE-CE 4.36Å; M329-M369 HydrophobicContact CE-SD 4.5Å; D334-M369 HydrophobicContact CB-CB 3.99Å; D334-M369 HydrophobicContact CB-CE 3.49Å; D334-M369 VanDerWaalsContact CB-CE 3.49Å; D334-M369 HydrophobicContact CB-CG 3.84Å; D334-M369 HydrophobicContact CB-SD 4.46Å; L338-M369 HydrophobicContact CD1-CB 3.86Å; L338-M369 HydrophobicContact CD1-CE 3.44Å; L338-M369 VanDerWaalsContact CD1-CE 3.44Å; L338-M369 HydrophobicContact CD1-SD 3.92Å; L338-M369 HydrophobicContact CD2-CB 4.37Å; L338-M369 WeakPolarHBondContact CD2-O 3.37Å; L338-M369 HydrophobicContact CG-CB 3.97Å; L338-M369 HydrophobicContact CG-CE 4.32Å; S367-M369 VanDerWaalsContact C-N 3.3Å; S367-M369 PolarHBondContact O-N 3.31Å; M369-C371 PolarHBondContact O-N 3Å; M369-C371 VanDerWaalsContact O-N 3.13Å; M369-I372 PolarHBondContact O-N 3.18Å
370A54.8Low69Low18 Ų1868.3 Ų68.315%0.14935%0.353CS..G310 helixtrans-64.1-15.1177.100000113.5V337 M357 T361 S367V337-A370 HydrophobicContact CG1-CB 3.67Å; M357-A370 HydrophobicContact SD-CB 4.47Å; T361-A370 HydrophobicContact CG2-CB 4.38Å; S367-A370 PolarHBondContact O-N 2.94Å; S367-A370 PolarHBondContact OG-N 3.35Å
371C47.3Very low67.7Low72 Ų7273.3 Ų73.349%0.48638%0.379SS..G310 helixtrans-106.85.6-175.8-60.90000114.6F203 M369F203-C371 HydrophobicContact CD2-CB 4.33Å; F203-C371 HydrophobicContact CE2-CB 4.19Å; M369-C371 PolarHBondContact O-N 3Å; M369-C371 VanDerWaalsContact O-N 3.13Å
372I45.2Very low66.2Low126 Ų12676.8 Ų76.865%0.64639%0.394SS*.  trans-1000174.2-50.2173.8000108.8V94 M369V94-I372 HydrophobicContact CG2-CG2 3.49Å; V94-I372 VanDerWaalsContact CG2-CG2 3.49Å; M369-I372 PolarHBondContact O-N 3.18Å

Retrieved 372 of 372 residues in 115.1 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).