A0A096NVK4_PAPAN Loading...

Sphingosine-1-phosphate phosphatase 1

AlphaFold DB , UniProt , Accession A0A096NVK4, Species PAPAN (Papio anubis, Olive baboon), Gene SGPP1, Length 441 aa.

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Site Residue pLDDT pLDDT confidence pLDDT10 pLDDT10 confidence SASA SASA [Ų] SASA10 SASA10 [Ų] RSA RSA unformatted RSA10 RSA10 unformatted Surface Surface10 (not used) Disorder (not used) Disorder Sec. str. Secondary structure Isomer Phi (φ) Psi (ψ) Omega (ω) Chi 1 (χ1) Chi 2 (χ2) Chi 3 (χ3) Chi 4 (χ4) Chi 5 (χ5) Tau (τ) Contacts (colored by PAE) Contact details
1M67.4Low86.1Confident120 Ų120109.2 Ų109.259%0.59154%0.539SS*.  0124.90-90.8-174.882.800109.9Q5 R6 Q9M1-Q5 VanDerWaalsContact CA-OE1 3.25Å; M1-Q5 VanDerWaalsContact CE-C 3.46Å; M1-Q5 HydrophobicContact CE-CB 3.6Å; M1-Q5 WeakPolarHBondContact CE-O 3.45Å; M1-Q5 HydrophobicContact CG-CB 4.49Å; M1-R6 HydrophobicContact CB-CG 4.19Å; M1-R6 HydrophobicContact CE-CG 3.95Å; M1-R6 HydrophobicContact SD-CG 4.49Å; M1-Q9 HydrophobicContact CE-CG 4.01Å
2S87.6Confident86.3Confident62 Ų62103.6 Ų103.643%0.43453%0.531SS..  trans-71.1158.7174.169.40000111.5R4 Q5 R6S2-R4 PolarHBondContact O-N 2.92Å; S2-Q5 WeakPolarHBondContact O-CB 3.38Å; S2-Q5 PolarHBondContact O-N 3.25Å; S2-Q5 WeakPolarHBondContact OG-CG 3.41Å; S2-Q5 PolarHBondContact OG-N 3.36Å; S2-R6 PolarHBondContact O-N 3.23Å; S2-R6 VanDerWaalsContact O-N 3.12Å
3L85.7Confident86.7Confident135 Ų135107.8 Ų107.871%0.70754%0.536SS*.Hα-helixtrans-52.7-42.5177.3-175.472.4000111.6Q5 R6 L7L3-Q5 VanDerWaalsContact C-N 3.34Å; L3-Q5 PolarHBondContact O-N 2.95Å; L3-R6 PolarHBondContact O-N 3.46Å; L3-L7 HydrophobicContact CG-CD1 4.26Å; L3-L7 WeakPolarHBondContact O-CG 3.44Å; L3-L7 PolarHBondContact O-N 3.2Å
4R86.3Confident87.1Confident213 Ų213102.4 Ų102.480%0.80451%0.51SS*.Hα-helixtrans-59.6-41.5177.4-170177.5-179.8-171.50.3112.6S2 L7 A8S2-R4 PolarHBondContact O-N 2.92Å; R4-L7 PolarHBondContact O-N 3.31Å; R4-A8 WeakPolarHBondContact O-CB 3.11Å; R4-A8 PolarHBondContact O-N 3.25Å
5Q85.8Confident87.3Confident103 Ų10399.5 Ų99.548%0.48149%0.494SS..Hα-helixtrans-67.6-38.5177.2-70.9170.8-22.700111.8M1 S2 L3 Q9M1-Q5 VanDerWaalsContact CA-OE1 3.25Å; M1-Q5 VanDerWaalsContact CE-C 3.46Å; M1-Q5 HydrophobicContact CE-CB 3.6Å; M1-Q5 WeakPolarHBondContact CE-O 3.45Å; M1-Q5 HydrophobicContact CG-CB 4.49Å; S2-Q5 WeakPolarHBondContact O-CB 3.38Å; S2-Q5 PolarHBondContact O-N 3.25Å; S2-Q5 WeakPolarHBondContact OG-CG 3.41Å; S2-Q5 PolarHBondContact OG-N 3.36Å; L3-Q5 VanDerWaalsContact C-N 3.34Å; L3-Q5 PolarHBondContact O-N 2.95Å; Q5-Q9 WeakPolarHBondContact O-CB 3.46Å; Q5-Q9 WeakPolarHBondContact O-CG 3.42Å; Q5-Q9 PolarHBondContact O-N 3.15Å
6R89.1Confident87.6Confident164 Ų16497.1 Ų97.162%0.61948%0.483SS*.Hα-helixtrans-65.1-42.8176.3-66.7-175.6-175.7-165.5-0.1111.4M1 S2 L3 Q9 L10M1-R6 HydrophobicContact CB-CG 4.19Å; M1-R6 HydrophobicContact CE-CG 3.95Å; M1-R6 HydrophobicContact SD-CG 4.49Å; S2-R6 PolarHBondContact O-N 3.23Å; S2-R6 VanDerWaalsContact O-N 3.12Å; L3-R6 PolarHBondContact O-N 3.46Å; R6-Q9 PolarHBondContact O-N 3.09Å; R6-L10 WeakPolarHBondContact O-CB 3.27Å; R6-L10 PolarHBondContact O-N 3.45Å
7L87.5Confident87.9Confident96 Ų9693.4 Ų93.450%0.50347%0.468SS..Hα-helixtrans-64.7-45.7176.6-71173000111.9L3 R4 Q9 L10 V11L3-L7 HydrophobicContact CG-CD1 4.26Å; L3-L7 WeakPolarHBondContact O-CG 3.44Å; L3-L7 PolarHBondContact O-N 3.2Å; R4-L7 PolarHBondContact O-N 3.31Å; L7-Q9 VanDerWaalsContact C-N 3.31Å; L7-Q9 PolarHBondContact O-N 2.97Å; L7-L10 PolarHBondContact O-N 3.31Å; L7-L10 VanDerWaalsContact O-N 3.14Å; L7-V11 WeakPolarHBondContact O-CG2 3.42Å; L7-V11 PolarHBondContact O-N 2.85Å
8A87.9Confident88.1Confident64 Ų6493.4 Ų93.453%0.52947%0.466SS..Hα-helixtrans-59.9-41.7176.500000112.1R4 V11 G12R4-A8 WeakPolarHBondContact O-CB 3.11Å; R4-A8 PolarHBondContact O-N 3.25Å; A8-V11 PolarHBondContact O-N 3.07Å; A8-G12 PolarHBondContact O-N 3.24Å
9Q89.9Confident88.4Confident97 Ų9792.4 Ų92.445%0.45346%0.459SS..Hα-helixtrans-64.9-39.5174.4-77.2-174.7-0.900112.7M1 Q5 R6 L7 R13M1-Q9 HydrophobicContact CE-CG 4.01Å; Q5-Q9 WeakPolarHBondContact O-CB 3.46Å; Q5-Q9 WeakPolarHBondContact O-CG 3.42Å; Q5-Q9 PolarHBondContact O-N 3.15Å; R6-Q9 PolarHBondContact O-N 3.09Å; L7-Q9 VanDerWaalsContact C-N 3.31Å; L7-Q9 PolarHBondContact O-N 2.97Å; Q9-R13 WeakPolarHBondContact O-CB 3.15Å; Q9-R13 VanDerWaalsContact O-CG 3.27Å; Q9-R13 WeakPolarHBondContact O-CG 3.48Å; Q9-R13 PolarHBondContact O-N 3.35Å
10L90.3Very high88.7Confident93 Ų9387.8 Ų87.849%0.48744%0.436SS..Hα-helixtrans-64.3-46.6176.6-179.263.3000111.2R6 L7 R13 L14R6-L10 WeakPolarHBondContact O-CB 3.27Å; R6-L10 PolarHBondContact O-N 3.45Å; L7-L10 PolarHBondContact O-N 3.31Å; L7-L10 VanDerWaalsContact O-N 3.14Å; L10-R13 PolarHBondContact O-N 3.02Å; L10-L14 HydrophobicContact CD1-CD1 4.01Å; L10-L14 HydrophobicContact CD1-CG 4.16Å; L10-L14 HydrophobicContact CG-CD1 3.94Å; L10-L14 HydrophobicContact CG-CG 4.44Å; L10-L14 WeakPolarHBondContact O-CG 3.34Å; L10-L14 PolarHBondContact O-N 3.37Å
11V89.7Confident88.8Confident54 Ų5483.8 Ų83.833%0.32742%0.417SS..Hα-helixtrans-57.1-52176167.30000110.4L7 A8 R13 L14 Q15 L258L7-V11 WeakPolarHBondContact O-CG2 3.42Å; L7-V11 PolarHBondContact O-N 2.85Å; A8-V11 PolarHBondContact O-N 3.07Å; V11-R13 VanDerWaalsContact C-N 3.29Å; V11-R13 PolarHBondContact O-N 3.3Å; V11-L14 PolarHBondContact O-N 2.88Å; V11-L14 VanDerWaalsContact O-N 3.11Å; V11-Q15 WeakPolarHBondContact O-CB 3.29Å; V11-Q15 PolarHBondContact O-N 2.98Å; V11-L258 HydrophobicContact CG1-CD2 3.82Å
12G88.5Confident90.1Very high42 Ų4287.3 Ų87.343%0.43342%0.424SS..Hα-helixtrans-58.8-39.7177.800000112.8A8 D16A8-G12 PolarHBondContact O-N 3.24Å; G12-D16 PolarHBondContact O-N 3.45Å
13R91.5Very high90.4Very high158 Ų15886.5 Ų86.560%0.59641%0.412SS*.Hα-helixtrans-66.4-40.1175.1-77179.1-171.3-174.43.9112.7Q9 L10 V11 K19Q9-R13 WeakPolarHBondContact O-CB 3.15Å; Q9-R13 VanDerWaalsContact O-CG 3.27Å; Q9-R13 WeakPolarHBondContact O-CG 3.48Å; Q9-R13 PolarHBondContact O-N 3.35Å; L10-R13 PolarHBondContact O-N 3.02Å; V11-R13 VanDerWaalsContact C-N 3.29Å; V11-R13 PolarHBondContact O-N 3.3Å; R13-K19 VanDerWaalsContact O-CD 3.3Å; R13-K19 WeakPolarHBondContact O-CD 3.2Å; R13-K19 WeakPolarHBondContact O-CE 3.35Å; R13-K19 PolarHBondContact O-NZ 3.35Å
14L91.7Very high90.8Very high33 Ų3380.1 Ų80.117%0.17338%0.379CS..Hα-helixtrans-77.3-25.7-177.1-69.6174.1000112.6L10 V11 I257 L258 I261L10-L14 HydrophobicContact CD1-CD1 4.01Å; L10-L14 HydrophobicContact CD1-CG 4.16Å; L10-L14 HydrophobicContact CG-CD1 3.94Å; L10-L14 HydrophobicContact CG-CG 4.44Å; L10-L14 WeakPolarHBondContact O-CG 3.34Å; L10-L14 PolarHBondContact O-N 3.37Å; V11-L14 PolarHBondContact O-N 2.88Å; V11-L14 VanDerWaalsContact O-N 3.11Å; L14-I257 HydrophobicContact CD2-CB 4.48Å; L14-I257 HydrophobicContact CD2-CG2 3.96Å; L14-I257 PolarHBondContact O-N 3.44Å; L14-L258 HydrophobicContact CB-CB 3.84Å; L14-L258 HydrophobicContact CB-CD1 4.31Å; L14-L258 HydrophobicContact CD1-CD1 4.17Å; L14-L258 PolarHBondContact O-N 2.91Å; L14-I261 HydrophobicContact CD1-CD1 4.06Å; L14-I261 HydrophobicContact CD2-CD1 4.22Å
15Q91.4Very high91.1Very high59 Ų5976.6 Ų76.628%0.27637%0.366SS..Hα-helixtrans-80.5-20.2176.6-170.3179.88.100113.2V11 P17 W183 L258V11-Q15 WeakPolarHBondContact O-CB 3.29Å; V11-Q15 PolarHBondContact O-N 2.98Å; Q15-P17 VanDerWaalsContact O-CD 3.25Å; Q15-P17 WeakPolarHBondContact O-CD 3.44Å; Q15-P17 VanDerWaalsContact O-N 3.1Å; Q15-W183 VanDerWaalsContact CD-CZ2 3.47Å; Q15-W183 VanDerWaalsContact NE2-CE2 3.3Å; Q15-W183 VanDerWaalsContact NE2-CZ2 3.3Å; Q15-W183 VanDerWaalsContact NE2-NE1 3.1Å; Q15-L258 HydrophobicContact CB-CD2 4.41Å
16D91.8Very high91.4Very high60 Ų6078.5 Ų78.532%0.32138%0.378SS..  trans-49.1112.2-174.1-179.28.6000113.4G12 Q18 K19G12-D16 PolarHBondContact O-N 3.45Å; D16-Q18 PolarHBondContact O-N 2.91Å; D16-Q18 VanDerWaalsContact O-N 3.12Å; D16-Q18 VanDerWaalsContact OD1-CB 3.3Å; D16-Q18 WeakPolarHBondContact OD1-CB 3.24Å; D16-Q18 WeakPolarHBondContact OD1-CG 3.04Å; D16-Q18 PolarHBondContact OD1-N 3.4Å; D16-K19 HydrophobicContact CB-CD 4.48Å; D16-K19 HydrophobicContact CB-CG 4.31Å; D16-K19 WeakPolarHBondContact O-CB 3.29Å; D16-K19 PolarHBondContact O-N 3.31Å
17P91.6Very high91.6Very high34 Ų3471 Ų7122%0.22135%0.351CS..Hα-helixtrans-59-23.8178.5-24.234.4000113.6Q15 K19 V20 A21 A187 P190 V191Q15-P17 VanDerWaalsContact O-CD 3.25Å; Q15-P17 WeakPolarHBondContact O-CD 3.44Å; Q15-P17 VanDerWaalsContact O-N 3.1Å; P17-K19 PolarHBondContact O-N 3.25Å; P17-V20 PolarHBondContact O-N 2.95Å; P17-A21 PolarHBondContact O-N 3.35Å; P17-A187 HydrophobicContact CG-CB 4.32Å; P17-P190 HydrophobicContact CB-CG 4.23Å; P17-V191 HydrophobicContact CB-CG2 3.9Å; P17-V191 WeakPolarHBondContact O-CG2 3.34Å
18Q92.8Very high91.7Very high94 Ų9466.9 Ų66.944%0.43933%0.331SS..Hα-helixtrans-63.2-30.5176.8-67-67.7-15.500112.2D16 R22D16-Q18 PolarHBondContact O-N 2.91Å; D16-Q18 VanDerWaalsContact O-N 3.12Å; D16-Q18 VanDerWaalsContact OD1-CB 3.3Å; D16-Q18 WeakPolarHBondContact OD1-CB 3.24Å; D16-Q18 WeakPolarHBondContact OD1-CG 3.04Å; D16-Q18 PolarHBondContact OD1-N 3.4Å; Q18-R22 VanDerWaalsContact O-CB 3.23Å; Q18-R22 WeakPolarHBondContact O-CB 3.2Å; Q18-R22 PolarHBondContact O-N 3.48Å
19K93.8Very high91.7Very high74 Ų7463.9 Ų63.932%0.32231%0.307SS..Hα-helixtrans-69-40.9176.5-66-174.9177.5179.40111.8R13 D16 P17 R22 F23 I257R13-K19 VanDerWaalsContact O-CD 3.3Å; R13-K19 WeakPolarHBondContact O-CD 3.2Å; R13-K19 WeakPolarHBondContact O-CE 3.35Å; R13-K19 PolarHBondContact O-NZ 3.35Å; D16-K19 HydrophobicContact CB-CD 4.48Å; D16-K19 HydrophobicContact CB-CG 4.31Å; D16-K19 WeakPolarHBondContact O-CB 3.29Å; D16-K19 PolarHBondContact O-N 3.31Å; P17-K19 PolarHBondContact O-N 3.25Å; K19-R22 PolarHBondContact O-N 3.27Å; K19-F23 WeakPolarHBondContact O-CB 3.36Å; K19-F23 PolarHBondContact O-N 3.13Å; K19-I257 HydrophobicContact CB-CD1 4.01Å; K19-I257 HydrophobicContact CD-CD1 3.98Å
20V93.4Very high91.4Very high1 Ų163.8 Ų63.81%0.00631%0.306CS..Hα-helixtrans-62.7-49.4174.6-177.10000109.5P17 R22 F23 Q24 V191 I250P17-V20 PolarHBondContact O-N 2.95Å; V20-R22 VanDerWaalsContact C-N 3.3Å; V20-R22 PolarHBondContact O-N 2.97Å; V20-F23 WeakPolarHBondContact O-CB 3.23Å; V20-F23 PolarHBondContact O-N 3.27Å; V20-F23 VanDerWaalsContact O-N 3.16Å; V20-Q24 WeakPolarHBondContact O-CG 3.49Å; V20-Q24 PolarHBondContact O-N 2.89Å; V20-V191 HydrophobicContact CB-CG2 3.82Å; V20-V191 HydrophobicContact CG1-CG1 3.8Å; V20-V191 HydrophobicContact CG1-CG2 3.93Å; V20-I250 HydrophobicContact CB-CG2 4.4Å; V20-I250 HydrophobicContact CG1-CG2 4.04Å; V20-I250 WeakPolarHBondContact CG1-O 3.14Å; V20-I250 HydrophobicContact CG2-CG2 4.33Å
21A92.1Very high90.6Very high4 Ų462.3 Ų62.33%0.03331%0.307CS..Hα-helixtrans-63.2-33177.200000113.2P17 R25 P190 V191P17-A21 PolarHBondContact O-N 3.35Å; A21-R25 WeakPolarHBondContact O-CB 3.26Å; A21-R25 WeakPolarHBondContact O-CG 3.39Å; A21-R25 PolarHBondContact O-N 2.95Å; A21-R25 PolarHBondContact O-NE 3.23Å; A21-P190 HydrophobicContact CB-CB 3.98Å; A21-P190 HydrophobicContact CB-CG 4.05Å; A21-V191 HydrophobicContact CB-CG2 4.42Å
22R93.7Very high89.4Confident194 Ų19462.7 Ų62.773%0.73231%0.311SS*.Hα-helixtrans-69.2-41.2174-175.8178.7178.1-176-0.3111.4Q18 K19 V20 R25 L26Q18-R22 VanDerWaalsContact O-CB 3.23Å; Q18-R22 WeakPolarHBondContact O-CB 3.2Å; Q18-R22 PolarHBondContact O-N 3.48Å; K19-R22 PolarHBondContact O-N 3.27Å; V20-R22 VanDerWaalsContact C-N 3.3Å; V20-R22 PolarHBondContact O-N 2.97Å; R22-R25 PolarHBondContact O-N 2.95Å; R22-L26 WeakPolarHBondContact O-CB 3.36Å; R22-L26 PolarHBondContact O-N 3.44Å
23F94.2Very high87.8Confident44 Ų4466.3 Ų66.319%0.19333%0.327CS..Hα-helixtrans-63-44.9174.3179.7-105.8000111.4K19 V20 R25 L26 C27 F132 L247 I250K19-F23 WeakPolarHBondContact O-CB 3.36Å; K19-F23 PolarHBondContact O-N 3.13Å; V20-F23 WeakPolarHBondContact O-CB 3.23Å; V20-F23 PolarHBondContact O-N 3.27Å; V20-F23 VanDerWaalsContact O-N 3.16Å; F23-R25 PolarHBondContact O-N 2.62Å; F23-L26 WeakPolarHBondContact O-CB 3.33Å; F23-L26 PolarHBondContact O-N 3.42Å; F23-C27 PolarHBondContact O-N 3.46Å; F23-C27 PolarHBondContact O-SG 2.96Å; F23-C27 VanDerWaalsContact O-SG 3.36Å; F23-F132 HydrophobicContact CZ-CE2 4.5Å; F23-F132 HydrophobicContact CZ-CZ 4.01Å; F23-L247 HydrophobicContact CE2-CD2 4.26Å; F23-L247 HydrophobicContact CZ-CB 4.24Å; F23-L247 HydrophobicContact CZ-CD2 4.04Å; F23-I250 HydrophobicContact CB-CG2 4.15Å; F23-I250 HydrophobicContact CD1-CB 3.97Å; F23-I250 HydrophobicContact CD1-CG2 3.48Å; F23-I250 VanDerWaalsContact CD1-CG2 3.48Å; F23-I250 HydrophobicContact CE1-CB 4.1Å; F23-I250 HydrophobicContact CE1-CG2 4.12Å; F23-I250 HydrophobicContact CG-CG2 4Å
24Q93.4Very high85.9Confident2 Ų269.4 Ų69.41%0.00934%0.338CS..Hα-helixtrans-55.8-48.9173.8-77.7-173.8-39.200112.2V20 L26 C27 G28 V29 V192 Y251V20-Q24 WeakPolarHBondContact O-CG 3.49Å; V20-Q24 PolarHBondContact O-N 2.89Å; Q24-L26 PolarHBondContact O-N 2.82Å; Q24-C27 CarbonylContact O-C 3.52Å; Q24-C27 PolarHBondContact O-N 3.49Å; Q24-C27 VanDerWaalsContact O-N 3.12Å; Q24-G28 PolarHBondContact O-N 3.37Å; Q24-G28 VanDerWaalsContact O-N 3.08Å; Q24-V29 CarbonylContact C-O 3.5Å; Q24-V29 HydrophobicContact CB-CB 4.02Å; Q24-V29 HydrophobicContact CB-CG1 4.46Å; Q24-V29 PolarHBondContact O-N 3.15Å; Q24-V192 PolarHBondContact NE2-O 2.93Å; Q24-Y251 PolarHBondContact NE2-O 3.24Å
25R92.5Very high83.5Confident139 Ų13979.2 Ų79.253%0.52537%0.373SS..Hα-helixtrans-60.7-42.3175.6-76.9-179.7-77.4-179.6-5.8112.8A21 R22 F23 C27 G28A21-R25 WeakPolarHBondContact O-CB 3.26Å; A21-R25 WeakPolarHBondContact O-CG 3.39Å; A21-R25 PolarHBondContact O-N 2.95Å; A21-R25 PolarHBondContact O-NE 3.23Å; R22-R25 PolarHBondContact O-N 2.95Å; F23-R25 PolarHBondContact O-N 2.62Å; R25-C27 PolarHBondContact O-N 2.9Å; R25-G28 PolarHBondContact O-N 3Å
26L93.6Very high80.8Confident142 Ų14281.5 Ų81.574%0.74340%0.396SS*.Hα-helixtrans-59.3-37.1175.4-176.969.2000111.6R22 F23 Q24 G28R22-L26 WeakPolarHBondContact O-CB 3.36Å; R22-L26 PolarHBondContact O-N 3.44Å; F23-L26 WeakPolarHBondContact O-CB 3.33Å; F23-L26 PolarHBondContact O-N 3.42Å; Q24-L26 PolarHBondContact O-N 2.82Å; L26-G28 VanDerWaalsContact C-N 3.27Å; L26-G28 PolarHBondContact O-N 3.13Å
27C91.9Very high78.1Confident8 Ų882.7 Ų82.75%0.05441%0.414CS..THydrogen-bonded Turntrans-87.19.6176.4-57.90000113.6F23 Q24 R25 N125 L128 F132 Y251F23-C27 PolarHBondContact O-N 3.46Å; F23-C27 PolarHBondContact O-SG 2.96Å; F23-C27 VanDerWaalsContact O-SG 3.36Å; Q24-C27 CarbonylContact O-C 3.52Å; Q24-C27 PolarHBondContact O-N 3.49Å; Q24-C27 VanDerWaalsContact O-N 3.12Å; R25-C27 PolarHBondContact O-N 2.9Å; C27-N125 WeakPolarHBondContact O-CB 3.41Å; C27-L128 HydrophobicContact CB-CD1 4.14Å; C27-F132 HydrophobicContact CB-CE2 4.37Å; C27-Y251 HydrophobicContact CB-CD2 3.61Å; C27-Y251 HydrophobicContact CB-CE2 3.41Å; C27-Y251 VanDerWaalsContact CB-CE2 3.41Å
28G89.3Confident75.2Confident8 Ų886 Ų868%0.08243%0.429CS..THydrogen-bonded Turntrans81.723.3173.700000115.7Q24 R25 L26 V123 S124Q24-G28 PolarHBondContact O-N 3.37Å; Q24-G28 VanDerWaalsContact O-N 3.08Å; R25-G28 PolarHBondContact O-N 3Å; L26-G28 VanDerWaalsContact C-N 3.27Å; L26-G28 PolarHBondContact O-N 3.13Å; G28-V123 CarbonylContact O-C 3.37Å; G28-V123 WeakPolarHBondContact O-CA 3.33Å; G28-S124 WeakPolarHBondContact CA-OG 3.42Å; G28-S124 PolarHBondContact O-N 2.71Å; G28-S124 PolarHBondContact O-OG 3.04Å
29V88Confident72.4Confident2 Ų286.5 Ų86.51%0.01244%0.441CS..EExtended strand (participates in β ladder)trans-100.9123.3174.6-177.90000109.6Q24 A121 V123 V192 L194 Y251Q24-V29 CarbonylContact C-O 3.5Å; Q24-V29 HydrophobicContact CB-CB 4.02Å; Q24-V29 HydrophobicContact CB-CG1 4.46Å; Q24-V29 PolarHBondContact O-N 3.15Å; V29-A121 HydrophobicContact CG1-CB 4.32Å; V29-V123 HydrophobicContact CG2-CG2 4.34Å; V29-V192 HydrophobicContact CG1-CB 4.22Å; V29-V192 HydrophobicContact CG1-CG1 4.3Å; V29-L194 HydrophobicContact CG1-CD1 4.31Å; V29-L194 HydrophobicContact CG1-CD2 4.32Å; V29-L194 HydrophobicContact CG2-CD1 4.27Å; V29-Y251 HydrophobicContact CG2-CD2 4.28Å; V29-Y251 HydrophobicContact CG2-CE1 4.19Å; V29-Y251 HydrophobicContact CG2-CE2 3.39Å; V29-Y251 WeakPolarHBondContact CG2-OH 3.23Å
30E83.3Confident69.5Low94 Ų9492.9 Ų92.944%0.43946%0.463SS..EExtended strand (participates in β ladder)trans-128142178.7-67.6177.9176.800110.8R122E30-R122 PolarHBondContact N-O 2.67Å; E30-R122 PolarHBondContact O-N 3.31Å
31A74.1Confident66.7Low62 Ų62101.1 Ų101.151%0.51250%0.502SS..PPolyproline II helixtrans-64.1141168.500000108.9V192A31-V192 HydrophobicContact CB-CG2 3.83Å
32P65.2Low63.8Low63 Ų63106.9 Ų106.941%0.40953%0.532SS..PPolyproline II helixtrans-59.9144.9174.528.3-34.3000108.8R34 L120P32-R34 PolarHBondContact O-N 3.29Å; P32-R34 VanDerWaalsContact O-N 3.16Å; P32-L120 WeakPolarHBondContact CD-O 3.35Å; P32-L120 WeakPolarHBondContact CG-O 3.36Å
33P55.5Low60.9Low118 Ų118106 Ų10677%0.76654%0.536SS*.PPolyproline II helixtrans-55.6127.917322-29.8000107.9R35P33-R35 PolarHBondContact O-N 3.46Å
34R51.4Low57.9Low222 Ų222114 Ų11484%0.83857%0.571SS**PPolyproline II helixtrans-52.1120.4168.7-80.3-177.8171.6-178.6-4.1105.7P32 S36P32-R34 PolarHBondContact O-N 3.29Å; P32-R34 VanDerWaalsContact O-N 3.16Å; R34-S36 PolarHBondContact O-N 3.4Å
35R40.6Very low55.2Low239 Ų239117.9 Ų117.990%0.90260%0.603SS**PPolyproline II helixtrans-52.6117.3160.7-83.9-179.5171.4172.6-5.2104.3P33 A37P33-R35 PolarHBondContact O-N 3.46Å; R35-A37 PolarHBondContact O-N 2.9Å
36S33.6Very low52.3Low108 Ų108120.2 Ų120.276%0.75562%0.62SS**  trans-45.5120.416341.70000105.5R34 D38R34-S36 PolarHBondContact O-N 3.4Å; S36-D38 PolarHBondContact O-N 3.39Å
37A35.2Very low49.1Very low84 Ų84117.9 Ų117.969%0.69462%0.621SS**  trans-49.3113.3165.500000105.3R35 P39R35-A37 PolarHBondContact O-N 2.9Å; A37-P39 VanDerWaalsContact O-CD 3.27Å; A37-P39 WeakPolarHBondContact O-CD 3.38Å
38D30.9Very low46.1Very low103 Ų103123.6 Ų123.655%0.55166%0.658SS**  trans-65.5118.8170.6-164.4-8.4000104.3S36 R40 E41S36-D38 PolarHBondContact O-N 3.39Å; D38-R40 PolarHBondContact O-N 3.24Å; D38-E41 PolarHBondContact O-N 3.49Å
39P33.8Very low43.4Very low106 Ų106132 Ų13269%0.68870%0.701SS**THydrogen-bonded Turntrans-64.19.6-175-19.431.5000114.2A37A37-P39 VanDerWaalsContact O-CD 3.27Å; A37-P39 WeakPolarHBondContact O-CD 3.38Å
40R34.5Very low40.5Very low207 Ų207136.5 Ų136.578%0.78174%0.738SS**THydrogen-bonded Turntrans-106.7-2.1-171.3-65.8-175.8172.9-168.1-1.4114.2D38D38-R40 PolarHBondContact O-N 3.24Å
41E34.2Very low37.8Very low174 Ų174135.9 Ų135.981%0.81376%0.757SS**SBendtrans-95.9-13.2172.7-71.2-168.4158.400113.8D38D38-E41 PolarHBondContact O-N 3.49Å
42D31.1Very low35.5Very low125 Ų125140.5 Ų140.567%0.66877%0.773SS**G310 helixtrans-84.6-10.6177.2-74.4-34.1000113.8K44 A45D42-K44 VanDerWaalsContact C-N 3.27Å; D42-K44 PolarHBondContact O-N 3.04Å; D42-A45 PolarHBondContact O-N 3.01Å
43E32.7Very low33.9Very low175 Ų175142.4 Ų142.482%0.81879%0.785SS**G310 helixtrans-86.816-177.5-130.6-179.8-175.700114.5
44K31.7Very low32.5Very low212 Ų212147.9 Ų147.992%0.92279%0.791SS**G310 helixtrans-120.35.5167.9-84.1-173178.2179.50114.2D42D42-K44 VanDerWaalsContact C-N 3.27Å; D42-K44 PolarHBondContact O-N 3.04Å
45A35.4Very low31.3Very low84 Ų84145.9 Ų145.969%0.69480%0.796SS**SBendtrans-112.57.1-177.600000114.8D42D42-A45 PolarHBondContact O-N 3.01Å
46E32.3Very low30.7Very low188 Ų188146.2 Ų146.288%0.87980%0.797SS**  trans-122.591.1172.8-74.7-170.7149.700111.4
47A27.2Very low30.2Very low93 Ų93144.9 Ų144.977%0.76980%0.8SS**  trans-121.1125.6156.100000107.8
48P29.2Very low29.7Very low128 Ų128152.6 Ų152.683%0.83181%0.811SS**  trans-74.8132.8-172.1-1227.3000112.4A50P48-A50 PolarHBondContact O-N 3.13Å; P48-A50 VanDerWaalsContact O-N 3.14Å
49L31.5Very low30.2Very low185 Ų185152.8 Ų152.897%0.96982%0.818SS**  trans-67.399.5162.5-81152.9000109.4
50A27.9Very low30.6Very low96 Ų96153.7 Ų153.779%0.79382%0.824SS**  trans-97.1121.3164.300000109.3P48P48-A50 PolarHBondContact O-N 3.13Å; P48-A50 VanDerWaalsContact O-N 3.14Å
51G26.5Very low30.2Very low82 Ų82147.6 Ų147.685%0.84583%0.826SS**  trans-75.5153.3177.500000112.9
52D25.8Very low29.7Very low158 Ų158143.9 Ų143.985%0.84583%0.825SS**  trans-129.7121.5175.2-165.99.7000110.3
53P30.8Very low30.3Very low103 Ų103144.2 Ų144.267%0.66983%0.834SS**  trans-100.4123.9172.734-24000112.4
54R26Very low30.1Very low234 Ų234139.7 Ų139.788%0.88383%0.834SS**  trans58.8119.4146.3-58.6-178.6177.3-174.1-0.2118.7
55L27.4Very low29.8Very low179 Ų179133.3 Ų133.394%0.93783%0.829SS**  trans-155.2148.4132.8-110.8135.8000113.7
56R26.8Very low29.7Very low247 Ų247135.4 Ų135.493%0.93284%0.835SS**  trans-74157.7-168.2-72.4166.6164.7165-5.7113.5
57G24.4Very low29.8Very low80 Ų80135.3 Ų135.383%0.82584%0.835SS**  trans153.4101.8146.200000117
58R23.8Very low30.4Very low245 Ų245136.6 Ų136.693%0.92584%0.835SS**  trans-123.5166.3150.4-134.8-172.2-178.9-179.61.6105.4
59P41.5Very low30.8Very low107 Ų107136.4 Ų136.470%0.69583%0.834SS**  cis-140.3-143.84.541.4-17.2000110.8
60P41.4Very low30.5Very low125 Ų125131.2 Ų131.281%0.81283%0.825SS**  cis-138.5174.7-11.736.5-15.5000116.9
61G26.1Very low30.3Very low80 Ų80132.1 Ų132.183%0.82583%0.826SS**  trans149118.7156.500000116.8
62A25.1Very low30.3Very low96 Ų96135.4 Ų135.479%0.79382%0.824SS**  trans-96.8-167.2176.300000111.4
63P42.6Very low30.3Very low132 Ų132138.4 Ų138.486%0.85782%0.823SS**  cis-140.9179.6-9.537.3-16.3000116.4
64G28.1Very low30.1Very low79 Ų79139.6 Ų139.681%0.81482%0.824SS**  trans114113.9159.800000113.4
65G26.9Very low30Very low79 Ų79137.6 Ų137.681%0.81483%0.825SS**  cis107.3148.640.100000108.4
66P33.2Very low29.9Very low128 Ų128135 Ų13583%0.83182%0.82SS**  cis-120.8166.5-24.938.9-23.1000113.8
67Q33.8Very low30.1Very low186 Ų186129.3 Ų129.387%0.86982%0.815SS**  trans-74.5160.4156.6-72.6-176.5-24.600110
68P39.4Very low30.1Very low119 Ų119130 Ų13077%0.77381%0.814SS**  -154.1-160.49743.6-22.4000112.9
69P37.9Very low30.1Very low125 Ų125128.1 Ų128.181%0.81281%0.812SS**  -124.9-174.4-97.535.8-13.7000113.6
70G25.2Very low29.6Very low76 Ų76127.8 Ų127.878%0.78481%0.81SS**  trans-69.5176-164.600000118
71S24.6Very low28.8Very low115 Ų115129.6 Ų129.680%0.80481%0.813SS**  trans-169.8128.9138.270.90000111.1
72D25.7Very low28.6Very low151 Ų151129 Ų12981%0.80781%0.806SS**  trans14.7149.8135.2-77.3-35.8000122.4
73R25.1Very low28.5Very low220 Ų220131.5 Ų131.583%0.8381%0.812SS**  trans95.2117.4143.2-87169170-176-2.9119.4
74N26.3Very low27.6Very low129 Ų129128.2 Ų128.269%0.6980%0.801SS**  49.7111.9129.4-67.5-5.4000117.7
75Q25.7Very low27.4Very low192 Ų192130.6 Ų130.690%0.89781%0.806SS**  -172.7111.8120.1-100.2149.57600111.2
76C25Very low27.6Very low124 Ų124132.5 Ų132.584%0.83880%0.803SS**  trans-71.3152.3140.7-67.40000107.8
77P31.3Very low27.3Very low127 Ų127133.8 Ų133.883%0.82580%0.803SS**  -137.1157.5106.129.8-13.6000114.8
78A23.8Very low26.9Very low96 Ų96128.9 Ų128.979%0.79380%0.803SS**  trans-47.9151-177.800000117.6
79K24.4Very low26.3Very low204 Ų204128.5 Ų128.589%0.88780%0.798SS**  -146.6153.6125.5-106.7-172.1179.1-179.40111.6
80P30.5Very low25.6Very low100 Ų100134.5 Ų134.565%0.64981%0.805SS**  trans-96.3-172.1-164.640.5-34.4000112.7
81D24.2Very low25.7Very low164 Ų164137.7 Ų137.788%0.87780%0.804SS**  trans99124.4176.3-48-26.5000111.9
82G21.8Very low26Very low66 Ų66135.8 Ų135.868%0.6880%0.802SS**  cis152.813511.500000107.1
83V23.4Very low26Very low150 Ų150137 Ų13791%0.90981%0.808SS**  trans69.9106.5150.7-167.50000118.9
84G23.8Very low26.2Very low62 Ų62131.3 Ų131.364%0.63981%0.808SS**  45.3107.3127.800000119.4P86G84-P86 WeakPolarHBondContact O-CD 3.24Å
85S23.7Very low26.3Very low130 Ų130129.9 Ų129.991%0.90981%0.814SS**PPolyproline II helixtrans-66.5116.6161.1-59.20000110.8
86P30.3Very low26.3Very low118 Ų118129.9 Ų129.977%0.76681%0.814SS**PPolyproline II helixtrans-83132.8170.6-2.422.7000109G84 G88G84-P86 WeakPolarHBondContact O-CD 3.24Å; P86-G88 PolarHBondContact O-N 2.98Å; P86-G88 VanDerWaalsContact O-N 3.15Å
87N27.7Very low26.7Very low155 Ų155132.9 Ų132.983%0.82982%0.821SS**PPolyproline II helixtrans-46.2119.5160.6-77.5-40.3000109.3V89N87-V89 VanDerWaalsContact C-N 3.26Å; N87-V89 PolarHBondContact O-N 3.24Å
88G24.6Very low26.7Very low84 Ų84129.4 Ų129.487%0.86681%0.808SS**  trans-67.879.3178.700000112.2P86P86-G88 PolarHBondContact O-N 2.98Å; P86-G88 VanDerWaalsContact O-N 3.15Å
89V27Very low27.3Very low111 Ų111131.1 Ų131.167%0.67381%0.811SS**  trans-9096.9157.31800000106N87 N91N87-V89 VanDerWaalsContact C-N 3.26Å; N87-V89 PolarHBondContact O-N 3.24Å; V89-N91 PolarHBondContact O-N 2.93Å
90R24Very low28.1Very low250 Ų250126.5 Ų126.594%0.94381%0.811SS**  trans-77.992.3173.6-157.6174.1175.6-176.1-1.7107.8G92R90-G92 PolarHBondContact O-N 2.82Å; R90-G92 VanDerWaalsContact O-N 3.17Å
91N27.4Very low28.9Very low144 Ų144126.2 Ų126.277%0.7781%0.811SS**  trans-64.2109167.4-78.4-16.8000108.5V89 L93V89-N91 PolarHBondContact O-N 2.93Å; N91-L93 PolarHBondContact O-N 3.39Å
92G29.5Very low30.1Very low75 Ų75121.5 Ų121.577%0.77379%0.789SS**  trans-76.111417000000109.8R90R90-G92 PolarHBondContact O-N 2.82Å; R90-G92 VanDerWaalsContact O-N 3.17Å
93L25.8Very low31.8Very low175 Ų175126.6 Ų126.692%0.91679%0.788SS**PPolyproline II helixtrans-60.8146.8168.5-141.185.3000110.1N91 A95N91-L93 PolarHBondContact O-N 3.39Å; L93-A95 PolarHBondContact O-N 3.45Å
94A29.6Very low33.4Very low102 Ų102129.5 Ų129.584%0.84378%0.783SS**PPolyproline II helixtrans-59.4129.3-175.700000112.9
95A28.5Very low34.9Very low98 Ų98127 Ų12781%0.8176%0.756SS**PPolyproline II helixtrans-103.5143.5165.700000109.4L93L93-A95 PolarHBondContact O-N 3.45Å
96E26.3Very low36.1Very low193 Ų193121.8 Ų121.890%0.90272%0.723SS**PPolyproline II helixtrans-50.5150.9-167.9-63.6-173.9128.600116.4G98E96-G98 PolarHBondContact O-N 2.92Å
97L34Very low36.8Very low187 Ų187118.4 Ų118.498%0.97971%0.705SS**  trans-65.897175.9-93.290.8000111.6
98G30.5Very low37.6Very low54 Ų54117.1 Ų117.156%0.55770%0.697SS**  trans-96.2170.2153.400000111.9E96 A100E96-G98 PolarHBondContact O-N 2.92Å; G98-A100 PolarHBondContact O-N 2.78Å
99P37.1Very low38.7Very low132 Ų132122 Ų12286%0.85769%0.69SS**SBendtrans-54.4133.5-177.722.9-32000110.5S101P99-S101 PolarHBondContact O-N 3.13Å
100A40.7Very low39.6Very low106 Ų106125 Ų12588%0.87669%0.689SS**  trans-42.598.3-165.300000113.2G98G98-A100 PolarHBondContact O-N 2.78Å
101S47.8Very low41Very low95 Ų95113.4 Ų113.466%0.66465%0.645SS**PPolyproline II helixtrans-69.3141.5174.758.70000109.3P99 R103P99-S101 PolarHBondContact O-N 3.13Å; S101-R103 PolarHBondContact O-N 3Å
102P49.4Very low42.1Very low64 Ų64110.5 Ų110.542%0.41664%0.636SS.*PPolyproline II helixtrans-57.3122.6174.726.2-37.8000110.2R104 R122P102-R104 PolarHBondContact O-N 2.94Å; P102-R122 HydrophobicContact CB-CG 4.17Å; P102-R122 VanDerWaalsContact CG-CZ 3.45Å; P102-R122 VanDerWaalsContact CG-NH2 3.26Å
103R57.5Low43.1Very low173 Ų173109 Ų10965%0.65361%0.61SS**PPolyproline II helixtrans-70.8130.1-179.1-65.8-178.3179.2175.6-0.8109.5S101 A105 V123S101-R103 PolarHBondContact O-N 3Å; R103-A105 PolarHBondContact O-N 3.5Å; R103-V123 PolarHBondContact O-N 2.94Å
104R57.1Low44.4Very low212 Ų212102.8 Ų102.880%0.858%0.58SS**BIsolated β-bridgetrans-75.6120.8169.1-68.4-177.1-173.9179.82.3107.4P102P102-R104 PolarHBondContact O-N 2.94Å
105A54.4Low45.6Very low8 Ų899.4 Ų99.47%0.06656%0.555CS.*  trans-130.5114.4176.700000108.2R103 A121 V123 W126 Y129R103-A105 PolarHBondContact O-N 3.5Å; A105-A121 CarbonylContact C-O 3.45Å; A105-A121 PolarHBondContact N-O 3.38Å; A105-A121 VanDerWaalsContact N-O 3.07Å; A105-A121 CarbonylContact O-C 3.54Å; A105-A121 WeakPolarHBondContact O-CB 3.16Å; A105-V123 HydrophobicContact CB-CB 3.86Å; A105-V123 HydrophobicContact CB-CG2 3.71Å; A105-W126 HydrophobicContact CB-CZ3 3.79Å; A105-Y129 HydrophobicContact CB-CE2 4.4Å
106G49.8Very low46.8Very low22 Ų2298.6 Ų98.623%0.22754%0.535CS..  trans-167.9123.7174.700000104.5L108G106-L108 PolarHBondContact O-N 3.04Å
107A44Very low48.3Very low47 Ų4795.8 Ų95.839%0.38852%0.521SS..  trans-64.8112.4176.300000106.7R109A107-R109 HydrophobicContact CB-CB 3.8Å; A107-R109 PolarHBondContact O-N 3.36Å
108L45.6Very low49.4Very low127 Ų12787.7 Ų87.767%0.66548%0.483SS*.  trans-68.550161.3-122.5140000107.9G106 L120G106-L108 PolarHBondContact O-N 3.04Å; L108-L120 HydrophobicContact CD1-CD2 4.4Å
109R46.3Very low50.9Low188 Ų18889.7 Ų89.771%0.70948%0.478SS*.  trans-99.598-175.9-158.3178.5-166.1-168.73.6106.1A107A107-R109 HydrophobicContact CB-CB 3.8Å; A107-R109 PolarHBondContact O-N 3.36Å
110R46.5Very low52.2Low174 Ų17487.3 Ų87.366%0.65746%0.458SS*.  trans-63.8129.3175.4-169.1173.9-177.2-174.4-0.6109.4S112 G115 E116 E117R110-S112 PolarHBondContact O-N 3.31Å; R110-G115 PolarHBondContact NE-O 3.4Å; R110-E116 WeakPolarHBondContact CA-O 3.43Å; R110-E117 HydrophobicContact CG-CG 4.42Å
111N53.7Low53.8Low5 Ų582.3 Ų82.33%0.02742%0.417CS..  trans-64.7121.1171-174.5-35.2000108.4L113 T114 G115 E116 F197N111-L113 VanDerWaalsContact C-N 3.27Å; N111-L113 PolarHBondContact O-N 2.69Å; N111-L113 WeakPolarHBondContact OD1-CB 3.32Å; N111-L113 PolarHBondContact OD1-N 3.36Å; N111-T114 WeakPolarHBondContact CB-OG1 3.49Å; N111-T114 PolarHBondContact ND2-OG1 3.15Å; N111-T114 VanDerWaalsContact ND2-OG1 3.11Å; N111-T114 PolarHBondContact OD1-N 2.69Å; N111-T114 VanDerWaalsContact OD1-N 3.08Å; N111-G115 WeakPolarHBondContact O-CA 3.35Å; N111-G115 PolarHBondContact O-N 3.02Å; N111-E116 HydrophobicContact CB-CB 4.45Å; N111-E116 PolarHBondContact N-O 3.33Å; N111-F197 PolarHBondContact ND2-O 3.15Å
112S49.7Very low55.3Low83 Ų8383 Ų8358%0.5841%0.405SS*.THydrogen-bonded Turntrans-72.9-19.7-17751.40000113.6R110R110-S112 PolarHBondContact O-N 3.31Å
113L50.8Low57Low43 Ų4380.2 Ų80.223%0.22539%0.386CS..THydrogen-bonded Turntrans-91.4-47.2178.5-66.3168.5000111.2N111 F197 T314 Q407N111-L113 VanDerWaalsContact C-N 3.27Å; N111-L113 PolarHBondContact O-N 2.69Å; N111-L113 WeakPolarHBondContact OD1-CB 3.32Å; N111-L113 PolarHBondContact OD1-N 3.36Å; L113-F197 HydrophobicContact CD1-CZ 4.43Å; L113-T314 HydrophobicContact CD1-CG2 4.47Å; L113-Q407 PolarHBondContact O-NE2 3.25Å
114T52.8Low58.4Low46 Ų4676 Ų7628%0.28238%0.384SS..THydrogen-bonded Turntrans-99.4-15.2-174.867.50000114.3N111 E116N111-T114 WeakPolarHBondContact CB-OG1 3.49Å; N111-T114 PolarHBondContact ND2-OG1 3.15Å; N111-T114 VanDerWaalsContact ND2-OG1 3.11Å; N111-T114 PolarHBondContact OD1-N 2.69Å; N111-T114 VanDerWaalsContact OD1-N 3.08Å; T114-E116 PolarHBondContact O-N 3.22Å
115G54.5Low60Low31 Ų3168.9 Ų68.932%0.3236%0.361SS..  trans77.2-2.8-178.700000115.5R110 N111R110-G115 PolarHBondContact NE-O 3.4Å; N111-G115 WeakPolarHBondContact O-CA 3.35Å; N111-G115 PolarHBondContact O-N 3.02Å
116E54.8Low61.5Low81 Ų8173.8 Ų73.838%0.37938%0.378SS..PPolyproline II helixtrans-62138.5-178.4-70.7-172176.900112.9R110 N111 T114 V196 N199R110-E116 WeakPolarHBondContact CA-O 3.43Å; N111-E116 HydrophobicContact CB-CB 4.45Å; N111-E116 PolarHBondContact N-O 3.33Å; T114-E116 PolarHBondContact O-N 3.22Å; E116-V196 HydrophobicContact CB-CG1 3.5Å; E116-N199 VanDerWaalsContact OE2-CB 3.29Å; E116-N199 WeakPolarHBondContact OE2-CB 3.33Å; E116-N199 PolarHBondContact OE2-ND2 2.9Å; E116-N199 VanDerWaalsContact OE2-ND2 3.15Å
117E57.2Low63.6Low133 Ų13377.4 Ų77.462%0.62140%0.397SS*.PPolyproline II helixtrans-102.5142.5175.4-63.6-170.4168.700111.3R110R110-E117 HydrophobicContact CG-CG 4.42Å
118G58.2Low65.8Low17 Ų1777.6 Ų77.618%0.17539%0.392CS..PPolyproline II helixtrans-74.7148.3-178.900000113.7
119Q61.3Low68Low96 Ų9673.4 Ų73.445%0.44937%0.367SS..PPolyproline II helixtrans-73.1129.8173.1-72176.7-3.400110.2A121 S188Q119-A121 PolarHBondContact O-N 3.44Å; Q119-S188 PolarHBondContact OE1-OG 3.2Å
120L65Low70.2Confident82 Ų8267.2 Ų67.243%0.42935%0.352SS..  trans-68.2100.7173.9-83.5154.3000110P32 L108P32-L120 WeakPolarHBondContact CD-O 3.35Å; P32-L120 WeakPolarHBondContact CG-O 3.36Å; L108-L120 HydrophobicContact CD1-CD2 4.4Å
121A73.4Confident72.5Confident2 Ų262.7 Ų62.72%0.01734%0.34CS..  trans-88.3152.8175.900000112.3V29 A105 Q119 V192 L194V29-A121 HydrophobicContact CG1-CB 4.32Å; A105-A121 CarbonylContact C-O 3.45Å; A105-A121 PolarHBondContact N-O 3.38Å; A105-A121 VanDerWaalsContact N-O 3.07Å; A105-A121 CarbonylContact O-C 3.54Å; A105-A121 WeakPolarHBondContact O-CB 3.16Å; Q119-A121 PolarHBondContact O-N 3.44Å; A121-V192 HydrophobicContact CB-CG1 3.58Å; A121-L194 HydrophobicContact CB-CD2 3.47Å; A121-L194 VanDerWaalsContact CB-CD2 3.47Å
122R79.3Confident74.4Confident110 Ų11063.1 Ų63.142%0.41534%0.342SS..EExtended strand (participates in β ladder)trans-94.5126166.8-177180173.6177.6-2.6107.9E30 P102E30-R122 PolarHBondContact N-O 2.67Å; E30-R122 PolarHBondContact O-N 3.31Å; P102-R122 HydrophobicContact CB-CG 4.17Å; P102-R122 VanDerWaalsContact CG-CZ 3.45Å; P102-R122 VanDerWaalsContact CG-NH2 3.26Å
123V85.3Confident76.4Confident5 Ų560.7 Ų60.73%0.0333%0.325CS..EExtended strand (participates in β ladder)trans-120.6117.3179.1178.90000109.1G28 V29 R103 A105 Y129G28-V123 CarbonylContact O-C 3.37Å; G28-V123 WeakPolarHBondContact O-CA 3.33Å; V29-V123 HydrophobicContact CG2-CG2 4.34Å; R103-V123 PolarHBondContact O-N 2.94Å; A105-V123 HydrophobicContact CB-CB 3.86Å; A105-V123 HydrophobicContact CB-CG2 3.71Å; V123-Y129 HydrophobicContact CG1-CD2 4.19Å; V123-Y129 HydrophobicContact CG1-CG 4.19Å; V123-Y129 HydrophobicContact CG2-CD2 4.2Å
124S86.4Confident78.5Confident85 Ų8564.3 Ų64.359%0.59434%0.339SS*.SBendtrans-90.1-33.6178.760.40000112.8G28G28-S124 WeakPolarHBondContact CA-OG 3.42Å; G28-S124 PolarHBondContact O-N 2.71Å; G28-S124 PolarHBondContact O-OG 3.04Å
125N90.4Very high80.5Confident61 Ų6162.1 Ų62.133%0.32633%0.326SS..  trans-102.690.2-178.1-164.4-28.6000112.1C27 P127 L128 Y129C27-N125 WeakPolarHBondContact O-CB 3.41Å; N125-P127 WeakPolarHBondContact OD1-CD 3.13Å; N125-L128 HydrophobicContact CB-CB 4.37Å; N125-L128 HydrophobicContact CB-CD1 4.36Å; N125-L128 VanDerWaalsContact ND2-CD1 3.29Å; N125-L128 WeakPolarHBondContact ND2-CD1 3.33Å; N125-L128 PolarHBondContact OD1-N 3.38Å; N125-Y129 PolarHBondContact O-N 2.84Å; N125-Y129 VanDerWaalsContact O-N 3.13Å
126W86.9Confident82.3Confident112 Ų11260.9 Ų60.942%0.42431%0.312SS..Hα-helixtrans-67-42-176.3-171.3-106000114.8A105 L128 Y129 C130A105-W126 HydrophobicContact CB-CZ3 3.79Å; W126-L128 VanDerWaalsContact C-N 3.32Å; W126-L128 PolarHBondContact O-N 2.89Å; W126-Y129 HydrophobicContact CD2-CD1 4.26Å; W126-Y129 AromaticContact CE3-CD1 3.68Å; W126-Y129 HydrophobicContact CE3-CD1 3.68Å; W126-Y129 HydrophobicContact CE3-CE1 4.31Å; W126-Y129 HydrophobicContact CE3-CG 4.21Å; W126-Y129 AromaticContact CH2-CD1 3.7Å; W126-Y129 HydrophobicContact CH2-CD1 3.7Å; W126-Y129 AromaticContact CH2-CE1 3.57Å; W126-Y129 HydrophobicContact CH2-CE1 3.57Å; W126-Y129 HydrophobicContact CZ2-CD1 4.27Å; W126-Y129 HydrophobicContact CZ2-CE1 4.37Å; W126-Y129 AromaticContact CZ3-CD1 3.36Å; W126-Y129 HydrophobicContact CZ3-CD1 3.36Å; W126-Y129 AromaticContact CZ3-CE1 3.53Å; W126-Y129 HydrophobicContact CZ3-CE1 3.53Å; W126-Y129 HydrophobicContact CZ3-CG 4.15Å; W126-Y129 WeakPolarHBondContact O-CB 3.49Å; W126-Y129 PolarHBondContact O-N 3.4Å; W126-Y129 VanDerWaalsContact O-N 3.17Å; W126-C130 PolarHBondContact NE1-SG 2.89Å; W126-C130 VanDerWaalsContact NE1-SG 3.39Å; W126-C130 PolarHBondContact O-N 3.46Å; W126-C130 PolarHBondContact O-SG 2.97Å
127P92.9Very high84.2Confident97 Ų9760.7 Ų60.763%0.6331%0.311SS*.Hα-helixtrans-56.8-43.3175.3-27.935.4000113.4N125 C130 L131N125-P127 WeakPolarHBondContact OD1-CD 3.13Å; P127-C130 PolarHBondContact O-N 3.23Å; P127-L131 WeakPolarHBondContact O-CB 3.48Å; P127-L131 PolarHBondContact O-N 3.45Å
128L92.1Very high85.9Confident51 Ų5155.1 Ų55.127%0.26729%0.285SS..Hα-helixtrans-66.6-38.8176.2-73.7-177.1000112.2C27 N125 W126 L131 F132C27-L128 HydrophobicContact CB-CD1 4.14Å; N125-L128 HydrophobicContact CB-CB 4.37Å; N125-L128 HydrophobicContact CB-CD1 4.36Å; N125-L128 VanDerWaalsContact ND2-CD1 3.29Å; N125-L128 WeakPolarHBondContact ND2-CD1 3.33Å; N125-L128 PolarHBondContact OD1-N 3.38Å; W126-L128 VanDerWaalsContact C-N 3.32Å; W126-L128 PolarHBondContact O-N 2.89Å; L128-L131 HydrophobicContact CD2-CD2 4.32Å; L128-L131 PolarHBondContact O-N 2.89Å; L128-F132 HydrophobicContact CB-CD2 4.36Å; L128-F132 HydrophobicContact CB-CE2 4.24Å; L128-F132 HydrophobicContact CD2-CE2 4.31Å; L128-F132 WeakPolarHBondContact O-CD2 3.44Å; L128-F132 PolarHBondContact O-N 3.18Å
129Y90.4Very high87.5Confident40 Ų4054.5 Ų54.516%0.15728%0.279CS..Hα-helixtrans-57.5-50.4173.6175.7-96.2000111.3A105 V123 N125 W126 L131 F132 C133 Y251A105-Y129 HydrophobicContact CB-CE2 4.4Å; V123-Y129 HydrophobicContact CG1-CD2 4.19Å; V123-Y129 HydrophobicContact CG1-CG 4.19Å; V123-Y129 HydrophobicContact CG2-CD2 4.2Å; N125-Y129 PolarHBondContact O-N 2.84Å; N125-Y129 VanDerWaalsContact O-N 3.13Å; W126-Y129 HydrophobicContact CD2-CD1 4.26Å; W126-Y129 AromaticContact CE3-CD1 3.68Å; W126-Y129 HydrophobicContact CE3-CD1 3.68Å; W126-Y129 HydrophobicContact CE3-CE1 4.31Å; W126-Y129 HydrophobicContact CE3-CG 4.21Å; W126-Y129 AromaticContact CH2-CD1 3.7Å; W126-Y129 HydrophobicContact CH2-CD1 3.7Å; W126-Y129 AromaticContact CH2-CE1 3.57Å; W126-Y129 HydrophobicContact CH2-CE1 3.57Å; W126-Y129 HydrophobicContact CZ2-CD1 4.27Å; W126-Y129 HydrophobicContact CZ2-CE1 4.37Å; W126-Y129 AromaticContact CZ3-CD1 3.36Å; W126-Y129 HydrophobicContact CZ3-CD1 3.36Å; W126-Y129 AromaticContact CZ3-CE1 3.53Å; W126-Y129 HydrophobicContact CZ3-CE1 3.53Å; W126-Y129 HydrophobicContact CZ3-CG 4.15Å; W126-Y129 WeakPolarHBondContact O-CB 3.49Å; W126-Y129 PolarHBondContact O-N 3.4Å; W126-Y129 VanDerWaalsContact O-N 3.17Å; Y129-L131 VanDerWaalsContact C-N 3.33Å; Y129-L131 PolarHBondContact O-N 3.14Å; Y129-F132 PolarHBondContact O-N 3.41Å; Y129-C133 VanDerWaalsContact CE1-SG 3.58Å; Y129-C133 WeakPolarHBondContact O-CB 3.44Å; Y129-C133 PolarHBondContact O-N 3.45Å; Y129-C133 PolarHBondContact O-SG 3.03Å; Y129-Y251 WeakPolarHBondContact CA-OH 3.47Å; Y129-Y251 WeakPolarHBondContact CB-OH 3.42Å; Y129-Y251 HydrophobicContact CD2-CE1 4.01Å
130C92.4Very high88.9Confident57 Ų5750.6 Ų50.639%0.38526%0.261SS..Hα-helixtrans-59.4-43.4176.5-68.60000112.2W126 P127 C133 F134W126-C130 PolarHBondContact NE1-SG 2.89Å; W126-C130 VanDerWaalsContact NE1-SG 3.39Å; W126-C130 PolarHBondContact O-N 3.46Å; W126-C130 PolarHBondContact O-SG 2.97Å; P127-C130 PolarHBondContact O-N 3.23Å; C130-C133 PolarHBondContact O-N 3.14Å; C130-F134 WeakPolarHBondContact O-CB 3.27Å; C130-F134 PolarHBondContact O-N 3.09Å
131L95.1Very high90Very high79 Ų7949.8 Ų49.841%0.41426%0.255SS..Hα-helixtrans-61.2-45.7178.9-178.466.3000111.8P127 L128 Y129 F134 G135 L244P127-L131 WeakPolarHBondContact O-CB 3.48Å; P127-L131 PolarHBondContact O-N 3.45Å; L128-L131 HydrophobicContact CD2-CD2 4.32Å; L128-L131 PolarHBondContact O-N 2.89Å; Y129-L131 VanDerWaalsContact C-N 3.33Å; Y129-L131 PolarHBondContact O-N 3.14Å; L131-F134 WeakPolarHBondContact O-CB 3.37Å; L131-F134 PolarHBondContact O-N 3.28Å; L131-G135 PolarHBondContact O-N 3.5Å; L131-L244 HydrophobicContact CD1-CD1 3.69Å; L131-L244 HydrophobicContact CD2-CD1 4.36Å; L131-L244 HydrophobicContact CG-CD1 3.68Å
132F94.4Very high90.8Very high14 Ų1454.9 Ų54.96%0.06128%0.282CS..Hα-helixtrans-76.8-31.4179.8-67.6-50.9000113.1F23 C27 L128 Y129 F134 G135 T136 L247 S248 Y251 M252F23-F132 HydrophobicContact CZ-CE2 4.5Å; F23-F132 HydrophobicContact CZ-CZ 4.01Å; C27-F132 HydrophobicContact CB-CE2 4.37Å; L128-F132 HydrophobicContact CB-CD2 4.36Å; L128-F132 HydrophobicContact CB-CE2 4.24Å; L128-F132 HydrophobicContact CD2-CE2 4.31Å; L128-F132 WeakPolarHBondContact O-CD2 3.44Å; L128-F132 PolarHBondContact O-N 3.18Å; Y129-F132 PolarHBondContact O-N 3.41Å; F132-F134 VanDerWaalsContact C-N 3.34Å; F132-G135 PolarHBondContact O-N 2.98Å; F132-T136 PolarHBondContact O-N 3.31Å; F132-L247 HydrophobicContact CD1-CB 4.45Å; F132-L247 HydrophobicContact CE1-CB 3.66Å; F132-L247 HydrophobicContact CZ-CB 4.36Å; F132-S248 VanDerWaalsContact O-CB 3.27Å; F132-S248 WeakPolarHBondContact O-CB 3.36Å; F132-Y251 HydrophobicContact CB-CD1 3.48Å; F132-Y251 VanDerWaalsContact CB-CD1 3.48Å; F132-Y251 HydrophobicContact CB-CE1 4.02Å; F132-Y251 HydrophobicContact CB-CG 3.77Å; F132-Y251 AromaticContact CD2-CD1 3.78Å; F132-Y251 HydrophobicContact CD2-CD1 3.78Å; F132-Y251 AromaticContact CD2-CD2 3.25Å; F132-Y251 HydrophobicContact CD2-CD2 3.25Å; F132-Y251 HydrophobicContact CD2-CE1 4.14Å; F132-Y251 AromaticContact CD2-CE2 3.68Å; F132-Y251 HydrophobicContact CD2-CE2 3.68Å; F132-Y251 AromaticContact CD2-CG 3.3Å; F132-Y251 HydrophobicContact CD2-CG 3.3Å; F132-Y251 AromaticContact CE2-CD2 3.61Å; F132-Y251 HydrophobicContact CE2-CD2 3.61Å; F132-Y251 HydrophobicContact CE2-CE2 4.13Å; F132-Y251 HydrophobicContact CE2-CG 4.01Å; F132-Y251 AromaticContact CG-CD1 3.94Å; F132-Y251 HydrophobicContact CG-CD1 3.94Å; F132-Y251 HydrophobicContact CG-CD2 4.12Å; F132-Y251 AromaticContact CG-CG 3.68Å; F132-Y251 HydrophobicContact CG-CG 3.68Å; F132-M252 WeakPolarHBondContact O-CE 3.29Å
133C91.9Very high91.6Very high33 Ų3351 Ų5122%0.22327%0.267CS..Hα-helixtrans-56.4-51.5166.2-75.50000110.1Y129 C130 G135 T136 E137 M252Y129-C133 VanDerWaalsContact CE1-SG 3.58Å; Y129-C133 WeakPolarHBondContact O-CB 3.44Å; Y129-C133 PolarHBondContact O-N 3.45Å; Y129-C133 PolarHBondContact O-SG 3.03Å; C130-C133 PolarHBondContact O-N 3.14Å; C133-G135 VanDerWaalsContact C-N 3.35Å; C133-G135 PolarHBondContact O-N 2.94Å; C133-T136 PolarHBondContact O-N 3.23Å; C133-E137 WeakPolarHBondContact O-CG 3.38Å; C133-E137 PolarHBondContact O-N 3.38Å; C133-M252 HydrophobicContact CB-CE 4.28Å
134F94Very high92Very high119 Ų11951.7 Ų51.752%0.52227%0.27SS..Hα-helixtrans-57.7-46.4175.9175.9-105.4000112C130 L131 F132 T136 E137 L138 L244C130-F134 WeakPolarHBondContact O-CB 3.27Å; C130-F134 PolarHBondContact O-N 3.09Å; L131-F134 WeakPolarHBondContact O-CB 3.37Å; L131-F134 PolarHBondContact O-N 3.28Å; F132-F134 VanDerWaalsContact C-N 3.34Å; F134-T136 VanDerWaalsContact C-N 3.29Å; F134-T136 PolarHBondContact O-N 2.92Å; F134-E137 PolarHBondContact O-N 3.46Å; F134-E137 VanDerWaalsContact O-N 3.12Å; F134-L138 HydrophobicContact CE1-CD1 3.99Å; F134-L138 HydrophobicContact CE1-CD2 4.42Å; F134-L138 HydrophobicContact CE1-CG 4.35Å; F134-L138 HydrophobicContact CE2-CD2 4.31Å; F134-L138 HydrophobicContact CZ-CD1 4.35Å; F134-L138 HydrophobicContact CZ-CD2 3.96Å; F134-L138 HydrophobicContact CZ-CG 4.35Å; F134-L138 PolarHBondContact O-N 3.47Å; F134-L244 HydrophobicContact CD1-CD2 3.99Å; F134-L244 HydrophobicContact CE1-CD2 4.07Å
135G95Very high92.3Very high0 Ų048.7 Ų48.70%025%0.247CC..Hα-helixtrans-59.9-34.8177.100000114.1L131 F132 C133L131-G135 PolarHBondContact O-N 3.5Å; F132-G135 PolarHBondContact O-N 2.98Å; C133-G135 VanDerWaalsContact C-N 3.35Å; C133-G135 PolarHBondContact O-N 2.94Å
136T92.6Very high92.5Very high4 Ų449.4 Ų49.43%0.02525%0.25CS..Hα-helixtrans-72.8-38.3173.9-84.40000111.9F132 C133 F134 L138 G139 S248 R249F132-T136 PolarHBondContact O-N 3.31Å; C133-T136 PolarHBondContact O-N 3.23Å; F134-T136 VanDerWaalsContact C-N 3.29Å; F134-T136 PolarHBondContact O-N 2.92Å; T136-L138 PolarHBondContact O-N 2.97Å; T136-G139 PolarHBondContact O-N 3.38Å; T136-S248 PolarHBondContact N-OG 2.85Å; T136-S248 PolarHBondContact OG1-OG 3.26Å; T136-R249 PolarHBondContact OG1-NH1 3.24Å
137E93.3Very high93Very high77 Ų7745.1 Ų45.136%0.3624%0.235SC..Hα-helixtrans-61.6-28.7177-68.9-59.1161.400112.9C133 F134 G139 N140 F143C133-E137 WeakPolarHBondContact O-CG 3.38Å; C133-E137 PolarHBondContact O-N 3.38Å; F134-E137 PolarHBondContact O-N 3.46Å; F134-E137 VanDerWaalsContact O-N 3.12Å; E137-G139 PolarHBondContact O-N 2.97Å; E137-G139 VanDerWaalsContact O-N 3.07Å; E137-N140 PolarHBondContact O-N 3.33Å; E137-N140 PolarHBondContact OE2-ND2 2.92Å; E137-F143 WeakPolarHBondContact O-CB 3.28Å
138L94.3Very high93.2Very high17 Ų1740.9 Ų40.99%0.08921%0.206CC..THydrogen-bonded Turntrans-63.2-9.4172.8-62.9178.1000114.4F134 T136 F143 W241 L244 V245F134-L138 HydrophobicContact CE1-CD1 3.99Å; F134-L138 HydrophobicContact CE1-CD2 4.42Å; F134-L138 HydrophobicContact CE1-CG 4.35Å; F134-L138 HydrophobicContact CE2-CD2 4.31Å; F134-L138 HydrophobicContact CZ-CD1 4.35Å; F134-L138 HydrophobicContact CZ-CD2 3.96Å; F134-L138 HydrophobicContact CZ-CG 4.35Å; F134-L138 PolarHBondContact O-N 3.47Å; T136-L138 PolarHBondContact O-N 2.97Å; L138-F143 HydrophobicContact CD2-CD2 3.64Å; L138-F143 HydrophobicContact CD2-CE2 3.75Å; L138-F143 HydrophobicContact CD2-CG 4.36Å; L138-F143 WeakPolarHBondContact O-CD1 3.46Å; L138-F143 WeakPolarHBondContact O-CE1 3.44Å; L138-W241 HydrophobicContact CB-CZ2 4.48Å; L138-W241 HydrophobicContact CD1-CZ2 4.29Å; L138-W241 HydrophobicContact CD2-CZ2 4.11Å; L138-L244 HydrophobicContact CD1-CD2 4.08Å; L138-V245 HydrophobicContact CB-CG2 3.98Å; L138-V245 HydrophobicContact CD1-CG2 4.15Å
139G90.4Very high93.4Very high4 Ų438.5 Ų38.54%0.04119%0.194CC..THydrogen-bonded Turntrans-113.111172.600000114.1T136 E137 Y144 H208T136-G139 PolarHBondContact O-N 3.38Å; E137-G139 PolarHBondContact O-N 2.97Å; E137-G139 VanDerWaalsContact O-N 3.07Å; G139-Y144 PolarHBondContact O-OH 3.44Å; G139-H208 PolarHBondContact O-NE2 3.4Å
140N90.6Very high93.7Very high14 Ų1440.5 Ų40.58%0.07520%0.204CC..SBendtrans-105.1163.4-177.4-71.9-18.4000112.5E137 L142 F143 Y144 H208E137-N140 PolarHBondContact O-N 3.33Å; E137-N140 PolarHBondContact OE2-ND2 2.92Å; N140-L142 VanDerWaalsContact C-N 3.26Å; N140-L142 PolarHBondContact O-N 3.46Å; N140-F143 PolarHBondContact O-N 3.25Å; N140-F143 VanDerWaalsContact O-N 3.07Å; N140-Y144 WeakPolarHBondContact O-CD2 3.31Å; N140-Y144 PolarHBondContact O-N 2.69Å; N140-H208 PolarHBondContact OD1-NE2 3.28Å
141E89.6Confident93.9Very high64 Ų6439 Ų3930%0.29919%0.19SC..Hα-helixtrans-48.5-44.6179.3-174.1-166.2164.700112.8F143 Y144 I145 E321 R380 Y420E141-F143 VanDerWaalsContact C-N 3.3Å; E141-F143 PolarHBondContact O-N 3.16Å; E141-Y144 PolarHBondContact O-N 2.99Å; E141-Y144 VanDerWaalsContact O-N 3.15Å; E141-I145 HydrophobicContact CG-CD1 3.73Å; E141-I145 HydrophobicContact CG-CG1 4.3Å; E141-I145 WeakPolarHBondContact O-CG1 3.29Å; E141-I145 PolarHBondContact O-N 2.9Å; E141-I145 WeakPolarHBondContact OE1-CD1 3.44Å; E141-E321 WeakPolarHBondContact CG-OE1 3.08Å; E141-R380 IonicContact OE1-CZ 3.94Å; E141-R380 VanDerWaalsContact OE1-CZ 3.24Å; E141-R380 IonicContact OE1-NE 3.08Å; E141-R380 IonicContact OE1-NH1 3.68Å; E141-R380 IonicContact OE1-NH2 2.97Å; E141-R380 PolarHBondContact OE1-NH2 3.28Å; E141-R380 IonicContact OE2-NH2 3.31Å; E141-Y420 VanDerWaalsContact OE1-CE1 3.25Å; E141-Y420 WeakPolarHBondContact OE1-CE1 3.3Å; E141-Y420 VanDerWaalsContact OE1-CZ 3.32Å; E141-Y420 PolarHBondContact OE1-OH 3.11Å
142L90.2Very high93.9Very high110 Ų11036 Ų3658%0.57617%0.174SC*.Hα-helixtrans-60.7-39.8-177.3-176.966.6000112.2N140 L146N140-L142 VanDerWaalsContact C-N 3.26Å; N140-L142 PolarHBondContact O-N 3.46Å; L142-L146 HydrophobicContact CD1-CD1 4.34Å; L142-L146 HydrophobicContact CG-CD1 4.31Å; L142-L146 WeakPolarHBondContact O-CG 3.42Å; L142-L146 PolarHBondContact O-N 3.42Å
143F94.9Very high94Very high27 Ų2735.8 Ų35.812%0.11817%0.173CC..Hα-helixtrans-63.7-47.1176.2165.9-101.3000110.6E137 L138 N140 E141 I145 L146 F147 I215 W241E137-F143 WeakPolarHBondContact O-CB 3.28Å; L138-F143 HydrophobicContact CD2-CD2 3.64Å; L138-F143 HydrophobicContact CD2-CE2 3.75Å; L138-F143 HydrophobicContact CD2-CG 4.36Å; L138-F143 WeakPolarHBondContact O-CD1 3.46Å; L138-F143 WeakPolarHBondContact O-CE1 3.44Å; N140-F143 PolarHBondContact O-N 3.25Å; N140-F143 VanDerWaalsContact O-N 3.07Å; E141-F143 VanDerWaalsContact C-N 3.3Å; E141-F143 PolarHBondContact O-N 3.16Å; F143-I145 PolarHBondContact O-N 2.96Å; F143-L146 PolarHBondContact O-N 3.31Å; F143-L146 VanDerWaalsContact O-N 3.16Å; F143-F147 HydrophobicContact CD1-CB 4.44Å; F143-F147 HydrophobicContact CD2-CB 4.09Å; F143-F147 HydrophobicContact CE1-CB 4.04Å; F143-F147 HydrophobicContact CE1-CD1 4.22Å; F143-F147 HydrophobicContact CE1-CD2 4.43Å; F143-F147 AromaticContact CE1-CG 3.99Å; F143-F147 HydrophobicContact CE1-CG 3.99Å; F143-F147 HydrophobicContact CE2-CB 3.66Å; F143-F147 AromaticContact CE2-CD2 3.54Å; F143-F147 HydrophobicContact CE2-CD2 3.54Å; F143-F147 HydrophobicContact CE2-CE2 4.33Å; F143-F147 AromaticContact CE2-CG 3.73Å; F143-F147 HydrophobicContact CE2-CG 3.73Å; F143-F147 HydrophobicContact CG-CB 4.46Å; F143-F147 HydrophobicContact CZ-CB 3.61Å; F143-F147 AromaticContact CZ-CD1 3.87Å; F143-F147 HydrophobicContact CZ-CD1 3.87Å; F143-F147 AromaticContact CZ-CD2 3.37Å; F143-F147 HydrophobicContact CZ-CD2 3.37Å; F143-F147 HydrophobicContact CZ-CE1 4.37Å; F143-F147 AromaticContact CZ-CE2 3.91Å; F143-F147 HydrophobicContact CZ-CE2 3.91Å; F143-F147 AromaticContact CZ-CG 3.33Å; F143-F147 HydrophobicContact CZ-CG 3.33Å; F143-F147 HydrophobicContact CZ-CZ 4.37Å; F143-F147 WeakPolarHBondContact O-CB 3.49Å; F143-F147 PolarHBondContact O-N 3.23Å; F143-I215 HydrophobicContact CE1-CD1 3.89Å; F143-W241 HydrophobicContact CE1-CZ2 4.17Å; F143-W241 AromaticContact CE2-CH2 3.83Å; F143-W241 HydrophobicContact CE2-CH2 3.83Å; F143-W241 AromaticContact CE2-CZ2 3.78Å; F143-W241 HydrophobicContact CE2-CZ2 3.78Å; F143-W241 AromaticContact CZ-CH2 3.61Å; F143-W241 HydrophobicContact CZ-CH2 3.61Å; F143-W241 AromaticContact CZ-CZ2 3.37Å; F143-W241 HydrophobicContact CZ-CZ2 3.37Å
144Y95.3Very high94.1Very high20 Ų2035.6 Ų35.68%0.07817%0.169CC..Hα-helixtrans-63-41.1-179.4-56.9-46.2000112.8G139 N140 E141 L146 F147 F148 W167 S211 I215G139-Y144 PolarHBondContact O-OH 3.44Å; N140-Y144 WeakPolarHBondContact O-CD2 3.31Å; N140-Y144 PolarHBondContact O-N 2.69Å; E141-Y144 PolarHBondContact O-N 2.99Å; E141-Y144 VanDerWaalsContact O-N 3.15Å; Y144-L146 PolarHBondContact O-N 2.93Å; Y144-F147 PolarHBondContact O-N 2.93Å; Y144-F148 AromaticContact CD1-CE2 3.73Å; Y144-F148 HydrophobicContact CD1-CE2 3.73Å; Y144-F148 HydrophobicContact CD1-CZ 4.22Å; Y144-F148 HydrophobicContact CG-CE2 4.04Å; Y144-F148 WeakPolarHBondContact O-CD2 3.22Å; Y144-F148 PolarHBondContact O-N 3.09Å; Y144-W167 AromaticContact CD1-NE1 3.58Å; Y144-W167 AromaticContact CD2-CZ2 3.69Å; Y144-W167 HydrophobicContact CD2-CZ2 3.69Å; Y144-W167 AromaticContact CD2-NE1 3.92Å; Y144-W167 AromaticContact CE1-CD1 3.79Å; Y144-W167 AromaticContact CE1-NE1 3.23Å; Y144-W167 AromaticContact CE2-CZ2 3.93Å; Y144-W167 HydrophobicContact CE2-CZ2 3.93Å; Y144-W167 AromaticContact CE2-NE1 3.59Å; Y144-W167 HydrophobicContact CG-CZ2 4.02Å; Y144-W167 AromaticContact CG-NE1 3.93Å; Y144-W167 AromaticContact CZ-NE1 3.23Å; Y144-S211 VanDerWaalsContact OH-CB 3.22Å; Y144-S211 WeakPolarHBondContact OH-CB 3.44Å; Y144-S211 PolarHBondContact OH-OG 3.3Å; Y144-I215 HydrophobicContact CD1-CD1 4.34Å; Y144-I215 HydrophobicContact CE1-CD1 3.78Å
145I92Very high94Very high23 Ų2333.4 Ų33.412%0.11816%0.163CC..Hα-helixtrans-63.4-26.4177.3-74.1179000112.3E141 F143 P149 M373 Y420E141-I145 HydrophobicContact CG-CD1 3.73Å; E141-I145 HydrophobicContact CG-CG1 4.3Å; E141-I145 WeakPolarHBondContact O-CG1 3.29Å; E141-I145 PolarHBondContact O-N 2.9Å; E141-I145 WeakPolarHBondContact OE1-CD1 3.44Å; F143-I145 PolarHBondContact O-N 2.96Å; I145-P149 VanDerWaalsContact O-CD 3.24Å; I145-P149 WeakPolarHBondContact O-CD 3.32Å; I145-P149 WeakPolarHBondContact O-CG 3.35Å; I145-M373 HydrophobicContact CG2-CE 3.4Å; I145-M373 HydrophobicContact CG2-SD 4.42Å; I145-Y420 HydrophobicContact CD1-CE1 4.5Å
146L94.7Very high93.9Very high76 Ų7633.6 Ų33.640%0.39816%0.164SC..Hα-helixtrans-94.1-42176.5-67.9172.6000112.1L142 F143 Y144 F150 M373L142-L146 HydrophobicContact CD1-CD1 4.34Å; L142-L146 HydrophobicContact CG-CD1 4.31Å; L142-L146 WeakPolarHBondContact O-CG 3.42Å; L142-L146 PolarHBondContact O-N 3.42Å; F143-L146 PolarHBondContact O-N 3.31Å; F143-L146 VanDerWaalsContact O-N 3.16Å; Y144-L146 PolarHBondContact O-N 2.93Å; L146-F150 WeakPolarHBondContact O-CB 3.15Å; L146-F150 PolarHBondContact O-N 3.46Å; L146-M373 HydrophobicContact CD2-CE 4.07Å; L146-M373 HydrophobicContact CD2-CG 4.07Å; L146-M373 HydrophobicContact CD2-SD 3.97Å
147F97.1Very high94Very high21 Ų2135 Ų359%0.09217%0.173CC..Hα-helixtrans-69.4-52.2-171.1178.9-97.6000112.6F143 Y144 F150 W151 L163 I215 M219 W241F143-F147 HydrophobicContact CD1-CB 4.44Å; F143-F147 HydrophobicContact CD2-CB 4.09Å; F143-F147 HydrophobicContact CE1-CB 4.04Å; F143-F147 HydrophobicContact CE1-CD1 4.22Å; F143-F147 HydrophobicContact CE1-CD2 4.43Å; F143-F147 AromaticContact CE1-CG 3.99Å; F143-F147 HydrophobicContact CE1-CG 3.99Å; F143-F147 HydrophobicContact CE2-CB 3.66Å; F143-F147 AromaticContact CE2-CD2 3.54Å; F143-F147 HydrophobicContact CE2-CD2 3.54Å; F143-F147 HydrophobicContact CE2-CE2 4.33Å; F143-F147 AromaticContact CE2-CG 3.73Å; F143-F147 HydrophobicContact CE2-CG 3.73Å; F143-F147 HydrophobicContact CG-CB 4.46Å; F143-F147 HydrophobicContact CZ-CB 3.61Å; F143-F147 AromaticContact CZ-CD1 3.87Å; F143-F147 HydrophobicContact CZ-CD1 3.87Å; F143-F147 AromaticContact CZ-CD2 3.37Å; F143-F147 HydrophobicContact CZ-CD2 3.37Å; F143-F147 HydrophobicContact CZ-CE1 4.37Å; F143-F147 AromaticContact CZ-CE2 3.91Å; F143-F147 HydrophobicContact CZ-CE2 3.91Å; F143-F147 AromaticContact CZ-CG 3.33Å; F143-F147 HydrophobicContact CZ-CG 3.33Å; F143-F147 HydrophobicContact CZ-CZ 4.37Å; F143-F147 WeakPolarHBondContact O-CB 3.49Å; F143-F147 PolarHBondContact O-N 3.23Å; Y144-F147 PolarHBondContact O-N 2.93Å; F147-F150 WeakPolarHBondContact O-CB 3.42Å; F147-F150 PolarHBondContact O-N 2.92Å; F147-W151 AromaticContact CD1-CD1 3.91Å; F147-W151 AromaticContact CD2-CD1 3.98Å; F147-W151 AromaticContact CD2-NE1 3.9Å; F147-W151 AromaticContact CE1-CD1 3.57Å; F147-W151 AromaticContact CE1-NE1 3.65Å; F147-W151 AromaticContact CE2-CD1 3.66Å; F147-W151 AromaticContact CE2-NE1 3.17Å; F147-W151 AromaticContact CZ-CD1 3.45Å; F147-W151 VanDerWaalsContact CZ-CD1 3.45Å; F147-W151 AromaticContact CZ-NE1 3.01Å; F147-W151 VanDerWaalsContact O-CD1 3.3Å; F147-W151 PolarHBondContact O-N 2.93Å; F147-L163 HydrophobicContact CE1-CD1 4.3Å; F147-I215 HydrophobicContact CE1-CG2 3.68Å; F147-I215 HydrophobicContact CZ-CG2 3.59Å; F147-M219 HydrophobicContact CE2-CE 4.27Å; F147-M219 HydrophobicContact CE2-SD 4.2Å; F147-M219 HydrophobicContact CZ-CE 4.14Å; F147-M219 HydrophobicContact CZ-CG 4.26Å; F147-M219 HydrophobicContact CZ-SD 3.63Å; F147-W241 HydrophobicContact CD2-CH2 4.42Å; F147-W241 AromaticContact CE2-CH2 3.94Å; F147-W241 HydrophobicContact CE2-CH2 3.94Å
148F97.3Very high94Very high8 Ų832 Ų324%0.03516%0.16CC..Hα-helixtrans-65.4-44.6-177.7-63-59.9000112.4Y144 F150 W151 I152 L163 V164 W167 I215Y144-F148 AromaticContact CD1-CE2 3.73Å; Y144-F148 HydrophobicContact CD1-CE2 3.73Å; Y144-F148 HydrophobicContact CD1-CZ 4.22Å; Y144-F148 HydrophobicContact CG-CE2 4.04Å; Y144-F148 WeakPolarHBondContact O-CD2 3.22Å; Y144-F148 PolarHBondContact O-N 3.09Å; F148-F150 VanDerWaalsContact C-N 3.3Å; F148-F150 PolarHBondContact O-N 3.12Å; F148-W151 PolarHBondContact O-N 2.88Å; F148-I152 VanDerWaalsContact O-CG1 3.31Å; F148-I152 WeakPolarHBondContact O-CG1 3.28Å; F148-I152 PolarHBondContact O-N 3.42Å; F148-L163 HydrophobicContact CD1-CB 4.45Å; F148-L163 HydrophobicContact CE1-CB 4.12Å; F148-V164 HydrophobicContact CB-CG2 3.97Å; F148-V164 HydrophobicContact CD1-CG2 3.47Å; F148-V164 VanDerWaalsContact CD1-CG2 3.47Å; F148-V164 HydrophobicContact CD2-CG2 4.17Å; F148-V164 HydrophobicContact CE1-CG2 3.93Å; F148-V164 HydrophobicContact CG-CG2 3.62Å; F148-V164 HydrophobicContact CZ-CG2 4.46Å; F148-W167 HydrophobicContact CE1-CB 4.33Å; F148-W167 HydrophobicContact CE2-CB 4.46Å; F148-W167 AromaticContact CE2-CD2 3.79Å; F148-W167 HydrophobicContact CE2-CD2 3.79Å; F148-W167 HydrophobicContact CE2-CE3 4.11Å; F148-W167 AromaticContact CE2-CG 3.94Å; F148-W167 HydrophobicContact CE2-CG 3.94Å; F148-W167 HydrophobicContact CZ-CB 3.64Å; F148-W167 AromaticContact CZ-CD1 3.88Å; F148-W167 AromaticContact CZ-CD2 3.86Å; F148-W167 HydrophobicContact CZ-CD2 3.86Å; F148-W167 HydrophobicContact CZ-CE3 4.39Å; F148-W167 AromaticContact CZ-CG 3.5Å; F148-W167 HydrophobicContact CZ-CG 3.5Å; F148-W167 VanDerWaalsContact CZ-CG 3.5Å; F148-I215 HydrophobicContact CZ-CD1 4.49Å
149P96.8Very high94.1Very high1 Ų131.2 Ų31.21%0.00616%0.156CC..Hα-helixtrans-62.4-36.7173.5-27.740.6000113.1I145 W151 I152 W153 I427I145-P149 VanDerWaalsContact O-CD 3.24Å; I145-P149 WeakPolarHBondContact O-CD 3.32Å; I145-P149 WeakPolarHBondContact O-CG 3.35Å; P149-W151 VanDerWaalsContact C-N 3.33Å; P149-W151 PolarHBondContact O-N 2.86Å; P149-I152 PolarHBondContact O-N 3.43Å; P149-W153 HydrophobicContact CB-CD2 3.83Å; P149-W153 HydrophobicContact CB-CE3 3.74Å; P149-W153 HydrophobicContact CB-CH2 3.51Å; P149-W153 HydrophobicContact CB-CZ2 3.61Å; P149-W153 HydrophobicContact CB-CZ3 3.58Å; P149-W153 HydrophobicContact CG-CH2 4.32Å; P149-W153 HydrophobicContact CG-CZ2 4.4Å; P149-W153 VanDerWaalsContact O-CB 3.24Å; P149-W153 WeakPolarHBondContact O-CB 3.43Å; P149-W153 PolarHBondContact O-N 3.31Å; P149-I427 HydrophobicContact CB-CG2 4.05Å; P149-I427 HydrophobicContact CG-CD1 3.7Å; P149-I427 HydrophobicContact CG-CG1 3.86Å; P149-I427 HydrophobicContact CG-CG2 3.82Å
150F96.8Very high94.4Very high83 Ų8331 Ų3136%0.36415%0.154SC..Hα-helixtrans-59.3-44.7174.6180-96000112.3L146 F147 F148 N154 L155 I369L146-F150 WeakPolarHBondContact O-CB 3.15Å; L146-F150 PolarHBondContact O-N 3.46Å; F147-F150 WeakPolarHBondContact O-CB 3.42Å; F147-F150 PolarHBondContact O-N 2.92Å; F148-F150 VanDerWaalsContact C-N 3.3Å; F148-F150 PolarHBondContact O-N 3.12Å; F150-N154 HydrophobicContact CD2-CB 4.33Å; F150-N154 WeakPolarHBondContact CD2-ND2 3.21Å; F150-N154 HydrophobicContact CE2-CB 4.16Å; F150-N154 HydrophobicContact CZ-CB 4.49Å; F150-N154 WeakPolarHBondContact O-CB 3.44Å; F150-N154 PolarHBondContact O-N 3.29Å; F150-L155 HydrophobicContact CD1-CD1 4.07Å; F150-L155 HydrophobicContact CD1-CG 4.36Å; F150-L155 HydrophobicContact CE1-CD1 3.67Å; F150-L155 HydrophobicContact CE1-CD2 4.33Å; F150-L155 HydrophobicContact CE1-CG 3.9Å; F150-I369 HydrophobicContact CB-CD1 3.92Å; F150-I369 HydrophobicContact CD2-CD1 3.84Å; F150-I369 HydrophobicContact CD2-CG1 4.05Å; F150-I369 HydrophobicContact CG-CD1 4.4Å
151W96Very high94.6Very high26 Ų2631 Ų3110%0.09815%0.153CC..Iπ-helixtrans-59.9-47.3173.6-87.194.6000112.4F147 F148 P149 L155 D156 V159 L163 M219 T223F147-W151 AromaticContact CD1-CD1 3.91Å; F147-W151 AromaticContact CD2-CD1 3.98Å; F147-W151 AromaticContact CD2-NE1 3.9Å; F147-W151 AromaticContact CE1-CD1 3.57Å; F147-W151 AromaticContact CE1-NE1 3.65Å; F147-W151 AromaticContact CE2-CD1 3.66Å; F147-W151 AromaticContact CE2-NE1 3.17Å; F147-W151 AromaticContact CZ-CD1 3.45Å; F147-W151 VanDerWaalsContact CZ-CD1 3.45Å; F147-W151 AromaticContact CZ-NE1 3.01Å; F147-W151 VanDerWaalsContact O-CD1 3.3Å; F147-W151 PolarHBondContact O-N 2.93Å; F148-W151 PolarHBondContact O-N 2.88Å; P149-W151 VanDerWaalsContact C-N 3.33Å; P149-W151 PolarHBondContact O-N 2.86Å; W151-L155 HydrophobicContact CD2-CB 4.42Å; W151-L155 HydrophobicContact CD2-CD1 3.69Å; W151-L155 HydrophobicContact CE3-CB 3.81Å; W151-L155 HydrophobicContact CE3-CD1 3.69Å; W151-L155 HydrophobicContact CE3-CG 4.41Å; W151-L155 HydrophobicContact CG-CD1 4.35Å; W151-L155 HydrophobicContact CH2-CD1 3.84Å; W151-L155 HydrophobicContact CZ2-CD1 3.81Å; W151-L155 HydrophobicContact CZ3-CB 4.08Å; W151-L155 HydrophobicContact CZ3-CD1 3.78Å; W151-L155 PolarHBondContact O-N 3.27Å; W151-D156 CarbonylContact O-C 3.49Å; W151-D156 PolarHBondContact O-N 2.88Å; W151-V159 HydrophobicContact CE3-CB 4.1Å; W151-V159 HydrophobicContact CE3-CG1 3.75Å; W151-V159 HydrophobicContact CH2-CG1 4.36Å; W151-V159 HydrophobicContact CZ3-CB 4.12Å; W151-V159 HydrophobicContact CZ3-CG1 3.62Å; W151-L163 HydrophobicContact CD2-CD1 4.06Å; W151-L163 HydrophobicContact CG-CD1 4.21Å; W151-M219 HydrophobicContact CH2-CE 4.47Å; W151-M219 HydrophobicContact CZ2-CE 3.48Å; W151-M219 VanDerWaalsContact CZ2-CE 3.48Å; W151-M219 HydrophobicContact CZ2-CG 4.19Å; W151-T223 HydrophobicContact CH2-CG2 3.93Å; W151-T223 HydrophobicContact CZ3-CG2 3.97Å
152I95.6Very high95Very high14 Ų1429.5 Ų29.57%0.07214%0.144CC..Iπ-helixtrans-69.6-38.3-175.7-65.9163.5000112F148 P149 P157 I427 T428F148-I152 VanDerWaalsContact O-CG1 3.31Å; F148-I152 WeakPolarHBondContact O-CG1 3.28Å; F148-I152 PolarHBondContact O-N 3.42Å; P149-I152 PolarHBondContact O-N 3.43Å; I152-P157 WeakPolarHBondContact O-CG 3.27Å; I152-I427 HydrophobicContact CD1-CG2 3.82Å; I152-T428 HydrophobicContact CD1-CG2 3.91Å; I152-T428 HydrophobicContact CG2-CG2 4.47Å
153W95.2Very high95.4Very high11 Ų1124.4 Ų24.44%0.04212%0.117CC..Iπ-helixtrans-91.6-24.8-172.2-58.9-21.9000114.2P149 R368 I369 G372 M373 V376 I427 V431 F435P149-W153 HydrophobicContact CB-CD2 3.83Å; P149-W153 HydrophobicContact CB-CE3 3.74Å; P149-W153 HydrophobicContact CB-CH2 3.51Å; P149-W153 HydrophobicContact CB-CZ2 3.61Å; P149-W153 HydrophobicContact CB-CZ3 3.58Å; P149-W153 HydrophobicContact CG-CH2 4.32Å; P149-W153 HydrophobicContact CG-CZ2 4.4Å; P149-W153 VanDerWaalsContact O-CB 3.24Å; P149-W153 WeakPolarHBondContact O-CB 3.43Å; P149-W153 PolarHBondContact O-N 3.31Å; W153-R368 WeakPolarHBondContact O-CD 3.07Å; W153-R368 PolarHBondContact O-NH1 3.34Å; W153-R368 VanDerWaalsContact O-NH1 3.16Å; W153-I369 HydrophobicContact CE3-CD1 3.81Å; W153-I369 HydrophobicContact CZ3-CD1 4.15Å; W153-G372 VanDerWaalsContact CH2-C 3.47Å; W153-M373 HydrophobicContact CH2-SD 4.24Å; W153-M373 HydrophobicContact CZ3-CG 4.41Å; W153-M373 HydrophobicContact CZ3-SD 4.22Å; W153-V376 HydrophobicContact CH2-CG2 4.2Å; W153-V376 HydrophobicContact CZ2-CG2 4.35Å; W153-I427 HydrophobicContact CZ2-CB 4.36Å; W153-I427 HydrophobicContact CZ2-CG1 4.14Å; W153-I427 HydrophobicContact CZ2-CG2 4.23Å; W153-I427 PolarHBondContact NE1-O 3.37Å; W153-V431 HydrophobicContact CD2-CG1 4.21Å; W153-V431 HydrophobicContact CH2-CG1 4.13Å; W153-V431 HydrophobicContact CZ2-CB 3.91Å; W153-V431 HydrophobicContact CZ2-CG1 3.51Å; W153-V431 HydrophobicContact CZ2-CG2 4.09Å; W153-F435 HydrophobicContact CB-CE2 3.85Å; W153-F435 AromaticContact CD1-CE2 3.89Å; W153-F435 AromaticContact CD2-CE2 3.9Å; W153-F435 HydrophobicContact CD2-CE2 3.9Å; W153-F435 HydrophobicContact CD2-CZ 4.12Å; W153-F435 HydrophobicContact CE3-CE2 4.44Å; W153-F435 HydrophobicContact CE3-CZ 4.27Å; W153-F435 AromaticContact CG-CE2 3.61Å; W153-F435 HydrophobicContact CG-CE2 3.61Å; W153-F435 HydrophobicContact CG-CZ 4.3Å
154N93.9Very high95.6Very high28 Ų2823.3 Ų23.315%0.1511%0.113CC..Iπ-helixtrans-123.7-24.6-169.6-60.7-63.8000115.1F150 A365 R368 I369F150-N154 HydrophobicContact CD2-CB 4.33Å; F150-N154 WeakPolarHBondContact CD2-ND2 3.21Å; F150-N154 HydrophobicContact CE2-CB 4.16Å; F150-N154 HydrophobicContact CZ-CB 4.49Å; F150-N154 WeakPolarHBondContact O-CB 3.44Å; F150-N154 PolarHBondContact O-N 3.29Å; N154-A365 HydrophobicContact CB-CB 4.4Å; N154-A365 WeakPolarHBondContact OD1-CA 3.23Å; N154-A365 WeakPolarHBondContact OD1-CB 3.48Å; N154-R368 WeakPolarHBondContact OD1-CD 3.23Å; N154-I369 WeakPolarHBondContact ND2-CG1 3.32Å
155L92.5Very high95.7Very high73 Ų7323.7 Ų23.738%0.38212%0.117SC..Iπ-helixtrans-111.6-73.7-173.3-62.6-176.9000111.4F150 W151F150-L155 HydrophobicContact CD1-CD1 4.07Å; F150-L155 HydrophobicContact CD1-CG 4.36Å; F150-L155 HydrophobicContact CE1-CD1 3.67Å; F150-L155 HydrophobicContact CE1-CD2 4.33Å; F150-L155 HydrophobicContact CE1-CG 3.9Å; W151-L155 HydrophobicContact CD2-CB 4.42Å; W151-L155 HydrophobicContact CD2-CD1 3.69Å; W151-L155 HydrophobicContact CE3-CB 3.81Å; W151-L155 HydrophobicContact CE3-CD1 3.69Å; W151-L155 HydrophobicContact CE3-CG 4.41Å; W151-L155 HydrophobicContact CG-CD1 4.35Å; W151-L155 HydrophobicContact CH2-CD1 3.84Å; W151-L155 HydrophobicContact CZ2-CD1 3.81Å; W151-L155 HydrophobicContact CZ3-CB 4.08Å; W151-L155 HydrophobicContact CZ3-CD1 3.78Å; W151-L155 PolarHBondContact O-N 3.27Å
156D93.4Very high96Very high5 Ų522.9 Ų22.93%0.02711%0.113CC..  trans-159.9102.4-169-166.9-30.8000109.6W151 L158 V159 G160 R226 W227W151-D156 CarbonylContact O-C 3.49Å; W151-D156 PolarHBondContact O-N 2.88Å; D156-L158 PolarHBondContact O-N 3.38Å; D156-L158 WeakPolarHBondContact OD1-CB 3.35Å; D156-L158 PolarHBondContact OD1-N 3.32Å; D156-L158 VanDerWaalsContact OD1-N 3.14Å; D156-V159 HydrophobicContact CB-CB 3.99Å; D156-V159 HydrophobicContact CB-CG2 3.94Å; D156-V159 PolarHBondContact O-N 3.02Å; D156-V159 PolarHBondContact OD1-N 2.94Å; D156-V159 WeakPolarHBondContact OD2-CG2 3.43Å; D156-G160 PolarHBondContact O-N 3.44Å; D156-R226 IonicContact OD1-CZ 3.73Å; D156-R226 IonicContact OD1-NE 3.31Å; D156-R226 IonicContact OD1-NH2 3.76Å; D156-R226 PolarHBondContact OD1-NH2 3.33Å; D156-R226 IonicContact OD2-CZ 3.42Å; D156-R226 IonicContact OD2-NE 3.34Å; D156-R226 PolarHBondContact OD2-NE 2.7Å; D156-R226 IonicContact OD2-NH2 3.27Å; D156-R226 PolarHBondContact OD2-NH2 3.31Å; D156-W227 HydrophobicContact CB-CZ2 4.24Å; D156-W227 PolarHBondContact OD2-NE1 3.31Å
157P93.6Very high96.2Very high34 Ų3420.1 Ų20.122%0.22110%0.097CC..Hα-helixtrans-54.2-37.3178.8-25.131.7000113.3I152 G160 R161 V342I152-P157 WeakPolarHBondContact O-CG 3.27Å; P157-G160 PolarHBondContact O-N 2.91Å; P157-R161 VanDerWaalsContact C-NH1 3.25Å; P157-R161 VanDerWaalsContact O-CG 3.29Å; P157-R161 WeakPolarHBondContact O-CG 3.36Å; P157-R161 PolarHBondContact O-N 2.84Å; P157-R161 PolarHBondContact O-NH1 3.39Å; P157-V342 HydrophobicContact CB-CG1 3.86Å; P157-V342 HydrophobicContact CG-CG1 3.81Å
158L94.1Very high96.2Very high14 Ų1419.7 Ų19.77%0.07310%0.096CC..Hα-helixtrans-66-47.7-180175.4153.6000111.6D156 G160 R161 R162 D344D156-L158 PolarHBondContact O-N 3.38Å; D156-L158 WeakPolarHBondContact OD1-CB 3.35Å; D156-L158 PolarHBondContact OD1-N 3.32Å; D156-L158 VanDerWaalsContact OD1-N 3.14Å; L158-G160 VanDerWaalsContact C-N 3.31Å; L158-G160 PolarHBondContact O-N 3.36Å; L158-R161 PolarHBondContact O-N 3.45Å; L158-R162 WeakPolarHBondContact O-CB 3.06Å; L158-R162 WeakPolarHBondContact O-CG 3.24Å; L158-R162 PolarHBondContact O-N 3.43Å; L158-R162 VanDerWaalsContact O-N 3.12Å; L158-D344 WeakPolarHBondContact CB-OD1 3.34Å
159V96.1Very high96.2Very high0 Ų021.3 Ų21.30%011%0.105CC..Hα-helixtrans-63.4-42.8176.6177.30000109.7W151 D156 R161 R162 L163 L222 T223W151-V159 HydrophobicContact CE3-CB 4.1Å; W151-V159 HydrophobicContact CE3-CG1 3.75Å; W151-V159 HydrophobicContact CH2-CG1 4.36Å; W151-V159 HydrophobicContact CZ3-CB 4.12Å; W151-V159 HydrophobicContact CZ3-CG1 3.62Å; D156-V159 HydrophobicContact CB-CB 3.99Å; D156-V159 HydrophobicContact CB-CG2 3.94Å; D156-V159 PolarHBondContact O-N 3.02Å; D156-V159 PolarHBondContact OD1-N 2.94Å; D156-V159 WeakPolarHBondContact OD2-CG2 3.43Å; V159-R161 PolarHBondContact O-N 2.9Å; V159-R162 PolarHBondContact O-N 2.92Å; V159-L163 HydrophobicContact CG1-CD1 3.83Å; V159-L163 HydrophobicContact CG1-CG 4.13Å; V159-L163 WeakPolarHBondContact O-CB 3.41Å; V159-L163 VanDerWaalsContact O-CG 3.25Å; V159-L163 WeakPolarHBondContact O-CG 3.31Å; V159-L163 PolarHBondContact O-N 2.94Å; V159-L222 HydrophobicContact CG1-CB 4.04Å; V159-L222 HydrophobicContact CG1-CD1 4.41Å; V159-L222 HydrophobicContact CG2-CB 4.42Å; V159-T223 HydrophobicContact CG1-CG2 3.86Å; V159-T223 HydrophobicContact CG2-CG2 4Å
160G96.6Very high96.3Very high0 Ų021.3 Ų21.30%011%0.105CC..Hα-helixtrans-57.1-49.3177.700000113.5D156 P157 L158 L163 V164D156-G160 PolarHBondContact O-N 3.44Å; P157-G160 PolarHBondContact O-N 2.91Å; L158-G160 VanDerWaalsContact C-N 3.31Å; L158-G160 PolarHBondContact O-N 3.36Å; G160-L163 PolarHBondContact O-N 3.42Å; G160-V164 WeakPolarHBondContact O-CG2 3.37Å; G160-V164 PolarHBondContact O-N 3.03Å; G160-V164 VanDerWaalsContact O-N 3.13Å
161R95.9Very high96.3Very high14 Ų1418 Ų185%0.0539%0.091CC..Hα-helixtrans-62.8-45.5177.9-68.5-177-49.4-93.65.9112.2P157 L158 V159 L163 V164 V165 D282 S333 D344P157-R161 VanDerWaalsContact C-NH1 3.25Å; P157-R161 VanDerWaalsContact O-CG 3.29Å; P157-R161 WeakPolarHBondContact O-CG 3.36Å; P157-R161 PolarHBondContact O-N 2.84Å; P157-R161 PolarHBondContact O-NH1 3.39Å; L158-R161 PolarHBondContact O-N 3.45Å; V159-R161 PolarHBondContact O-N 2.9Å; R161-L163 PolarHBondContact O-N 3.21Å; R161-V164 WeakPolarHBondContact O-CB 3.38Å; R161-V164 PolarHBondContact O-N 3.35Å; R161-V164 VanDerWaalsContact O-N 3.17Å; R161-V165 PolarHBondContact O-N 3.47Å; R161-D282 WeakPolarHBondContact CB-OD1 3.45Å; R161-D282 IonicContact NE-OD1 3.9Å; R161-D282 PolarHBondContact NE-OD1 2.94Å; R161-D282 IonicContact NE-OD2 3.24Å; R161-D282 IonicContact NH2-OD2 2.81Å; R161-S333 VanDerWaalsContact CD-CB 3.45Å; R161-S333 WeakPolarHBondContact CD-OG 3.23Å; R161-S333 WeakPolarHBondContact CG-OG 3.16Å; R161-D344 IonicContact NH2-OD1 3.65Å; R161-D344 IonicContact NH2-OD2 2.81Å; R161-D344 PolarHBondContact NH2-OD2 3.31Å
162R97.6Very high96.3Very high31 Ų3117.4 Ų17.412%0.1179%0.089CC..Hα-helixtrans-65.9-37.1179.5-70-179.1-175-166.7-3.9112.3L158 V159 V164 V165 I166 L222 V278 D279 D282L158-R162 WeakPolarHBondContact O-CB 3.06Å; L158-R162 WeakPolarHBondContact O-CG 3.24Å; L158-R162 PolarHBondContact O-N 3.43Å; L158-R162 VanDerWaalsContact O-N 3.12Å; V159-R162 PolarHBondContact O-N 2.92Å; R162-V164 VanDerWaalsContact C-N 3.32Å; R162-V164 PolarHBondContact O-N 2.68Å; R162-V165 PolarHBondContact O-N 3.49Å; R162-I166 WeakPolarHBondContact O-CG1 3.15Å; R162-I166 PolarHBondContact O-N 3.19Å; R162-I166 VanDerWaalsContact O-N 3.13Å; R162-L222 HydrophobicContact CB-CD1 3.76Å; R162-L222 HydrophobicContact CB-CD2 4.04Å; R162-V278 HydrophobicContact CB-CG1 3.64Å; R162-V278 HydrophobicContact CG-CG1 3.77Å; R162-D279 IonicContact CZ-OD1 3.29Å; R162-D279 IonicContact CZ-OD2 3.73Å; R162-D279 IonicContact NE-OD1 3.1Å; R162-D279 IonicContact NH1-OD1 3.14Å; R162-D279 PolarHBondContact NH1-OD1 3Å; R162-D279 IonicContact NH1-OD2 3.26Å; R162-D279 PolarHBondContact NH1-OD2 3.18Å; R162-D279 IonicContact NH2-OD1 2.71Å; R162-D279 IonicContact NH2-OD2 3.62Å; R162-D279 PolarHBondContact NH2-OD2 2.9Å; R162-D282 HydrophobicContact CG-CB 3.99Å; R162-D282 IonicContact NE-OD2 3.57Å
163L98.2Very high96.4Very high4 Ų418.6 Ų18.62%0.02110%0.095CC..Hα-helixtrans-60.2-41.6171.7-78.7173.2000111.7F147 F148 W151 V159 G160 R161 I166 W167 M219 L222F147-L163 HydrophobicContact CE1-CD1 4.3Å; F148-L163 HydrophobicContact CD1-CB 4.45Å; F148-L163 HydrophobicContact CE1-CB 4.12Å; W151-L163 HydrophobicContact CD2-CD1 4.06Å; W151-L163 HydrophobicContact CG-CD1 4.21Å; V159-L163 HydrophobicContact CG1-CD1 3.83Å; V159-L163 HydrophobicContact CG1-CG 4.13Å; V159-L163 WeakPolarHBondContact O-CB 3.41Å; V159-L163 VanDerWaalsContact O-CG 3.25Å; V159-L163 WeakPolarHBondContact O-CG 3.31Å; V159-L163 PolarHBondContact O-N 2.94Å; G160-L163 PolarHBondContact O-N 3.42Å; R161-L163 PolarHBondContact O-N 3.21Å; L163-I166 PolarHBondContact O-N 2.89Å; L163-W167 WeakPolarHBondContact O-CB 3.14Å; L163-W167 PolarHBondContact O-N 3.19Å; L163-M219 HydrophobicContact CD1-CG 3.97Å; L163-M219 HydrophobicContact CD2-CG 3.96Å; L163-L222 HydrophobicContact CD2-CD1 3.99Å; L163-L222 HydrophobicContact CG-CD1 3.95Å
164V98.2Very high96.4Very high3 Ų318 Ų182%0.0189%0.093CC..Hα-helixtrans-64.6-43.5176.61730000111F148 G160 R161 R162 I166 W167 V168 I329F148-V164 HydrophobicContact CB-CG2 3.97Å; F148-V164 HydrophobicContact CD1-CG2 3.47Å; F148-V164 VanDerWaalsContact CD1-CG2 3.47Å; F148-V164 HydrophobicContact CD2-CG2 4.17Å; F148-V164 HydrophobicContact CE1-CG2 3.93Å; F148-V164 HydrophobicContact CG-CG2 3.62Å; F148-V164 HydrophobicContact CZ-CG2 4.46Å; G160-V164 WeakPolarHBondContact O-CG2 3.37Å; G160-V164 PolarHBondContact O-N 3.03Å; G160-V164 VanDerWaalsContact O-N 3.13Å; R161-V164 WeakPolarHBondContact O-CB 3.38Å; R161-V164 PolarHBondContact O-N 3.35Å; R161-V164 VanDerWaalsContact O-N 3.17Å; R162-V164 VanDerWaalsContact C-N 3.32Å; R162-V164 PolarHBondContact O-N 2.68Å; V164-I166 VanDerWaalsContact C-N 3.31Å; V164-I166 PolarHBondContact O-N 2.91Å; V164-W167 PolarHBondContact O-N 2.92Å; V164-V168 HydrophobicContact CG1-CG2 4.05Å; V164-V168 VanDerWaalsContact O-CG2 3.3Å; V164-V168 WeakPolarHBondContact O-CG2 3.24Å; V164-V168 PolarHBondContact O-N 3.37Å; V164-I329 HydrophobicContact CB-CD1 4.35Å; V164-I329 HydrophobicContact CB-CG2 4.24Å; V164-I329 HydrophobicContact CG1-CB 4.23Å; V164-I329 HydrophobicContact CG1-CD1 3.72Å; V164-I329 HydrophobicContact CG1-CG2 3.99Å; V164-I329 HydrophobicContact CG2-CD1 3.79Å; V164-I329 HydrophobicContact CG2-CG2 4.32Å
165V98.1Very high96.3Very high28 Ų2816.8 Ų16.817%0.179%0.086CC..Hα-helixtrans-55.2-48.1176.4170.50000110.9R161 R162 L169 I281R161-V165 PolarHBondContact O-N 3.47Å; R162-V165 PolarHBondContact O-N 3.49Å; V165-L169 WeakPolarHBondContact O-CB 3.49Å; V165-L169 PolarHBondContact O-N 2.95Å; V165-L169 VanDerWaalsContact O-N 3.15Å; V165-I281 HydrophobicContact CG1-CB 4.35Å; V165-I281 HydrophobicContact CG1-CD1 4.27Å; V165-I281 HydrophobicContact CG1-CG2 3.87Å; V165-I281 HydrophobicContact CG2-CG2 4.23Å
166I98.5Very high96.3Very high7 Ų713.7 Ų13.74%0.0367%0.07CC..Hα-helixtrans-64.7-44.7178.3-64.7168.4000110.9R162 L163 V164 L169 V170 A214 S218 L222 L271 Y275 V278R162-I166 WeakPolarHBondContact O-CG1 3.15Å; R162-I166 PolarHBondContact O-N 3.19Å; R162-I166 VanDerWaalsContact O-N 3.13Å; L163-I166 PolarHBondContact O-N 2.89Å; V164-I166 VanDerWaalsContact C-N 3.31Å; V164-I166 PolarHBondContact O-N 2.91Å; I166-L169 PolarHBondContact O-N 3.42Å; I166-V170 HydrophobicContact CG2-CG2 4.12Å; I166-V170 WeakPolarHBondContact O-CB 3.33Å; I166-V170 VanDerWaalsContact O-CG2 3.28Å; I166-V170 WeakPolarHBondContact O-CG2 3.5Å; I166-V170 PolarHBondContact O-N 3.31Å; I166-A214 HydrophobicContact CG2-CB 4.47Å; I166-S218 WeakPolarHBondContact CD1-OG 3.31Å; I166-S218 WeakPolarHBondContact CG2-OG 3.31Å; I166-L222 HydrophobicContact CD1-CD1 4.21Å; I166-L271 HydrophobicContact CG2-CD2 3.55Å; I166-Y275 HydrophobicContact CD1-CD2 4.1Å; I166-V278 HydrophobicContact CD1-CG1 4.38Å; I166-V278 HydrophobicContact CD1-CG2 3.92Å; I166-V278 HydrophobicContact CG1-CG1 4.35Å; I166-V278 HydrophobicContact CG1-CG2 3.53Å
167W98.4Very high96.3Very high17 Ų1714.7 Ų14.76%0.0648%0.077CC..Hα-helixtrans-60.7-47.2179.1171.782000112.2Y144 F148 L163 V164 L169 V170 M171 I322Y144-W167 AromaticContact CD1-NE1 3.58Å; Y144-W167 AromaticContact CD2-CZ2 3.69Å; Y144-W167 HydrophobicContact CD2-CZ2 3.69Å; Y144-W167 AromaticContact CD2-NE1 3.92Å; Y144-W167 AromaticContact CE1-CD1 3.79Å; Y144-W167 AromaticContact CE1-NE1 3.23Å; Y144-W167 AromaticContact CE2-CZ2 3.93Å; Y144-W167 HydrophobicContact CE2-CZ2 3.93Å; Y144-W167 AromaticContact CE2-NE1 3.59Å; Y144-W167 HydrophobicContact CG-CZ2 4.02Å; Y144-W167 AromaticContact CG-NE1 3.93Å; Y144-W167 AromaticContact CZ-NE1 3.23Å; F148-W167 HydrophobicContact CE1-CB 4.33Å; F148-W167 HydrophobicContact CE2-CB 4.46Å; F148-W167 AromaticContact CE2-CD2 3.79Å; F148-W167 HydrophobicContact CE2-CD2 3.79Å; F148-W167 HydrophobicContact CE2-CE3 4.11Å; F148-W167 AromaticContact CE2-CG 3.94Å; F148-W167 HydrophobicContact CE2-CG 3.94Å; F148-W167 HydrophobicContact CZ-CB 3.64Å; F148-W167 AromaticContact CZ-CD1 3.88Å; F148-W167 AromaticContact CZ-CD2 3.86Å; F148-W167 HydrophobicContact CZ-CD2 3.86Å; F148-W167 HydrophobicContact CZ-CE3 4.39Å; F148-W167 AromaticContact CZ-CG 3.5Å; F148-W167 HydrophobicContact CZ-CG 3.5Å; F148-W167 VanDerWaalsContact CZ-CG 3.5Å; L163-W167 WeakPolarHBondContact O-CB 3.14Å; L163-W167 PolarHBondContact O-N 3.19Å; V164-W167 PolarHBondContact O-N 2.92Å; W167-L169 VanDerWaalsContact C-N 3.32Å; W167-L169 PolarHBondContact O-N 3.34Å; W167-V170 PolarHBondContact O-N 3.27Å; W167-M171 HydrophobicContact CD2-CG 4.27Å; W167-M171 HydrophobicContact CG-CG 4.23Å; W167-M171 HydrophobicContact CZ2-CG 4.37Å; W167-M171 VanDerWaalsContact O-CB 3.27Å; W167-M171 WeakPolarHBondContact O-CB 3.4Å; W167-M171 VanDerWaalsContact O-CG 3.22Å; W167-M171 WeakPolarHBondContact O-CG 3.35Å; W167-M171 PolarHBondContact O-N 2.81Å; W167-I322 HydrophobicContact CH2-CB 4.13Å; W167-I322 HydrophobicContact CH2-CG1 3.79Å; W167-I322 HydrophobicContact CH2-CG2 4.07Å; W167-I322 HydrophobicContact CZ2-CG1 4.04Å; W167-I322 HydrophobicContact CZ3-CB 4.47Å; W167-I322 HydrophobicContact CZ3-CG2 4.01Å
168V98.1Very high96.2Very high12 Ų1213.1 Ų13.17%0.0737%0.067CC..Hα-helixtrans-56.9-48.7177.1170.40000110.1V164 Y172 I322 L323V164-V168 HydrophobicContact CG1-CG2 4.05Å; V164-V168 VanDerWaalsContact O-CG2 3.3Å; V164-V168 WeakPolarHBondContact O-CG2 3.24Å; V164-V168 PolarHBondContact O-N 3.37Å; V168-Y172 WeakPolarHBondContact O-CB 3.32Å; V168-Y172 PolarHBondContact O-N 2.89Å; V168-I322 HydrophobicContact CB-CG2 4.41Å; V168-I322 HydrophobicContact CG1-CG2 4.25Å; V168-I322 HydrophobicContact CG2-CG2 4.42Å; V168-L323 HydrophobicContact CG1-CD2 4.32Å
169L97.6Very high95.9Very high42 Ų4212.5 Ų12.522%0.226%0.063CC..Hα-helixtrans-61.8-50.4-179.6177.371.4000112.1V165 I166 W167 M171 L173 I270 F274V165-L169 WeakPolarHBondContact O-CB 3.49Å; V165-L169 PolarHBondContact O-N 2.95Å; V165-L169 VanDerWaalsContact O-N 3.15Å; I166-L169 PolarHBondContact O-N 3.42Å; W167-L169 VanDerWaalsContact C-N 3.32Å; W167-L169 PolarHBondContact O-N 3.34Å; L169-M171 PolarHBondContact O-N 2.94Å; L169-L173 HydrophobicContact CD1-CD1 3.74Å; L169-L173 HydrophobicContact CD1-CG 4.14Å; L169-L173 HydrophobicContact CG-CD1 4.03Å; L169-L173 WeakPolarHBondContact O-CB 3.47Å; L169-L173 VanDerWaalsContact O-CG 3.31Å; L169-L173 WeakPolarHBondContact O-CG 3.31Å; L169-L173 PolarHBondContact O-N 2.9Å; L169-I270 HydrophobicContact CD2-CG2 3.74Å; L169-I270 HydrophobicContact CG-CG2 4.01Å; L169-F274 HydrophobicContact CD1-CD1 4.36Å; L169-F274 HydrophobicContact CD1-CE1 4.33Å; L169-F274 HydrophobicContact CD1-CE2 4.48Å; L169-F274 HydrophobicContact CD1-CG 4.45Å; L169-F274 HydrophobicContact CD1-CZ 4.38Å; L169-F274 HydrophobicContact CD2-CB 3.21Å; L169-F274 HydrophobicContact CD2-CD1 3.79Å; L169-F274 HydrophobicContact CD2-CD2 3.64Å; L169-F274 HydrophobicContact CD2-CE2 4.38Å; L169-F274 HydrophobicContact CD2-CG 3.29Å; L169-F274 HydrophobicContact CG-CD2 4.48Å; L169-F274 HydrophobicContact CG-CG 4.41Å
170V98.3Very high95.6Very high1 Ų117.7 Ų17.71%0.0069%0.09CC..Hα-helixtrans-61.9-45.7-179168.60000110.7I166 W167 G174 M210 A214 T267 I270I166-V170 HydrophobicContact CG2-CG2 4.12Å; I166-V170 WeakPolarHBondContact O-CB 3.33Å; I166-V170 VanDerWaalsContact O-CG2 3.28Å; I166-V170 WeakPolarHBondContact O-CG2 3.5Å; I166-V170 PolarHBondContact O-N 3.31Å; W167-V170 PolarHBondContact O-N 3.27Å; V170-G174 PolarHBondContact O-N 2.93Å; V170-M210 HydrophobicContact CG1-CB 3.76Å; V170-M210 HydrophobicContact CG1-CE 3.97Å; V170-M210 VanDerWaalsContact O-CE 3.31Å; V170-M210 WeakPolarHBondContact O-CE 3.47Å; V170-A214 HydrophobicContact CB-CB 4.35Å; V170-A214 HydrophobicContact CG1-CB 4.06Å; V170-A214 HydrophobicContact CG2-CB 3.92Å; V170-T267 HydrophobicContact CG1-CG2 4.39Å; V170-T267 HydrophobicContact CG2-CG2 4.49Å; V170-I270 HydrophobicContact CG2-CB 4.45Å; V170-I270 HydrophobicContact CG2-CG2 3.79Å
171M96.8Very high95.4Very high13 Ų1321 Ų216%0.06411%0.107CC..Hα-helixtrans-69.7-44.1-178.9-68.3-63.8-73.700111.7W167 L169 G174 Q175 I322W167-M171 HydrophobicContact CD2-CG 4.27Å; W167-M171 HydrophobicContact CG-CG 4.23Å; W167-M171 HydrophobicContact CZ2-CG 4.37Å; W167-M171 VanDerWaalsContact O-CB 3.27Å; W167-M171 WeakPolarHBondContact O-CB 3.4Å; W167-M171 VanDerWaalsContact O-CG 3.22Å; W167-M171 WeakPolarHBondContact O-CG 3.35Å; W167-M171 PolarHBondContact O-N 2.81Å; L169-M171 PolarHBondContact O-N 2.94Å; M171-G174 PolarHBondContact O-N 2.78Å; M171-Q175 WeakPolarHBondContact O-CG 3.41Å; M171-Q175 PolarHBondContact O-N 2.96Å; M171-I322 HydrophobicContact CB-CD1 3.73Å; M171-I322 HydrophobicContact CB-CG1 4.27Å; M171-I322 HydrophobicContact CB-CG2 4.08Å; M171-I322 HydrophobicContact CE-CD1 4.26Å
172Y96.4Very high95.1Very high15 Ų1526 Ų266%0.05913%0.126CC..Hα-helixtrans-60.6-49.6177.4172.1-101.7000112V168 G174 Q175 C176 L302 F305 T319 L323V168-Y172 WeakPolarHBondContact O-CB 3.32Å; V168-Y172 PolarHBondContact O-N 2.89Å; Y172-G174 VanDerWaalsContact C-N 3.3Å; Y172-G174 PolarHBondContact O-N 3.35Å; Y172-Q175 PolarHBondContact O-N 2.93Å; Y172-C176 VanDerWaalsContact CE2-SG 3.56Å; Y172-C176 PolarHBondContact O-N 2.93Å; Y172-C176 PolarHBondContact O-SG 2.94Å; Y172-L302 HydrophobicContact CE1-CB 4.35Å; Y172-L302 HydrophobicContact CE1-CD1 4.46Å; Y172-L302 HydrophobicContact CE1-CD2 3.85Å; Y172-L302 HydrophobicContact CE1-CG 4.44Å; Y172-L302 HydrophobicContact CE2-CB 3.82Å; Y172-L302 WeakPolarHBondContact CE2-O 3.25Å; Y172-L302 WeakPolarHBondContact OH-CA 3.22Å; Y172-L302 WeakPolarHBondContact OH-CD2 3.05Å; Y172-L302 PolarHBondContact OH-O 3.46Å; Y172-F305 WeakPolarHBondContact OH-CD1 3.49Å; Y172-T319 HydrophobicContact CD2-CG2 3.99Å; Y172-T319 HydrophobicContact CE2-CG2 4.23Å; Y172-L323 HydrophobicContact CD2-CD1 3.93Å; Y172-L323 HydrophobicContact CD2-CD2 3.85Å; Y172-L323 HydrophobicContact CD2-CG 4.1Å; Y172-L323 HydrophobicContact CE2-CD1 3.98Å; Y172-L323 HydrophobicContact CE2-CD2 4.39Å; Y172-L323 HydrophobicContact CG-CD2 4.27Å
173L96.6Very high94.7Very high38 Ų3828 Ų2820%0.19913%0.133CC..Hα-helixtrans-64-37.9177.4-70.7178.5000111.5L169 T177 Y266 I270 F274L169-L173 HydrophobicContact CD1-CD1 3.74Å; L169-L173 HydrophobicContact CD1-CG 4.14Å; L169-L173 HydrophobicContact CG-CD1 4.03Å; L169-L173 WeakPolarHBondContact O-CB 3.47Å; L169-L173 VanDerWaalsContact O-CG 3.31Å; L169-L173 WeakPolarHBondContact O-CG 3.31Å; L169-L173 PolarHBondContact O-N 2.9Å; L173-T177 VanDerWaalsContact O-CB 3.25Å; L173-T177 WeakPolarHBondContact O-CB 3.47Å; L173-T177 PolarHBondContact O-N 3.09Å; L173-T177 PolarHBondContact O-OG1 3.33Å; L173-Y266 HydrophobicContact CB-CE1 4.46Å; L173-I270 HydrophobicContact CB-CD1 3.96Å; L173-I270 HydrophobicContact CD1-CD1 3.89Å; L173-I270 HydrophobicContact CD1-CG1 3.89Å; L173-I270 HydrophobicContact CD1-CG2 4.18Å; L173-F274 HydrophobicContact CD1-CE2 4.08Å
174G95.3Very high94.3Very high0 Ų031.8 Ų31.80%016%0.158CC..Hα-helixtrans-60.5-47.2174.300000113V170 M171 Y172 T177 K178V170-G174 PolarHBondContact O-N 2.93Å; M171-G174 PolarHBondContact O-N 2.78Å; Y172-G174 VanDerWaalsContact C-N 3.3Å; Y172-G174 PolarHBondContact O-N 3.35Å; G174-T177 PolarHBondContact O-N 3.46Å; G174-K178 PolarHBondContact O-N 3.12Å
175Q92.9Very high93.9Very high2 Ų233 Ų331%0.00916%0.163CC..Hα-helixtrans-65.8-46.4177.4-64.4-65.217.200111.6M171 Y172 T177 K178 D179 T207 T319 I322M171-Q175 WeakPolarHBondContact O-CG 3.41Å; M171-Q175 PolarHBondContact O-N 2.96Å; Y172-Q175 PolarHBondContact O-N 2.93Å; Q175-T177 VanDerWaalsContact C-N 3.26Å; Q175-T177 PolarHBondContact O-N 3.16Å; Q175-K178 WeakPolarHBondContact O-CB 3.26Å; Q175-K178 PolarHBondContact O-N 3.01Å; Q175-K178 VanDerWaalsContact O-N 3.15Å; Q175-D179 PolarHBondContact O-N 3.37Å; Q175-D179 VanDerWaalsContact O-N 3.1Å; Q175-T207 HydrophobicContact CG-CG2 4.48Å; Q175-T319 WeakPolarHBondContact CB-OG1 3.39Å; Q175-I322 HydrophobicContact CG-CD1 4.3Å
176C92.3Very high93.5Very high7 Ų732.1 Ų32.15%0.04716%0.157CC..Hα-helixtrans-58.6-40.8175.5-66.90000111.8Y172 D179 I180 L309Y172-C176 VanDerWaalsContact CE2-SG 3.56Å; Y172-C176 PolarHBondContact O-N 2.93Å; Y172-C176 PolarHBondContact O-SG 2.94Å; C176-D179 PolarHBondContact O-N 3.02Å; C176-I180 WeakPolarHBondContact O-CD1 3.29Å; C176-I180 VanDerWaalsContact O-CG1 3.28Å; C176-I180 WeakPolarHBondContact O-CG1 3.5Å; C176-I180 PolarHBondContact O-N 3.38Å; C176-L309 HydrophobicContact CB-CD1 3.97Å
177T93.3Very high92.9Very high27 Ų2734.4 Ų34.417%0.16618%0.178CC..Hα-helixtrans-66.8-37.9179.2-58.10000111.7L173 G174 Q175 D179 I180 I181 P205 Y266L173-T177 VanDerWaalsContact O-CB 3.25Å; L173-T177 WeakPolarHBondContact O-CB 3.47Å; L173-T177 PolarHBondContact O-N 3.09Å; L173-T177 PolarHBondContact O-OG1 3.33Å; G174-T177 PolarHBondContact O-N 3.46Å; Q175-T177 VanDerWaalsContact C-N 3.26Å; Q175-T177 PolarHBondContact O-N 3.16Å; T177-D179 VanDerWaalsContact C-N 3.31Å; T177-D179 PolarHBondContact O-N 3.19Å; T177-I180 PolarHBondContact O-N 3.35Å; T177-I181 HydrophobicContact CG2-CD1 3.5Å; T177-I181 HydrophobicContact CG2-CG1 4Å; T177-I181 WeakPolarHBondContact O-CB 3.41Å; T177-I181 VanDerWaalsContact O-CG1 3.32Å; T177-I181 WeakPolarHBondContact O-CG1 3.41Å; T177-I181 PolarHBondContact O-N 3.46Å; T177-P205 HydrophobicContact CG2-CG 4.17Å; T177-Y266 HydrophobicContact CG2-CE1 4.28Å; T177-Y266 WeakPolarHBondContact OG1-CE1 3.28Å; T177-Y266 PolarHBondContact OG1-OH 2.92Å
178K91.4Very high92.2Very high1 Ų135.5 Ų35.50%0.00419%0.188CC..Hα-helixtrans-57.5-45.9171.8-82.6178.3176.8171.70111.7G174 Q175 I180 I181 R182 E201 Y202 M204 P205 T207G174-K178 PolarHBondContact O-N 3.12Å; Q175-K178 WeakPolarHBondContact O-CB 3.26Å; Q175-K178 PolarHBondContact O-N 3.01Å; Q175-K178 VanDerWaalsContact O-N 3.15Å; K178-I180 VanDerWaalsContact C-N 3.27Å; K178-I180 PolarHBondContact O-N 3Å; K178-I181 PolarHBondContact O-N 3.03Å; K178-R182 WeakPolarHBondContact O-CA 3.45Å; K178-R182 PolarHBondContact O-N 3.41Å; K178-E201 IonicContact NZ-OE2 3.47Å; K178-E201 PolarHBondContact NZ-OE2 3.33Å; K178-Y202 WeakPolarHBondContact CE-O 3.23Å; K178-Y202 WeakPolarHBondContact O-CD2 3.29Å; K178-M204 WeakPolarHBondContact CA-O 3.31Å; K178-M204 WeakPolarHBondContact CG-O 3.43Å; K178-P205 WeakPolarHBondContact CE-O 3.37Å; K178-T207 HydrophobicContact CD-CG2 4.24Å; K178-T207 PolarHBondContact NZ-OG1 3.35Å
179D88.4Confident91.5Very high1 Ų139.5 Ų39.51%0.00521%0.214CC..Hα-helixtrans-69.5-25.4-178.1-61.6-24.4000112.6Q175 C176 T177 R182 L309 D310 S315Q175-D179 PolarHBondContact O-N 3.37Å; Q175-D179 VanDerWaalsContact O-N 3.1Å; C176-D179 PolarHBondContact O-N 3.02Å; T177-D179 VanDerWaalsContact C-N 3.31Å; T177-D179 PolarHBondContact O-N 3.19Å; D179-R182 WeakPolarHBondContact O-CG 3.48Å; D179-R182 PolarHBondContact O-NE 3.38Å; D179-L309 HydrophobicContact CB-CB 4.07Å; D179-D310 HydrophobicContact CB-CB 4.32Å; D179-S315 PolarHBondContact OD1-OG 3.01Å
180I89.6Confident91Very high109 Ų10939.8 Ų39.856%0.55922%0.218SC*.Hα-helixtrans-79.3-48.7173.6-67.7163.8000111.5C176 T177 K178 L309C176-I180 WeakPolarHBondContact O-CD1 3.29Å; C176-I180 VanDerWaalsContact O-CG1 3.28Å; C176-I180 WeakPolarHBondContact O-CG1 3.5Å; C176-I180 PolarHBondContact O-N 3.38Å; T177-I180 PolarHBondContact O-N 3.35Å; K178-I180 VanDerWaalsContact C-N 3.27Å; K178-I180 PolarHBondContact O-N 3Å; I180-L309 HydrophobicContact CD1-CD1 4.29Å; I180-L309 HydrophobicContact CG1-CD1 4.19Å; I180-L309 HydrophobicContact CG1-CD2 4.33Å
181I90.8Very high90.5Very high70 Ų7039.8 Ų39.836%0.35922%0.218SC..Hα-helixtrans-75.9-36-174.7-62.3179.4000111.1T177 K178 W183 M204T177-I181 HydrophobicContact CG2-CD1 3.5Å; T177-I181 HydrophobicContact CG2-CG1 4Å; T177-I181 WeakPolarHBondContact O-CB 3.41Å; T177-I181 VanDerWaalsContact O-CG1 3.32Å; T177-I181 WeakPolarHBondContact O-CG1 3.41Å; T177-I181 PolarHBondContact O-N 3.46Å; K178-I181 PolarHBondContact O-N 3.03Å; I181-W183 HydrophobicContact CG2-CB 3.89Å; I181-W183 HydrophobicContact CG2-CE3 3.97Å; I181-W183 PolarHBondContact O-N 3.16Å; I181-M204 HydrophobicContact CG2-SD 4.41Å
182R89.5Confident89.9Confident119 Ų11939.5 Ų39.545%0.44922%0.217SC..  trans5436.8-180-55.8-171.1-177179.3-0.4114.2K178 D179 Y202 L309 D310K178-R182 WeakPolarHBondContact O-CA 3.45Å; K178-R182 PolarHBondContact O-N 3.41Å; D179-R182 WeakPolarHBondContact O-CG 3.48Å; D179-R182 PolarHBondContact O-NE 3.38Å; R182-Y202 HydrophobicContact CB-CD1 3.83Å; R182-Y202 HydrophobicContact CB-CE1 3.5Å; R182-Y202 VanDerWaalsContact CB-CE1 3.5Å; R182-Y202 HydrophobicContact CB-CE2 4.28Å; R182-Y202 HydrophobicContact CB-CG 4.34Å; R182-Y202 HydrophobicContact CG-CD1 4.45Å; R182-Y202 HydrophobicContact CG-CD2 4.36Å; R182-Y202 HydrophobicContact CG-CE1 3.92Å; R182-Y202 HydrophobicContact CG-CE2 3.84Å; R182-L309 PolarHBondContact NH2-O 3.45Å; R182-D310 IonicContact CZ-OD1 3.56Å; R182-D310 IonicContact NE-OD1 3.6Å; R182-D310 IonicContact NH1-OD1 3.89Å; R182-D310 IonicContact NH2-OD1 2.67Å
183W90.2Very high89.3Confident71 Ų7140.6 Ų40.627%0.26922%0.222SC..PPolyproline II helixtrans-71.9132.1-174.7-155.9-104.2000111.9Q15 I181 Y202 S203 M204 L258Q15-W183 VanDerWaalsContact CD-CZ2 3.47Å; Q15-W183 VanDerWaalsContact NE2-CE2 3.3Å; Q15-W183 VanDerWaalsContact NE2-CZ2 3.3Å; Q15-W183 VanDerWaalsContact NE2-NE1 3.1Å; I181-W183 HydrophobicContact CG2-CB 3.89Å; I181-W183 HydrophobicContact CG2-CE3 3.97Å; I181-W183 PolarHBondContact O-N 3.16Å; W183-Y202 CarbonylContact O-C 3.6Å; W183-Y202 WeakPolarHBondContact O-CA 3.34Å; W183-S203 PolarHBondContact O-N 3.25Å; W183-M204 HydrophobicContact CB-CB 3.45Å; W183-M204 VanDerWaalsContact CB-CB 3.45Å; W183-M204 HydrophobicContact CD2-SD 4.26Å; W183-M204 HydrophobicContact CG-CB 3.78Å; W183-M204 HydrophobicContact CG-SD 4.27Å; W183-L258 HydrophobicContact CZ2-CD2 4.35Å
184P89.6Confident88.5Confident84 Ų8439.7 Ų39.755%0.54522%0.217SC..PPolyproline II helixtrans-72.3150.1-179.129.8-35000112.3S203P184-S203 WeakPolarHBondContact O-CB 3.27Å
185R89.6Confident87.4Confident29 Ų2941.1 Ų41.111%0.10922%0.224CC..PPolyproline II helixtrans-65.5157.9172.2-65.4-79.9-179.4176.52.7111.3A187 E201 Y202 M254 H255R185-A187 PolarHBondContact O-N 3.46Å; R185-E201 VanDerWaalsContact CG-O 3.32Å; R185-E201 WeakPolarHBondContact CG-O 3.43Å; R185-E201 PolarHBondContact NE-O 2.92Å; R185-Y202 PolarHBondContact NH2-O 2.88Å; R185-M254 WeakPolarHBondContact CD-O 3.18Å; R185-M254 PolarHBondContact NH1-O 3.38Å; R185-H255 PolarHBondContact NH1-CD2 2.97Å; R185-H255 VanDerWaalsContact NH1-CD2 3.31Å; R185-H255 PolarHBondContact NH1-CE1 2.94Å; R185-H255 PolarHBondContact NH1-ND1 3.24Å; R185-H255 PolarHBondContact NH1-NE2 3.38Å
186P89.1Confident86.1Confident9 Ų941.4 Ų41.46%0.05823%0.226CC..PPolyproline II helixtrans-54.6136.7173.5-24.133.5000112.3V191 M254P186-V191 HydrophobicContact CB-CG2 4.08Å; P186-M254 WeakPolarHBondContact CD-O 3.46Å
187A86.6Confident84.4Confident56 Ų5644.3 Ų44.346%0.46324%0.238SC..PPolyproline II helixtrans-64.4137.1-178.800000112P17 R185 P189 V191P17-A187 HydrophobicContact CG-CB 4.32Å; R185-A187 PolarHBondContact O-N 3.46Å; A187-P189 CarbonylContact C-O 3.41Å; A187-P189 CarbonylContact O-C 3.56Å; A187-V191 WeakPolarHBondContact O-CB 3.41Å; A187-V191 PolarHBondContact O-N 2.83Å
188S83.4Confident82.6Confident40 Ų4044.3 Ų44.328%0.2824%0.235SC..THydrogen-bonded Turntrans-124.7114.9174.7-179.30000108.4Q119 V191Q119-S188 PolarHBondContact OE1-OG 3.2Å; S188-V191 WeakPolarHBondContact CA-O 3.48Å; S188-V191 WeakPolarHBondContact CB-O 3.25Å; S188-V191 PolarHBondContact OG-O 2.83Å
189P84.4Confident81.1Confident95 Ų9545.6 Ų45.662%0.61724%0.242SC*.THydrogen-bonded Turncis-69161.7-2.529.7-35.5000113.9A187A187-P189 CarbonylContact C-O 3.41Å; A187-P189 CarbonylContact O-C 3.56Å
190P87.3Confident79.8Confident49 Ų4947.7 Ų47.732%0.31826%0.257SS..THydrogen-bonded Turncis-89-10.210.237.6-39.4000115.1P17 A21P17-P190 HydrophobicContact CB-CG 4.23Å; A21-P190 HydrophobicContact CB-CB 3.98Å; A21-P190 HydrophobicContact CB-CG 4.05Å
191V87Confident79.1Confident1 Ų142.8 Ų42.81%0.00623%0.232CC..SBendtrans-74.4139.6-177.7178.80000110.1P17 V20 A21 P186 A187 S188P17-V191 HydrophobicContact CB-CG2 3.9Å; P17-V191 WeakPolarHBondContact O-CG2 3.34Å; V20-V191 HydrophobicContact CB-CG2 3.82Å; V20-V191 HydrophobicContact CG1-CG1 3.8Å; V20-V191 HydrophobicContact CG1-CG2 3.93Å; A21-V191 HydrophobicContact CB-CG2 4.42Å; P186-V191 HydrophobicContact CB-CG2 4.08Å; A187-V191 WeakPolarHBondContact O-CB 3.41Å; A187-V191 PolarHBondContact O-N 2.83Å; S188-V191 WeakPolarHBondContact CA-O 3.48Å; S188-V191 WeakPolarHBondContact CB-O 3.25Å; S188-V191 PolarHBondContact OG-O 2.83Å
192V84.8Confident78.8Confident7 Ų742 Ų424%0.04223%0.225CC..  trans-94.5119.3173.4-178.80000108.8Q24 V29 A31 A121 L194Q24-V192 PolarHBondContact NE2-O 2.93Å; V29-V192 HydrophobicContact CG1-CB 4.22Å; V29-V192 HydrophobicContact CG1-CG1 4.3Å; A31-V192 HydrophobicContact CB-CG2 3.83Å; A121-V192 HydrophobicContact CB-CG1 3.58Å; V192-L194 HydrophobicContact CG1-CD2 4.16Å; V192-L194 PolarHBondContact O-N 2.85Å
193K83.9Confident78.8Confident38 Ų3836.3 Ų36.317%0.16520%0.203CC..  trans-86.9103.2179.7-72.6172.5159.5-155.30109.8N199K193-N199 VanDerWaalsContact CD-OD1 3.23Å; K193-N199 WeakPolarHBondContact CD-OD1 3.27Å; K193-N199 VanDerWaalsContact CE-OD1 3.32Å; K193-N199 WeakPolarHBondContact CE-OD1 3.16Å; K193-N199 PolarHBondContact NZ-OD1 2.84Å
194L79.1Confident78.9Confident18 Ų1834.4 Ų34.49%0.09420%0.197CC..SBendtrans-81.9-20.5179.1-64.4178.1000112.5V29 A121 V192 Y251 M252V29-L194 HydrophobicContact CG1-CD1 4.31Å; V29-L194 HydrophobicContact CG1-CD2 4.32Å; V29-L194 HydrophobicContact CG2-CD1 4.27Å; A121-L194 HydrophobicContact CB-CD2 3.47Å; A121-L194 VanDerWaalsContact CB-CD2 3.47Å; V192-L194 HydrophobicContact CG1-CD2 4.16Å; V192-L194 PolarHBondContact O-N 2.85Å; L194-Y251 HydrophobicContact CD1-CD1 3.96Å; L194-Y251 HydrophobicContact CD1-CE1 3.61Å; L194-M252 HydrophobicContact CB-SD 3.79Å; L194-M252 HydrophobicContact CD1-SD 4.16Å; L194-M252 PolarHBondContact N-O 2.78Å
195E71.9Confident79.1Confident30 Ų3030.5 Ų30.514%0.1417%0.172CC..  trans-118.3131.1176.3-173.2173-146.800109.8Y198 R249 M252 M254E195-Y198 HydrophobicContact CG-CD2 4.2Å; E195-Y198 VanDerWaalsContact OE1-CE2 3.3Å; E195-Y198 WeakPolarHBondContact OE1-CE2 3.48Å; E195-R249 IonicContact OE2-CZ 3.22Å; E195-R249 VanDerWaalsContact OE2-CZ 3.22Å; E195-R249 IonicContact OE2-NH1 2.7Å; E195-R249 PolarHBondContact OE2-NH1 3.07Å; E195-R249 IonicContact OE2-NH2 2.8Å; E195-R249 PolarHBondContact OE2-NH2 3.41Å; E195-M252 HydrophobicContact CB-CB 4.5Å; E195-M254 HydrophobicContact CB-CG 4.06Å; E195-M254 HydrophobicContact CB-SD 4.17Å
196V65.1Low79.5Confident9 Ų929.1 Ų29.16%0.05517%0.167CC..  trans-108-24.4-173.2-167.60000111.8E116 Y198 N199E116-V196 HydrophobicContact CB-CG1 3.5Å; V196-Y198 PolarHBondContact O-N 2.83Å; V196-Y198 VanDerWaalsContact O-N 3.15Å; V196-N199 WeakPolarHBondContact O-CB 3.37Å; V196-N199 PolarHBondContact O-N 3.36Å; V196-N199 VanDerWaalsContact O-N 3.15Å
197F57.6Low79.7Confident67 Ų6728.9 Ų28.929%0.29417%0.166SC..THydrogen-bonded Turntrans-58.3-36.6-170-170.8-94.3000112.8N111 L113N111-F197 PolarHBondContact ND2-O 3.15Å; L113-F197 HydrophobicContact CD1-CZ 4.43Å
198Y56.5Low80.2Confident28 Ų2826.6 Ų26.611%0.1115%0.145CC..THydrogen-bonded Turntrans-101.814.4-176.1-54.7-76000114.1E195 V196 S200 E201E195-Y198 HydrophobicContact CG-CD2 4.2Å; E195-Y198 VanDerWaalsContact OE1-CE2 3.3Å; E195-Y198 WeakPolarHBondContact OE1-CE2 3.48Å; V196-Y198 PolarHBondContact O-N 2.83Å; V196-Y198 VanDerWaalsContact O-N 3.15Å; Y198-S200 VanDerWaalsContact C-N 3.25Å; Y198-S200 PolarHBondContact O-N 2.78Å; Y198-E201 WeakPolarHBondContact CD1-OE1 3.43Å; Y198-E201 PolarHBondContact O-N 2.68Å
199N59.7Low80.8Confident28 Ų2824.7 Ų24.715%0.1513%0.132CC..THydrogen-bonded Turntrans-62.9-32.4-178.1-91.1-21.6000113.8E116 K193 V196 E201E116-N199 VanDerWaalsContact OE2-CB 3.29Å; E116-N199 WeakPolarHBondContact OE2-CB 3.33Å; E116-N199 PolarHBondContact OE2-ND2 2.9Å; E116-N199 VanDerWaalsContact OE2-ND2 3.15Å; K193-N199 VanDerWaalsContact CD-OD1 3.23Å; K193-N199 WeakPolarHBondContact CD-OD1 3.27Å; K193-N199 VanDerWaalsContact CE-OD1 3.32Å; K193-N199 WeakPolarHBondContact CE-OD1 3.16Å; K193-N199 PolarHBondContact NZ-OD1 2.84Å; V196-N199 WeakPolarHBondContact O-CB 3.37Å; V196-N199 PolarHBondContact O-N 3.36Å; V196-N199 VanDerWaalsContact O-N 3.15Å; N199-E201 PolarHBondContact O-N 3.44Å
200S60.6Low81.5Confident45 Ų4520.2 Ų20.232%0.31510%0.103SC..THydrogen-bonded Turntrans-78.9-4.5178.846.80000113.5Y198 T314Y198-S200 VanDerWaalsContact C-N 3.25Å; Y198-S200 PolarHBondContact O-N 2.78Å; S200-T314 PolarHBondContact OG-OG1 2.77Å
201E74.1Confident82Confident6 Ų617.9 Ų17.93%0.0289%0.088CC..SBendtrans-96.6150.1-179.8-63.9-175.4-174.300113K178 R185 Y198 N199 T314K178-E201 IonicContact NZ-OE2 3.47Å; K178-E201 PolarHBondContact NZ-OE2 3.33Å; R185-E201 VanDerWaalsContact CG-O 3.32Å; R185-E201 WeakPolarHBondContact CG-O 3.43Å; R185-E201 PolarHBondContact NE-O 2.92Å; Y198-E201 WeakPolarHBondContact CD1-OE1 3.43Å; Y198-E201 PolarHBondContact O-N 2.68Å; N199-E201 PolarHBondContact O-N 3.44Å; E201-T314 WeakPolarHBondContact CG-OG1 3.48Å; E201-T314 PolarHBondContact OE1-OG1 2.9Å
202Y85.8Confident82.5Confident53 Ų5317.9 Ų17.921%0.2089%0.088CC..  trans-60.5148.6169.6-53.1-63.3000112.1K178 R182 W183 R185 D310K178-Y202 WeakPolarHBondContact CE-O 3.23Å; K178-Y202 WeakPolarHBondContact O-CD2 3.29Å; R182-Y202 HydrophobicContact CB-CD1 3.83Å; R182-Y202 HydrophobicContact CB-CE1 3.5Å; R182-Y202 VanDerWaalsContact CB-CE1 3.5Å; R182-Y202 HydrophobicContact CB-CE2 4.28Å; R182-Y202 HydrophobicContact CB-CG 4.34Å; R182-Y202 HydrophobicContact CG-CD1 4.45Å; R182-Y202 HydrophobicContact CG-CD2 4.36Å; R182-Y202 HydrophobicContact CG-CE1 3.92Å; R182-Y202 HydrophobicContact CG-CE2 3.84Å; W183-Y202 CarbonylContact O-C 3.6Å; W183-Y202 WeakPolarHBondContact O-CA 3.34Å; R185-Y202 PolarHBondContact NH2-O 2.88Å; Y202-D310 WeakPolarHBondContact CE2-OD2 3.37Å; Y202-D310 PolarHBondContact OH-OD1 3.35Å; Y202-D310 PolarHBondContact OH-OD2 3.15Å
203S88.4Confident83.1Confident0 Ų017.6 Ų17.60%09%0.086CC..  trans-84.8-39.1-171.3-156.40000113.6W183 P184 P205 M254 H255 D259W183-S203 PolarHBondContact O-N 3.25Å; P184-S203 WeakPolarHBondContact O-CB 3.27Å; S203-P205 CarbonylContact O-C 3.33Å; S203-M254 PolarHBondContact OG-O 3.47Å; S203-H255 PolarHBondContact O-CE1 3.3Å; S203-H255 PolarHBondContact O-ND1 3Å; S203-H255 PolarHBondContact OG-ND1 3.49Å; S203-D259 VanDerWaalsContact OG-CG 3.27Å; S203-D259 PolarHBondContact OG-OD2 3.32Å
204M91.8Very high83.8Confident30 Ų3015.8 Ų15.815%0.1488%0.078CC..SBendtrans-110.4132.1-166.2-167.1-177.6-166.800111.3K178 I181 W183 L258 D259 A262K178-M204 WeakPolarHBondContact CA-O 3.31Å; K178-M204 WeakPolarHBondContact CG-O 3.43Å; I181-M204 HydrophobicContact CG2-SD 4.41Å; W183-M204 HydrophobicContact CB-CB 3.45Å; W183-M204 VanDerWaalsContact CB-CB 3.45Å; W183-M204 HydrophobicContact CD2-SD 4.26Å; W183-M204 HydrophobicContact CG-CB 3.78Å; W183-M204 HydrophobicContact CG-SD 4.27Å; M204-L258 HydrophobicContact CE-CD1 4.46Å; M204-L258 HydrophobicContact CE-CD2 4.36Å; M204-L258 HydrophobicContact CE-CG 4.02Å; M204-D259 WeakPolarHBondContact CB-OD1 3.34Å; M204-A262 HydrophobicContact CE-CB 3.26Å; M204-A262 HydrophobicContact CG-CB 4.2Å
205P95.7Very high84.7Confident3 Ų315.2 Ų15.22%0.0198%0.075CC..SBendcis-74.9161.1-10.231.2-36000112.7T177 K178 S203 T207 M210 Y266T177-P205 HydrophobicContact CG2-CG 4.17Å; K178-P205 WeakPolarHBondContact CE-O 3.37Å; S203-P205 CarbonylContact O-C 3.33Å; P205-T207 PolarHBondContact O-N 3.24Å; P205-T207 VanDerWaalsContact O-N 3.15Å; P205-M210 HydrophobicContact CB-SD 3.85Å; P205-M210 HydrophobicContact CG-SD 3.56Å; P205-M210 VanDerWaalsContact CG-SD 3.56Å; P205-Y266 HydrophobicContact CG-CD1 4.07Å
206S96.1Very high86Confident0 Ų013.8 Ų13.80%07%0.069CC..  trans-72106172.7175.10000111.6H208 A209 M210 H255 D259S206-H208 VanDerWaalsContact C-N 3.33Å; S206-H208 PolarHBondContact O-N 2.91Å; S206-A209 WeakPolarHBondContact O-CB 3.41Å; S206-A209 PolarHBondContact O-N 2.75Å; S206-A209 VanDerWaalsContact O-N 3.14Å; S206-A209 WeakPolarHBondContact OG-CB 3.17Å; S206-A209 PolarHBondContact OG-N 2.88Å; S206-M210 VanDerWaalsContact O-CG 3.28Å; S206-M210 WeakPolarHBondContact O-CG 3.45Å; S206-M210 PolarHBondContact O-N 2.59Å; S206-H255 VanDerWaalsContact CA-CE1 3.45Å; S206-H255 WeakPolarHBondContact CA-CE1 3.43Å; S206-H255 PolarHBondContact OG-NE2 3.17Å; S206-D259 PolarHBondContact N-O 2.92Å
207T95.1Very high87.6Confident4 Ų414.7 Ų14.73%0.0257%0.073CC..Hα-helixtrans-62.8-35.4178.6450000112.9Q175 K178 P205 M210 S211Q175-T207 HydrophobicContact CG-CG2 4.48Å; K178-T207 HydrophobicContact CD-CG2 4.24Å; K178-T207 PolarHBondContact NZ-OG1 3.35Å; P205-T207 PolarHBondContact O-N 3.24Å; P205-T207 VanDerWaalsContact O-N 3.15Å; T207-M210 WeakPolarHBondContact O-CB 3.08Å; T207-M210 PolarHBondContact O-N 3.02Å; T207-S211 PolarHBondContact O-N 3.42Å; T207-S211 PolarHBondContact O-OG 3.48Å
208H95.6Very high89.5Confident8 Ų811.5 Ų11.54%0.0376%0.059CC..Hα-helixtrans-63.3-43.2171.9-72.161.5000111.7G139 N140 S206 M210 S211 G212 V245 R249G139-H208 PolarHBondContact O-NE2 3.4Å; N140-H208 PolarHBondContact OD1-NE2 3.28Å; S206-H208 VanDerWaalsContact C-N 3.33Å; S206-H208 PolarHBondContact O-N 2.91Å; H208-M210 VanDerWaalsContact C-N 3.27Å; H208-M210 PolarHBondContact O-N 3.39Å; H208-S211 PolarHBondContact O-OG 2.88Å; H208-G212 PolarHBondContact O-N 2.83Å; H208-V245 HydrophobicContact CB-CG1 4.26Å; H208-V245 VanDerWaalsContact O-CG1 3.23Å; H208-V245 WeakPolarHBondContact O-CG1 3.37Å; H208-R249 VanDerWaalsContact CB-CD 3.49Å; H208-R249 HydrophobicContact CB-CG 3.77Å
209A97.4Very high91.4Very high0 Ų011 Ų110%06%0.058CC..Hα-helixtrans-64.7-36.7174.500000110.9S206 T213 I260S206-A209 WeakPolarHBondContact O-CB 3.41Å; S206-A209 PolarHBondContact O-N 2.75Å; S206-A209 VanDerWaalsContact O-N 3.14Å; S206-A209 WeakPolarHBondContact OG-CB 3.17Å; S206-A209 PolarHBondContact OG-N 2.88Å; A209-T213 WeakPolarHBondContact O-CB 3.34Å; A209-T213 PolarHBondContact O-N 3.19Å; A209-T213 PolarHBondContact O-OG1 2.95Å; A209-I260 HydrophobicContact CB-CD1 3.94Å; A209-I260 HydrophobicContact CB-CG2 4.31Å
210M98.4Very high93.2Very high0 Ų010.4 Ų10.40%06%0.055CC..Hα-helixtrans-62.6-54.2176.1-67.7174.57100111.8V170 P205 S206 T207 H208 G212 T213 A214 G263 Y266 T267 I270V170-M210 HydrophobicContact CG1-CB 3.76Å; V170-M210 HydrophobicContact CG1-CE 3.97Å; V170-M210 VanDerWaalsContact O-CE 3.31Å; V170-M210 WeakPolarHBondContact O-CE 3.47Å; P205-M210 HydrophobicContact CB-SD 3.85Å; P205-M210 HydrophobicContact CG-SD 3.56Å; P205-M210 VanDerWaalsContact CG-SD 3.56Å; S206-M210 VanDerWaalsContact O-CG 3.28Å; S206-M210 WeakPolarHBondContact O-CG 3.45Å; S206-M210 PolarHBondContact O-N 2.59Å; T207-M210 WeakPolarHBondContact O-CB 3.08Å; T207-M210 PolarHBondContact O-N 3.02Å; H208-M210 VanDerWaalsContact C-N 3.27Å; H208-M210 PolarHBondContact O-N 3.39Å; M210-G212 VanDerWaalsContact C-N 3.34Å; M210-G212 PolarHBondContact O-N 3.19Å; M210-T213 PolarHBondContact O-N 3.37Å; M210-T213 VanDerWaalsContact O-N 3.14Å; M210-A214 WeakPolarHBondContact O-CB 3.44Å; M210-A214 PolarHBondContact O-N 3.41Å; M210-G263 WeakPolarHBondContact CG-O 3.35Å; M210-Y266 HydrophobicContact CE-CD1 3.44Å; M210-Y266 VanDerWaalsContact CE-CD1 3.44Å; M210-Y266 HydrophobicContact CE-CE1 3.83Å; M210-Y266 HydrophobicContact CE-CG 4.34Å; M210-Y266 HydrophobicContact SD-CD1 4.08Å; M210-T267 WeakPolarHBondContact CA-OG1 3.44Å; M210-T267 VanDerWaalsContact CB-OG1 3.23Å; M210-T267 WeakPolarHBondContact CB-OG1 3.45Å; M210-T267 WeakPolarHBondContact CG-OG1 3.17Å; M210-T267 PolarHBondContact O-OG1 2.98Å; M210-I270 HydrophobicContact CE-CD1 3.74Å
211S97.4Very high95Very high1 Ų112 Ų121%0.0076%0.059CC..Hα-helixtrans-64.2-38.4177.462.50000112.6Y144 T207 H208 T213 A214 I215Y144-S211 VanDerWaalsContact OH-CB 3.22Å; Y144-S211 WeakPolarHBondContact OH-CB 3.44Å; Y144-S211 PolarHBondContact OH-OG 3.3Å; T207-S211 PolarHBondContact O-N 3.42Å; T207-S211 PolarHBondContact O-OG 3.48Å; H208-S211 PolarHBondContact O-OG 2.88Å; S211-T213 PolarHBondContact O-N 3.46Å; S211-A214 PolarHBondContact O-N 2.97Å; S211-I215 WeakPolarHBondContact O-CB 3.13Å; S211-I215 WeakPolarHBondContact O-CG1 3.44Å; S211-I215 PolarHBondContact O-N 3.25Å
212G97.3Very high96Very high1 Ų112.2 Ų12.21%0.016%0.061CC..Hα-helixtrans-67.9-15.2176.600000114H208 M210 P216 C242H208-G212 PolarHBondContact O-N 2.83Å; M210-G212 VanDerWaalsContact C-N 3.34Å; M210-G212 PolarHBondContact O-N 3.19Å; G212-P216 WeakPolarHBondContact O-CD 3.21Å; G212-P216 WeakPolarHBondContact O-CG 3.25Å; G212-C242 WeakPolarHBondContact O-CA 3.4Å
213T98.3Very high96.5Very high0 Ų010.2 Ų10.20%05%0.054CC..Hα-helixtrans-93.2-48170.2-55.70000110.4A209 M210 S211 I217 C242 F264 T267 I268A209-T213 WeakPolarHBondContact O-CB 3.34Å; A209-T213 PolarHBondContact O-N 3.19Å; A209-T213 PolarHBondContact O-OG1 2.95Å; M210-T213 PolarHBondContact O-N 3.37Å; M210-T213 VanDerWaalsContact O-N 3.14Å; S211-T213 PolarHBondContact O-N 3.46Å; T213-I217 HydrophobicContact CG2-CD1 3.66Å; T213-I217 WeakPolarHBondContact O-CB 3.49Å; T213-I217 WeakPolarHBondContact O-CD1 3.45Å; T213-I217 VanDerWaalsContact O-CG1 3.25Å; T213-I217 WeakPolarHBondContact O-CG1 3.24Å; T213-I217 PolarHBondContact O-N 2.96Å; T213-C242 PolarHBondContact OG1-SG 3.1Å; T213-F264 HydrophobicContact CG2-CD2 3.57Å; T213-F264 HydrophobicContact CG2-CE2 3.7Å; T213-F264 HydrophobicContact CG2-CG 4.45Å; T213-F264 WeakPolarHBondContact OG1-CD2 3.33Å; T213-T267 HydrophobicContact CG2-CG2 3.94Å; T213-I268 HydrophobicContact CG2-CD1 4.07Å
214A98.4Very high96.7Very high1 Ų116.3 Ų16.31%0.0088%0.078CC..Hα-helixtrans-62.6-52.6-174.200000112.2I166 V170 M210 S211 I217 S218 T267I166-A214 HydrophobicContact CG2-CB 4.47Å; V170-A214 HydrophobicContact CB-CB 4.35Å; V170-A214 HydrophobicContact CG1-CB 4.06Å; V170-A214 HydrophobicContact CG2-CB 3.92Å; M210-A214 WeakPolarHBondContact O-CB 3.44Å; M210-A214 PolarHBondContact O-N 3.41Å; S211-A214 PolarHBondContact O-N 2.97Å; A214-I217 PolarHBondContact O-N 2.94Å; A214-S218 VanDerWaalsContact O-CB 3.22Å; A214-S218 WeakPolarHBondContact O-CB 3.34Å; A214-S218 PolarHBondContact O-N 3.47Å; A214-S218 PolarHBondContact O-OG 3.14Å; A214-T267 HydrophobicContact CB-CG2 3.6Å
215I98.1Very high96.7Very high5 Ų517.4 Ų17.43%0.02610%0.097CC..Hα-helixtrans-58.8-56-172.7-67.2174.7000112.1F143 Y144 F147 F148 S211 I217 S218 M219F143-I215 HydrophobicContact CE1-CD1 3.89Å; Y144-I215 HydrophobicContact CD1-CD1 4.34Å; Y144-I215 HydrophobicContact CE1-CD1 3.78Å; F147-I215 HydrophobicContact CE1-CG2 3.68Å; F147-I215 HydrophobicContact CZ-CG2 3.59Å; F148-I215 HydrophobicContact CZ-CD1 4.49Å; S211-I215 WeakPolarHBondContact O-CB 3.13Å; S211-I215 WeakPolarHBondContact O-CG1 3.44Å; S211-I215 PolarHBondContact O-N 3.25Å; I215-I217 PolarHBondContact O-N 3.49Å; I215-S218 PolarHBondContact O-N 3.4Å; I215-M219 HydrophobicContact CG2-CG 4.31Å; I215-M219 HydrophobicContact CG2-SD 3.76Å; I215-M219 WeakPolarHBondContact O-CB 3.31Å; I215-M219 WeakPolarHBondContact O-CG 3.09Å; I215-M219 PolarHBondContact O-N 3.09Å
216P98.2Very high96.6Very high0 Ų018.5 Ų18.50%010%0.1CC..Hα-helixtrans-66.9-34.5-177.826.5-35.7000113.1G212 V220 I238 W241G212-P216 WeakPolarHBondContact O-CD 3.21Å; G212-P216 WeakPolarHBondContact O-CG 3.25Å; P216-V220 WeakPolarHBondContact O-CG2 3.32Å; P216-V220 PolarHBondContact O-N 3.05Å; P216-I238 HydrophobicContact CB-CG1 4.32Å; P216-W241 HydrophobicContact CB-CB 4.08Å; P216-W241 HydrophobicContact CB-CD2 4.34Å; P216-W241 HydrophobicContact CB-CG 4.15Å; P216-W241 HydrophobicContact CG-CB 4.07Å; P216-W241 HydrophobicContact CG-CD2 4.48Å; P216-W241 HydrophobicContact CG-CG 3.98Å
217I98.4Very high96.4Very high28 Ų2821.2 Ų21.214%0.14411%0.111CC..Hα-helixtrans-64.9-50.5175.1-67.6175.7000109.8T213 A214 I215 M219 V220 L221 I238 I268 L271T213-I217 HydrophobicContact CG2-CD1 3.66Å; T213-I217 WeakPolarHBondContact O-CB 3.49Å; T213-I217 WeakPolarHBondContact O-CD1 3.45Å; T213-I217 VanDerWaalsContact O-CG1 3.25Å; T213-I217 WeakPolarHBondContact O-CG1 3.24Å; T213-I217 PolarHBondContact O-N 2.96Å; A214-I217 PolarHBondContact O-N 2.94Å; I215-I217 PolarHBondContact O-N 3.49Å; I217-M219 VanDerWaalsContact C-N 3.33Å; I217-M219 PolarHBondContact O-N 2.63Å; I217-V220 PolarHBondContact O-N 3.49Å; I217-L221 HydrophobicContact CG2-CD1 3.73Å; I217-L221 HydrophobicContact CG2-CG 4.17Å; I217-L221 WeakPolarHBondContact O-CG 3.38Å; I217-L221 PolarHBondContact O-N 3.26Å; I217-I238 HydrophobicContact CD1-CG2 4.45Å; I217-I238 HydrophobicContact CG1-CD1 4.27Å; I217-I238 HydrophobicContact CG1-CG1 4.29Å; I217-I238 HydrophobicContact CG1-CG2 3.75Å; I217-I268 HydrophobicContact CD1-CD1 3.53Å; I217-L271 HydrophobicContact CB-CD1 4.07Å; I217-L271 HydrophobicContact CD1-CD1 4.37Å; I217-L271 HydrophobicContact CG2-CD1 3.72Å
218S98.1Very high96.3Very high0 Ų026.7 Ų26.70%014%0.136CC..Hα-helixtrans-64.9-35-179.5-62.70000112.9I166 A214 I215 L221 L222 L271I166-S218 WeakPolarHBondContact CD1-OG 3.31Å; I166-S218 WeakPolarHBondContact CG2-OG 3.31Å; A214-S218 VanDerWaalsContact O-CB 3.22Å; A214-S218 WeakPolarHBondContact O-CB 3.34Å; A214-S218 PolarHBondContact O-N 3.47Å; A214-S218 PolarHBondContact O-OG 3.14Å; I215-S218 PolarHBondContact O-N 3.4Å; S218-L221 PolarHBondContact O-N 3.28Å; S218-L222 VanDerWaalsContact O-CB 3.25Å; S218-L222 WeakPolarHBondContact O-CB 3.3Å; S218-L222 WeakPolarHBondContact O-CD1 3.45Å; S218-L222 WeakPolarHBondContact O-CG 3.29Å; S218-L222 PolarHBondContact O-N 3.24Å; S218-L271 WeakPolarHBondContact OG-CD2 3.43Å
219M97.3Very high96.2Very high19 Ų1929 Ų299%0.09415%0.145CC..Hα-helixtrans-55.4-56171.6-75.9163.476.800109.6F147 W151 L163 I215 I217 L221 L222 T223 L237 W241F147-M219 HydrophobicContact CE2-CE 4.27Å; F147-M219 HydrophobicContact CE2-SD 4.2Å; F147-M219 HydrophobicContact CZ-CE 4.14Å; F147-M219 HydrophobicContact CZ-CG 4.26Å; F147-M219 HydrophobicContact CZ-SD 3.63Å; W151-M219 HydrophobicContact CH2-CE 4.47Å; W151-M219 HydrophobicContact CZ2-CE 3.48Å; W151-M219 VanDerWaalsContact CZ2-CE 3.48Å; W151-M219 HydrophobicContact CZ2-CG 4.19Å; L163-M219 HydrophobicContact CD1-CG 3.97Å; L163-M219 HydrophobicContact CD2-CG 3.96Å; I215-M219 HydrophobicContact CG2-CG 4.31Å; I215-M219 HydrophobicContact CG2-SD 3.76Å; I215-M219 WeakPolarHBondContact O-CB 3.31Å; I215-M219 WeakPolarHBondContact O-CG 3.09Å; I215-M219 PolarHBondContact O-N 3.09Å; I217-M219 VanDerWaalsContact C-N 3.33Å; I217-M219 PolarHBondContact O-N 2.63Å; M219-L221 VanDerWaalsContact C-N 3.35Å; M219-L221 PolarHBondContact O-N 3.31Å; M219-L222 PolarHBondContact O-N 3.05Å; M219-T223 WeakPolarHBondContact O-CB 3.32Å; M219-T223 WeakPolarHBondContact O-CG2 3Å; M219-T223 PolarHBondContact O-N 2.91Å; M219-T223 PolarHBondContact O-OG1 3.01Å; M219-L237 HydrophobicContact CE-CD2 4.18Å; M219-W241 HydrophobicContact SD-CZ3 4.41Å
220V97.5Very high96.1Very high14 Ų1432.2 Ų32.29%0.08517%0.166CC..Hα-helixtrans-61.8-43-178.5176.40000111.4P216 I217 L222 Y224 L231 G234 I238P216-V220 WeakPolarHBondContact O-CG2 3.32Å; P216-V220 PolarHBondContact O-N 3.05Å; I217-V220 PolarHBondContact O-N 3.49Å; V220-L222 PolarHBondContact O-N 3.12Å; V220-Y224 WeakPolarHBondContact O-CB 3.38Å; V220-Y224 PolarHBondContact O-N 3.1Å; V220-L231 HydrophobicContact CG1-CD1 4.42Å; V220-G234 VanDerWaalsContact CG2-CA 3.47Å; V220-I238 HydrophobicContact CB-CD1 4.05Å; V220-I238 HydrophobicContact CG1-CD1 4.37Å; V220-I238 HydrophobicContact CG2-CD1 3.86Å; V220-I238 HydrophobicContact CG2-CG1 4.01Å
221L96.9Very high95.8Very high78 Ų7835.7 Ų35.741%0.40818%0.184SC..Hα-helixtrans-62.7-39.1178.8-71.4177000112.9I217 S218 M219 Y275I217-L221 HydrophobicContact CG2-CD1 3.73Å; I217-L221 HydrophobicContact CG2-CG 4.17Å; I217-L221 WeakPolarHBondContact O-CG 3.38Å; I217-L221 PolarHBondContact O-N 3.26Å; S218-L221 PolarHBondContact O-N 3.28Å; M219-L221 VanDerWaalsContact C-N 3.35Å; M219-L221 PolarHBondContact O-N 3.31Å; L221-Y275 HydrophobicContact CB-CE2 3.76Å; L221-Y275 HydrophobicContact CD1-CD1 4.49Å; L221-Y275 HydrophobicContact CD1-CD2 4.11Å; L221-Y275 HydrophobicContact CD1-CE1 4.4Å; L221-Y275 HydrophobicContact CD1-CE2 4Å; L221-Y275 HydrophobicContact CD1-CG 4.35Å; L221-Y275 PolarHBondContact O-OH 2.77Å
222L96.1Very high95.8Very high11 Ų1139.9 Ų39.96%0.05821%0.206CC..Hα-helixtrans-82.7-26.3-177.9-67.8169.4000113.1V159 R162 L163 I166 S218 M219 V220 Y275V159-L222 HydrophobicContact CG1-CB 4.04Å; V159-L222 HydrophobicContact CG1-CD1 4.41Å; V159-L222 HydrophobicContact CG2-CB 4.42Å; R162-L222 HydrophobicContact CB-CD1 3.76Å; R162-L222 HydrophobicContact CB-CD2 4.04Å; L163-L222 HydrophobicContact CD2-CD1 3.99Å; L163-L222 HydrophobicContact CG-CD1 3.95Å; I166-L222 HydrophobicContact CD1-CD1 4.21Å; S218-L222 VanDerWaalsContact O-CB 3.25Å; S218-L222 WeakPolarHBondContact O-CB 3.3Å; S218-L222 WeakPolarHBondContact O-CD1 3.45Å; S218-L222 WeakPolarHBondContact O-CG 3.29Å; S218-L222 PolarHBondContact O-N 3.24Å; M219-L222 PolarHBondContact O-N 3.05Å; V220-L222 PolarHBondContact O-N 3.12Å; L222-Y275 HydrophobicContact CD2-CE2 3.99Å; L222-Y275 HydrophobicContact CG-CE2 4.27Å
223T95.6Very high95.7Very high11 Ų1146.8 Ų46.87%0.06723%0.232CC..Hα-helixtrans-97.6-23.8-178.758.70000113.7W151 V159 M219 G225 R226 W227 Y229W151-T223 HydrophobicContact CH2-CG2 3.93Å; W151-T223 HydrophobicContact CZ3-CG2 3.97Å; V159-T223 HydrophobicContact CG1-CG2 3.86Å; V159-T223 HydrophobicContact CG2-CG2 4Å; M219-T223 WeakPolarHBondContact O-CB 3.32Å; M219-T223 WeakPolarHBondContact O-CG2 3Å; M219-T223 PolarHBondContact O-N 2.91Å; M219-T223 PolarHBondContact O-OG1 3.01Å; T223-G225 PolarHBondContact O-N 3.37Å; T223-R226 PolarHBondContact O-N 3.31Å; T223-R226 VanDerWaalsContact O-N 3.08Å; T223-W227 PolarHBondContact O-N 2.81Å; T223-Y229 PolarHBondContact OG1-OH 2.97Å
224Y93.7Very high95.6Very high129 Ų12946.9 Ų46.951%0.50623%0.233SC..BIsolated β-bridgetrans-69.8126.5-179.4-171.5-108.9000110.8V220 R226 Y229 L231V220-Y224 WeakPolarHBondContact O-CB 3.38Å; V220-Y224 PolarHBondContact O-N 3.1Å; Y224-R226 PolarHBondContact O-N 3.43Å; Y224-Y229 WeakPolarHBondContact CA-OH 3.47Å; Y224-Y229 HydrophobicContact CD2-CE2 4.47Å; Y224-Y229 PolarHBondContact N-OH 3.37Å; Y224-Y229 VanDerWaalsContact N-OH 3.12Å; Y224-L231 HydrophobicContact CD2-CB 4.46Å; Y224-L231 HydrophobicContact CD2-CD1 3.93Å; Y224-L231 HydrophobicContact CE2-CB 3.71Å; Y224-L231 HydrophobicContact CE2-CD1 3.85Å; Y224-L231 HydrophobicContact CE2-CG 4.25Å; Y224-L231 HydrophobicContact CG-CD1 4.32Å
225G90.8Very high95.4Very high52 Ų5251.8 Ų51.854%0.53626%0.259SS..THydrogen-bonded Turntrans81.8-15.8-171.900000114.3T223 P351T223-G225 PolarHBondContact O-N 3.37Å; G225-P351 WeakPolarHBondContact O-CB 3.48Å
226R92.8Very high95.4Very high26 Ų2656 Ų5610%0.09828%0.28CS..THydrogen-bonded Turntrans-91.3-39.4170.6-177.1170.217587.2-6.1112.2D156 T223 Y224 L350 P351 L352D156-R226 IonicContact OD1-CZ 3.73Å; D156-R226 IonicContact OD1-NE 3.31Å; D156-R226 IonicContact OD1-NH2 3.76Å; D156-R226 PolarHBondContact OD1-NH2 3.33Å; D156-R226 IonicContact OD2-CZ 3.42Å; D156-R226 IonicContact OD2-NE 3.34Å; D156-R226 PolarHBondContact OD2-NE 2.7Å; D156-R226 IonicContact OD2-NH2 3.27Å; D156-R226 PolarHBondContact OD2-NH2 3.31Å; T223-R226 PolarHBondContact O-N 3.31Å; T223-R226 VanDerWaalsContact O-N 3.08Å; Y224-R226 PolarHBondContact O-N 3.43Å; R226-L350 HydrophobicContact CG-CD2 4.16Å; R226-P351 CarbonylContact O-C 3.55Å; R226-P351 WeakPolarHBondContact O-CA 3.45Å; R226-L352 HydrophobicContact CG-CD1 4.49Å; R226-L352 WeakPolarHBondContact O-CB 3.46Å; R226-L352 PolarHBondContact O-N 2.79Å
227W93.8Very high95.3Very high58 Ų5859 Ų5922%0.2230%0.296CS..BIsolated β-bridgetrans-114.8144175.9-71.987.8000110.6D156 T223 Y229 L352D156-W227 HydrophobicContact CB-CZ2 4.24Å; D156-W227 PolarHBondContact OD2-NE1 3.31Å; T223-W227 PolarHBondContact O-N 2.81Å; W227-Y229 HydrophobicContact CB-CD1 3.83Å; W227-Y229 HydrophobicContact CB-CE1 3.93Å; W227-Y229 WeakPolarHBondContact O-CD1 3.43Å; W227-Y229 PolarHBondContact O-N 3.26Å; W227-L352 HydrophobicContact CD2-CB 4.01Å; W227-L352 HydrophobicContact CD2-CD1 4.22Å; W227-L352 HydrophobicContact CE3-CB 3.77Å; W227-L352 HydrophobicContact CH2-CB 4.45Å; W227-L352 HydrophobicContact CH2-CD1 4.2Å; W227-L352 HydrophobicContact CZ2-CD1 3.81Å; W227-L352 HydrophobicContact CZ3-CB 4Å
228Q92.8Very high95.3Very high118 Ų11859.6 Ų59.655%0.55130%0.299SS*.  trans-79.199.6176.2-66.4-175.56.100110.4P351 L352Q228-P351 HydrophobicContact CG-CB 3.61Å; Q228-P351 HydrophobicContact CG-CG 3.51Å; Q228-P351 PolarHBondContact NE2-O 2.62Å; Q228-L352 PolarHBondContact N-O 2.8Å
229Y93.4Very high95.3Very high56 Ų5662.6 Ų62.622%0.2232%0.319CS..  trans-153152.9167.263.9-88.9000111.4T223 Y224 W227 Y233T223-Y229 PolarHBondContact OG1-OH 2.97Å; Y224-Y229 WeakPolarHBondContact CA-OH 3.47Å; Y224-Y229 HydrophobicContact CD2-CE2 4.47Å; Y224-Y229 PolarHBondContact N-OH 3.37Å; Y224-Y229 VanDerWaalsContact N-OH 3.12Å; W227-Y229 HydrophobicContact CB-CD1 3.83Å; W227-Y229 HydrophobicContact CB-CE1 3.93Å; W227-Y229 WeakPolarHBondContact O-CD1 3.43Å; W227-Y229 PolarHBondContact O-N 3.26Å; Y229-Y233 HydrophobicContact CD2-CD2 4.35Å
230P94Very high95.3Very high68 Ų6865.5 Ų65.544%0.44234%0.34SS..  trans-61.7133176.1-27.137.1000113.5I232 Y233P230-I232 HydrophobicContact CB-CG2 3.77Å; P230-I232 PolarHBondContact O-N 3.26Å; P230-Y233 HydrophobicContact CG-CE2 4.21Å; P230-Y233 PolarHBondContact O-N 3.26Å
231L94Very high95.3Very high73 Ų7366.5 Ų66.538%0.38234%0.342SS..Hα-helixtrans-54.4-29.3177.8-177.659.8000113.2V220 Y224 Y233 G234 L235V220-L231 HydrophobicContact CG1-CD1 4.42Å; Y224-L231 HydrophobicContact CD2-CB 4.46Å; Y224-L231 HydrophobicContact CD2-CD1 3.93Å; Y224-L231 HydrophobicContact CE2-CB 3.71Å; Y224-L231 HydrophobicContact CE2-CD1 3.85Å; Y224-L231 HydrophobicContact CE2-CG 4.25Å; Y224-L231 HydrophobicContact CG-CD1 4.32Å; L231-Y233 PolarHBondContact O-N 3.14Å; L231-Y233 VanDerWaalsContact O-N 3.14Å; L231-G234 WeakPolarHBondContact O-CA 3.34Å; L231-G234 PolarHBondContact O-N 2.78Å; L231-L235 HydrophobicContact CG-CD1 4.34Å; L231-L235 HydrophobicContact CG-CG 4.26Å; L231-L235 PolarHBondContact O-N 3.36Å
232I96.7Very high95.4Very high90 Ų9063.3 Ų63.346%0.46233%0.326SS..Hα-helixtrans-55.3-31.4178.2-168.462.7000112.7P230 G234 L235 I236P230-I232 HydrophobicContact CB-CG2 3.77Å; P230-I232 PolarHBondContact O-N 3.26Å; I232-G234 VanDerWaalsContact C-N 3.34Å; I232-G234 PolarHBondContact O-N 2.81Å; I232-L235 HydrophobicContact CD1-CB 4.38Å; I232-L235 HydrophobicContact CD1-CD1 4.42Å; I232-L235 PolarHBondContact O-N 2.87Å; I232-I236 HydrophobicContact CG1-CD1 4.03Å; I232-I236 HydrophobicContact CG1-CG1 4.49Å; I232-I236 WeakPolarHBondContact O-CG1 3.48Å; I232-I236 PolarHBondContact O-N 3.49Å
233Y95.1Very high95.4Very high145 Ų14565.7 Ų65.757%0.56934%0.343SS*.Hα-helixtrans-64.1-40.7175.8-62.8-15000111.6Y229 P230 L231 I236 L237Y229-Y233 HydrophobicContact CD2-CD2 4.35Å; P230-Y233 HydrophobicContact CG-CE2 4.21Å; P230-Y233 PolarHBondContact O-N 3.26Å; L231-Y233 PolarHBondContact O-N 3.14Å; L231-Y233 VanDerWaalsContact O-N 3.14Å; Y233-I236 PolarHBondContact O-N 3.5Å; Y233-L237 WeakPolarHBondContact O-CB 3.45Å; Y233-L237 PolarHBondContact O-N 3.23Å
234G95.1Very high95.5Very high2 Ų266.7 Ų66.72%0.02135%0.348CS..Hα-helixtrans-66.2-42173.200000112.5V220 L231 I232 I236 L237 I238V220-G234 VanDerWaalsContact CG2-CA 3.47Å; L231-G234 WeakPolarHBondContact O-CA 3.34Å; L231-G234 PolarHBondContact O-N 2.78Å; I232-G234 VanDerWaalsContact C-N 3.34Å; I232-G234 PolarHBondContact O-N 2.81Å; G234-I236 PolarHBondContact O-N 3.41Å; G234-L237 PolarHBondContact O-N 3.1Å; G234-I238 WeakPolarHBondContact O-CG1 3.45Å; G234-I238 PolarHBondContact O-N 2.88Å
235L95.1Very high95.7Very high105 Ų10560.6 Ų60.655%0.5532%0.324SS..Hα-helixtrans-65.1-22.3177.9-64.5177.8000113.5L231 I232 P239L231-L235 HydrophobicContact CG-CD1 4.34Å; L231-L235 HydrophobicContact CG-CG 4.26Å; L231-L235 PolarHBondContact O-N 3.36Å; I232-L235 HydrophobicContact CD1-CB 4.38Å; I232-L235 HydrophobicContact CD1-CD1 4.42Å; I232-L235 PolarHBondContact O-N 2.87Å; L235-P239 WeakPolarHBondContact O-CD 3.18Å; L235-P239 WeakPolarHBondContact O-CG 3.08Å
236I97.7Very high96Very high93 Ų9358.7 Ų58.748%0.47730%0.303SS..Hα-helixtrans-88.4-46.9171.7-66.2166.8000110.4I232 Y233 G234 I238 P239 C240I232-I236 HydrophobicContact CG1-CD1 4.03Å; I232-I236 HydrophobicContact CG1-CG1 4.49Å; I232-I236 WeakPolarHBondContact O-CG1 3.48Å; I232-I236 PolarHBondContact O-N 3.49Å; Y233-I236 PolarHBondContact O-N 3.5Å; G234-I236 PolarHBondContact O-N 3.41Å; I236-I238 PolarHBondContact O-N 3.24Å; I236-P239 VanDerWaalsContact O-CD 3.29Å; I236-P239 WeakPolarHBondContact O-CD 3.35Å; I236-P239 WeakPolarHBondContact O-CG 3.29Å; I236-C240 VanDerWaalsContact O-CB 3.27Å; I236-C240 WeakPolarHBondContact O-CB 3.13Å; I236-C240 PolarHBondContact O-N 3.44Å; I236-C240 VanDerWaalsContact O-N 3.14Å; I236-C240 PolarHBondContact O-SG 3.02Å
237L97.1Very high96.2Very high62 Ų6260.9 Ų60.933%0.32532%0.316SS..Hα-helixtrans-57.6-49.4-176-17968.9000112.2M219 Y233 G234 C240 W241M219-L237 HydrophobicContact CE-CD2 4.18Å; Y233-L237 WeakPolarHBondContact O-CB 3.45Å; Y233-L237 PolarHBondContact O-N 3.23Å; G234-L237 PolarHBondContact O-N 3.1Å; L237-C240 PolarHBondContact O-N 3.45Å; L237-W241 HydrophobicContact CD1-CE3 4Å; L237-W241 VanDerWaalsContact O-CB 3.25Å; L237-W241 WeakPolarHBondContact O-CB 3.12Å; L237-W241 PolarHBondContact O-N 3.39Å
238I97.8Very high96.3Very high42 Ų4258.1 Ų58.122%0.21531%0.306CS..Hα-helixtrans-57.7-59-176.2-67.4165.6000111.8P216 I217 V220 G234 I236 C240 C242P216-I238 HydrophobicContact CB-CG1 4.32Å; I217-I238 HydrophobicContact CD1-CG2 4.45Å; I217-I238 HydrophobicContact CG1-CD1 4.27Å; I217-I238 HydrophobicContact CG1-CG1 4.29Å; I217-I238 HydrophobicContact CG1-CG2 3.75Å; V220-I238 HydrophobicContact CB-CD1 4.05Å; V220-I238 HydrophobicContact CG1-CD1 4.37Å; V220-I238 HydrophobicContact CG2-CD1 3.86Å; V220-I238 HydrophobicContact CG2-CG1 4.01Å; G234-I238 WeakPolarHBondContact O-CG1 3.45Å; G234-I238 PolarHBondContact O-N 2.88Å; I236-I238 PolarHBondContact O-N 3.24Å; I238-C240 PolarHBondContact O-N 2.95Å; I238-C242 WeakPolarHBondContact O-CB 3.39Å; I238-C242 PolarHBondContact O-N 3.43Å
239P97.7Very high96.4Very high63 Ų6352.5 Ų52.541%0.40928%0.279SS..Hα-helixtrans-66.5-36-178.225.4-34.4000112.4L235 I236 S243L235-P239 WeakPolarHBondContact O-CD 3.18Å; L235-P239 WeakPolarHBondContact O-CG 3.08Å; I236-P239 VanDerWaalsContact O-CD 3.29Å; I236-P239 WeakPolarHBondContact O-CD 3.35Å; I236-P239 WeakPolarHBondContact O-CG 3.29Å; P239-S243 WeakPolarHBondContact O-CB 3.33Å; P239-S243 PolarHBondContact O-N 3.22Å; P239-S243 PolarHBondContact O-OG 3.24Å
240C97.8Very high96.5Very high79 Ų7950.6 Ų50.653%0.53427%0.273SS..Hα-helixtrans-63.7-51.3178-730000111.7I236 L237 I238 L244I236-C240 VanDerWaalsContact O-CB 3.27Å; I236-C240 WeakPolarHBondContact O-CB 3.13Å; I236-C240 PolarHBondContact O-N 3.44Å; I236-C240 VanDerWaalsContact O-N 3.14Å; I236-C240 PolarHBondContact O-SG 3.02Å; L237-C240 PolarHBondContact O-N 3.45Å; I238-C240 PolarHBondContact O-N 2.95Å; C240-L244 WeakPolarHBondContact O-CB 3.38Å; C240-L244 PolarHBondContact O-N 2.59Å
241W98.1Very high96.5Very high36 Ų3647.3 Ų47.314%0.13625%0.252CS..Hα-helixtrans-64-51.7179.5-169.1-49.2000111L138 F143 F147 P216 M219 L237 S243 L244 V245L138-W241 HydrophobicContact CB-CZ2 4.48Å; L138-W241 HydrophobicContact CD1-CZ2 4.29Å; L138-W241 HydrophobicContact CD2-CZ2 4.11Å; F143-W241 HydrophobicContact CE1-CZ2 4.17Å; F143-W241 AromaticContact CE2-CH2 3.83Å; F143-W241 HydrophobicContact CE2-CH2 3.83Å; F143-W241 AromaticContact CE2-CZ2 3.78Å; F143-W241 HydrophobicContact CE2-CZ2 3.78Å; F143-W241 AromaticContact CZ-CH2 3.61Å; F143-W241 HydrophobicContact CZ-CH2 3.61Å; F143-W241 AromaticContact CZ-CZ2 3.37Å; F143-W241 HydrophobicContact CZ-CZ2 3.37Å; F147-W241 HydrophobicContact CD2-CH2 4.42Å; F147-W241 AromaticContact CE2-CH2 3.94Å; F147-W241 HydrophobicContact CE2-CH2 3.94Å; P216-W241 HydrophobicContact CB-CB 4.08Å; P216-W241 HydrophobicContact CB-CD2 4.34Å; P216-W241 HydrophobicContact CB-CG 4.15Å; P216-W241 HydrophobicContact CG-CB 4.07Å; P216-W241 HydrophobicContact CG-CD2 4.48Å; P216-W241 HydrophobicContact CG-CG 3.98Å; M219-W241 HydrophobicContact SD-CZ3 4.41Å; L237-W241 HydrophobicContact CD1-CE3 4Å; L237-W241 VanDerWaalsContact O-CB 3.25Å; L237-W241 WeakPolarHBondContact O-CB 3.12Å; L237-W241 PolarHBondContact O-N 3.39Å; W241-S243 VanDerWaalsContact C-N 3.35Å; W241-S243 PolarHBondContact O-N 2.88Å; W241-L244 PolarHBondContact O-N 3.47Å; W241-V245 WeakPolarHBondContact O-CG2 3.32Å; W241-V245 PolarHBondContact O-N 3.42Å
242C97.5Very high96.3Very high11 Ų1144.3 Ų44.37%0.07424%0.236CC..Hα-helixtrans-58.6-47.6-178-179.40000111G212 T213 I238 V245 C246G212-C242 WeakPolarHBondContact O-CA 3.4Å; T213-C242 PolarHBondContact OG1-SG 3.1Å; I238-C242 WeakPolarHBondContact O-CB 3.39Å; I238-C242 PolarHBondContact O-N 3.43Å; C242-V245 PolarHBondContact O-N 2.97Å; C242-C246 VanDerWaalsContact O-CB 3.24Å; C242-C246 WeakPolarHBondContact O-CB 3.36Å; C242-C246 PolarHBondContact O-N 2.71Å; C242-C246 PolarHBondContact O-SG 3.14Å
243S97.1Very high96Very high60 Ų6040 Ų4042%0.4221%0.214SC..Hα-helixtrans-64-43.3179-57.60000111.9P239 W241 V245 C246 L247P239-S243 WeakPolarHBondContact O-CB 3.33Å; P239-S243 PolarHBondContact O-N 3.22Å; P239-S243 PolarHBondContact O-OG 3.24Å; W241-S243 VanDerWaalsContact C-N 3.35Å; W241-S243 PolarHBondContact O-N 2.88Å; S243-V245 PolarHBondContact O-N 3.16Å; S243-C246 PolarHBondContact O-N 3.36Å; S243-L247 VanDerWaalsContact O-CB 3.25Å; S243-L247 WeakPolarHBondContact O-CB 3.4Å; S243-L247 WeakPolarHBondContact O-CG 3.41Å; S243-L247 PolarHBondContact O-N 3.49Å
244L97.8Very high95.7Very high33 Ų3333.1 Ų33.117%0.17319%0.187CC..Hα-helixtrans-57.8-49.9178.417662000111.5L131 F134 L138 C240 W241 S248L131-L244 HydrophobicContact CD1-CD1 3.69Å; L131-L244 HydrophobicContact CD2-CD1 4.36Å; L131-L244 HydrophobicContact CG-CD1 3.68Å; F134-L244 HydrophobicContact CD1-CD2 3.99Å; F134-L244 HydrophobicContact CE1-CD2 4.07Å; L138-L244 HydrophobicContact CD1-CD2 4.08Å; C240-L244 WeakPolarHBondContact O-CB 3.38Å; C240-L244 PolarHBondContact O-N 2.59Å; W241-L244 PolarHBondContact O-N 3.47Å; L244-S248 WeakPolarHBondContact O-CB 3.15Å; L244-S248 PolarHBondContact O-N 3.24Å
245V97.6Very high95.7Very high0 Ų033.1 Ų33.10%019%0.186CC..Hα-helixtrans-65.8-48179.5-179.90000110.5L138 H208 W241 C242 S243 L247 S248 R249L138-V245 HydrophobicContact CB-CG2 3.98Å; L138-V245 HydrophobicContact CD1-CG2 4.15Å; H208-V245 HydrophobicContact CB-CG1 4.26Å; H208-V245 VanDerWaalsContact O-CG1 3.23Å; H208-V245 WeakPolarHBondContact O-CG1 3.37Å; W241-V245 WeakPolarHBondContact O-CG2 3.32Å; W241-V245 PolarHBondContact O-N 3.42Å; C242-V245 PolarHBondContact O-N 2.97Å; S243-V245 PolarHBondContact O-N 3.16Å; V245-L247 PolarHBondContact O-N 2.92Å; V245-S248 WeakPolarHBondContact O-CB 3.24Å; V245-S248 PolarHBondContact O-N 3.47Å; V245-S248 PolarHBondContact O-OG 3.14Å; V245-R249 WeakPolarHBondContact O-CG 3.37Å; V245-R249 PolarHBondContact O-N 3.21Å
246C96.9Very high95.7Very high13 Ų1328.2 Ų28.29%0.08816%0.161CC..Hα-helixtrans-59.5-48.5-178.8-72.60000112.6C242 S243 S248 R249 I260C242-C246 VanDerWaalsContact O-CB 3.24Å; C242-C246 WeakPolarHBondContact O-CB 3.36Å; C242-C246 PolarHBondContact O-N 2.71Å; C242-C246 PolarHBondContact O-SG 3.14Å; S243-C246 PolarHBondContact O-N 3.36Å; C246-S248 VanDerWaalsContact C-N 3.31Å; C246-S248 PolarHBondContact O-N 3.24Å; C246-R249 PolarHBondContact O-N 3.22Å; C246-I260 HydrophobicContact CB-CG2 3.6Å
247L96.9Very high95.6Very high71 Ų7126.1 Ų26.137%0.37215%0.15SC..Hα-helixtrans-66.7-34.5179.2-67.6174.3000111.6F23 F132 S243 V245 R249 I250 Y251F23-L247 HydrophobicContact CE2-CD2 4.26Å; F23-L247 HydrophobicContact CZ-CB 4.24Å; F23-L247 HydrophobicContact CZ-CD2 4.04Å; F132-L247 HydrophobicContact CD1-CB 4.45Å; F132-L247 HydrophobicContact CE1-CB 3.66Å; F132-L247 HydrophobicContact CZ-CB 4.36Å; S243-L247 VanDerWaalsContact O-CB 3.25Å; S243-L247 WeakPolarHBondContact O-CB 3.4Å; S243-L247 WeakPolarHBondContact O-CG 3.41Å; S243-L247 PolarHBondContact O-N 3.49Å; V245-L247 PolarHBondContact O-N 2.92Å; L247-R249 VanDerWaalsContact C-N 3.26Å; L247-R249 PolarHBondContact O-N 2.98Å; L247-I250 PolarHBondContact O-N 3.03Å; L247-Y251 WeakPolarHBondContact O-CB 3.46Å; L247-Y251 PolarHBondContact O-N 3.25Å
248S96.4Very high95.6Very high0 Ų024.1 Ų24.10%014%0.14CC..Hα-helixtrans-59.3-36.9175.8800000112.5F132 T136 L244 V245 C246 I250 Y251 M252F132-S248 VanDerWaalsContact O-CB 3.27Å; F132-S248 WeakPolarHBondContact O-CB 3.36Å; T136-S248 PolarHBondContact N-OG 2.85Å; T136-S248 PolarHBondContact OG1-OG 3.26Å; L244-S248 WeakPolarHBondContact O-CB 3.15Å; L244-S248 PolarHBondContact O-N 3.24Å; V245-S248 WeakPolarHBondContact O-CB 3.24Å; V245-S248 PolarHBondContact O-N 3.47Å; V245-S248 PolarHBondContact O-OG 3.14Å; C246-S248 VanDerWaalsContact C-N 3.31Å; C246-S248 PolarHBondContact O-N 3.24Å; S248-I250 PolarHBondContact O-N 3.41Å; S248-Y251 WeakPolarHBondContact O-CB 3.45Å; S248-Y251 PolarHBondContact O-N 2.8Å; S248-M252 VanDerWaalsContact O-CG 3.25Å; S248-M252 WeakPolarHBondContact O-CG 3.42Å; S248-M252 PolarHBondContact O-N 2.89Å
249R95.6Very high95.5Very high0 Ų022.2 Ų22.20%013%0.13CC..Hα-helixtrans-70.2-32.9-179.4-61.3-40.2-71.2154.3-5113.2T136 E195 H208 V245 C246 L247 M254 H255 I260T136-R249 PolarHBondContact OG1-NH1 3.24Å; E195-R249 IonicContact OE2-CZ 3.22Å; E195-R249 VanDerWaalsContact OE2-CZ 3.22Å; E195-R249 IonicContact OE2-NH1 2.7Å; E195-R249 PolarHBondContact OE2-NH1 3.07Å; E195-R249 IonicContact OE2-NH2 2.8Å; E195-R249 PolarHBondContact OE2-NH2 3.41Å; H208-R249 VanDerWaalsContact CB-CD 3.49Å; H208-R249 HydrophobicContact CB-CG 3.77Å; V245-R249 WeakPolarHBondContact O-CG 3.37Å; V245-R249 PolarHBondContact O-N 3.21Å; C246-R249 PolarHBondContact O-N 3.22Å; L247-R249 VanDerWaalsContact C-N 3.26Å; L247-R249 PolarHBondContact O-N 2.98Å; R249-M254 PolarHBondContact O-N 3.19Å; R249-H255 HydrophobicContact CB-CB 4.28Å; R249-H255 PolarHBondContact O-N 3.43Å; R249-I260 HydrophobicContact CB-CD1 3.71Å; R249-I260 HydrophobicContact CG-CD1 4.27Å
250I94.9Very high95.5Very high16 Ų1619.9 Ų19.98%0.08211%0.114CC..Hα-helixtrans-71-43.5171.4-54.4173.8000109.1V20 F23 L247 S248 M252 G253 I257 I260V20-I250 HydrophobicContact CB-CG2 4.4Å; V20-I250 HydrophobicContact CG1-CG2 4.04Å; V20-I250 WeakPolarHBondContact CG1-O 3.14Å; V20-I250 HydrophobicContact CG2-CG2 4.33Å; F23-I250 HydrophobicContact CB-CG2 4.15Å; F23-I250 HydrophobicContact CD1-CB 3.97Å; F23-I250 HydrophobicContact CD1-CG2 3.48Å; F23-I250 VanDerWaalsContact CD1-CG2 3.48Å; F23-I250 HydrophobicContact CE1-CB 4.1Å; F23-I250 HydrophobicContact CE1-CG2 4.12Å; F23-I250 HydrophobicContact CG-CG2 4Å; L247-I250 PolarHBondContact O-N 3.03Å; S248-I250 PolarHBondContact O-N 3.41Å; I250-M252 PolarHBondContact O-N 3.48Å; I250-G253 PolarHBondContact O-N 2.83Å; I250-G253 VanDerWaalsContact O-N 3.08Å; I250-I257 HydrophobicContact CD1-CG1 4.2Å; I250-I260 HydrophobicContact CD1-CG1 4.3Å; I250-I260 HydrophobicContact CG1-CG1 4Å
251Y93.7Very high95.5Very high0 Ų019.4 Ų19.40%011%0.105CC..Hα-helixtrans-59.3-43.6177.7-176.9-95.7000112.3Q24 C27 V29 Y129 F132 L194 L247 S248 G253Q24-Y251 PolarHBondContact NE2-O 3.24Å; C27-Y251 HydrophobicContact CB-CD2 3.61Å; C27-Y251 HydrophobicContact CB-CE2 3.41Å; C27-Y251 VanDerWaalsContact CB-CE2 3.41Å; V29-Y251 HydrophobicContact CG2-CD2 4.28Å; V29-Y251 HydrophobicContact CG2-CE1 4.19Å; V29-Y251 HydrophobicContact CG2-CE2 3.39Å; V29-Y251 WeakPolarHBondContact CG2-OH 3.23Å; Y129-Y251 WeakPolarHBondContact CA-OH 3.47Å; Y129-Y251 WeakPolarHBondContact CB-OH 3.42Å; Y129-Y251 HydrophobicContact CD2-CE1 4.01Å; F132-Y251 HydrophobicContact CB-CD1 3.48Å; F132-Y251 VanDerWaalsContact CB-CD1 3.48Å; F132-Y251 HydrophobicContact CB-CE1 4.02Å; F132-Y251 HydrophobicContact CB-CG 3.77Å; F132-Y251 AromaticContact CD2-CD1 3.78Å; F132-Y251 HydrophobicContact CD2-CD1 3.78Å; F132-Y251 AromaticContact CD2-CD2 3.25Å; F132-Y251 HydrophobicContact CD2-CD2 3.25Å; F132-Y251 HydrophobicContact CD2-CE1 4.14Å; F132-Y251 AromaticContact CD2-CE2 3.68Å; F132-Y251 HydrophobicContact CD2-CE2 3.68Å; F132-Y251 AromaticContact CD2-CG 3.3Å; F132-Y251 HydrophobicContact CD2-CG 3.3Å; F132-Y251 AromaticContact CE2-CD2 3.61Å; F132-Y251 HydrophobicContact CE2-CD2 3.61Å; F132-Y251 HydrophobicContact CE2-CE2 4.13Å; F132-Y251 HydrophobicContact CE2-CG 4.01Å; F132-Y251 AromaticContact CG-CD1 3.94Å; F132-Y251 HydrophobicContact CG-CD1 3.94Å; F132-Y251 HydrophobicContact CG-CD2 4.12Å; F132-Y251 AromaticContact CG-CG 3.68Å; F132-Y251 HydrophobicContact CG-CG 3.68Å; L194-Y251 HydrophobicContact CD1-CD1 3.96Å; L194-Y251 HydrophobicContact CD1-CE1 3.61Å; L247-Y251 WeakPolarHBondContact O-CB 3.46Å; L247-Y251 PolarHBondContact O-N 3.25Å; S248-Y251 WeakPolarHBondContact O-CB 3.45Å; S248-Y251 PolarHBondContact O-N 2.8Å; Y251-G253 PolarHBondContact O-N 3.04Å
252M90.8Very high95.4Very high10 Ų1018.8 Ų18.85%0.04911%0.108CC..THydrogen-bonded Turntrans-69.4-10.7178.3-66.3-57.6173.100113.7F132 C133 L194 E195 S248 I250 M254F132-M252 WeakPolarHBondContact O-CE 3.29Å; C133-M252 HydrophobicContact CB-CE 4.28Å; L194-M252 HydrophobicContact CB-SD 3.79Å; L194-M252 HydrophobicContact CD1-SD 4.16Å; L194-M252 PolarHBondContact N-O 2.78Å; E195-M252 HydrophobicContact CB-CB 4.5Å; S248-M252 VanDerWaalsContact O-CG 3.25Å; S248-M252 WeakPolarHBondContact O-CG 3.42Å; S248-M252 PolarHBondContact O-N 2.89Å; I250-M252 PolarHBondContact O-N 3.48Å; M252-M254 VanDerWaalsContact C-N 3.3Å; M252-M254 HydrophobicContact CB-CG 4.02Å
253G89.8Confident95.4Very high0 Ų018.3 Ų18.30%010%0.104CC..THydrogen-bonded Turntrans76.915.7-179.600000114.1I250 Y251I250-G253 PolarHBondContact O-N 2.83Å; I250-G253 VanDerWaalsContact O-N 3.08Å; Y251-G253 PolarHBondContact O-N 3.04Å
254M89.4Confident95.5Very high0 Ų019.1 Ų19.10%010%0.101CC..SBendtrans-90.4-25.9-173.9-62.9-50.4-7500113.1R185 P186 E195 S203 R249 M252R185-M254 WeakPolarHBondContact CD-O 3.18Å; R185-M254 PolarHBondContact NH1-O 3.38Å; P186-M254 WeakPolarHBondContact CD-O 3.46Å; E195-M254 HydrophobicContact CB-CG 4.06Å; E195-M254 HydrophobicContact CB-SD 4.17Å; S203-M254 PolarHBondContact OG-O 3.47Å; R249-M254 PolarHBondContact O-N 3.19Å; M252-M254 VanDerWaalsContact C-N 3.3Å; M252-M254 HydrophobicContact CB-CG 4.02Å
255H94Very high95.5Very high1 Ų122.5 Ų22.51%0.00512%0.118CC..  trans-136.5145.4-174.3-71.2-80.7000111.7R185 S203 S206 R249 D259 I260R185-H255 PolarHBondContact NH1-CD2 2.97Å; R185-H255 VanDerWaalsContact NH1-CD2 3.31Å; R185-H255 PolarHBondContact NH1-CE1 2.94Å; R185-H255 PolarHBondContact NH1-ND1 3.24Å; R185-H255 PolarHBondContact NH1-NE2 3.38Å; S203-H255 PolarHBondContact O-CE1 3.3Å; S203-H255 PolarHBondContact O-ND1 3Å; S203-H255 PolarHBondContact OG-ND1 3.49Å; S206-H255 VanDerWaalsContact CA-CE1 3.45Å; S206-H255 WeakPolarHBondContact CA-CE1 3.43Å; S206-H255 PolarHBondContact OG-NE2 3.17Å; R249-H255 HydrophobicContact CB-CB 4.28Å; R249-H255 PolarHBondContact O-N 3.43Å; H255-D259 HydrophobicContact CB-CB 4.04Å; H255-D259 IonicContact ND1-OD2 3.99Å; H255-I260 HydrophobicContact CB-CD1 3.93Å; H255-I260 HydrophobicContact CB-CG1 4.35Å
256S95.4Very high95.5Very high2 Ų225.1 Ų25.11%0.01413%0.129CC..  trans-77.3167.2167.8710000111L258 D259 I260S256-L258 PolarHBondContact O-N 3.24Å; S256-D259 WeakPolarHBondContact CB-OD2 3.35Å; S256-D259 PolarHBondContact N-OD2 3.43Å; S256-D259 PolarHBondContact O-N 2.94Å; S256-D259 PolarHBondContact OG-N 3.13Å; S256-D259 PolarHBondContact OG-OD1 2.97Å; S256-D259 PolarHBondContact OG-OD2 2.84Å; S256-I260 WeakPolarHBondContact O-CG1 3.33Å; S256-I260 PolarHBondContact O-N 3.38Å
257I95.9Very high95.6Very high50 Ų5024.5 Ų24.526%0.25612%0.124SC..Hα-helixtrans-62.6-35.3176.3-58.9172.7000110.4L14 K19 I250 I260 I261L14-I257 HydrophobicContact CD2-CB 4.48Å; L14-I257 HydrophobicContact CD2-CG2 3.96Å; L14-I257 PolarHBondContact O-N 3.44Å; K19-I257 HydrophobicContact CB-CD1 4.01Å; K19-I257 HydrophobicContact CD-CD1 3.98Å; I250-I257 HydrophobicContact CD1-CG1 4.2Å; I257-I260 PolarHBondContact O-N 2.91Å; I257-I261 HydrophobicContact CG2-CD1 3.84Å; I257-I261 HydrophobicContact CG2-CG1 4.39Å; I257-I261 WeakPolarHBondContact O-CG1 3.49Å; I257-I261 PolarHBondContact O-N 3.47Å
258L96.3Very high95.7Very high20 Ų2024.4 Ų24.411%0.10512%0.123CC..Hα-helixtrans-61.2-43.7176.8-176.763.4000112.1V11 L14 Q15 W183 M204 S256 I260 I261 A262V11-L258 HydrophobicContact CG1-CD2 3.82Å; L14-L258 HydrophobicContact CB-CB 3.84Å; L14-L258 HydrophobicContact CB-CD1 4.31Å; L14-L258 HydrophobicContact CD1-CD1 4.17Å; L14-L258 PolarHBondContact O-N 2.91Å; Q15-L258 HydrophobicContact CB-CD2 4.41Å; W183-L258 HydrophobicContact CZ2-CD2 4.35Å; M204-L258 HydrophobicContact CE-CD1 4.46Å; M204-L258 HydrophobicContact CE-CD2 4.36Å; M204-L258 HydrophobicContact CE-CG 4.02Å; S256-L258 PolarHBondContact O-N 3.24Å; L258-I260 PolarHBondContact O-N 3.5Å; L258-I261 PolarHBondContact O-N 2.73Å; L258-A262 VanDerWaalsContact O-CB 3.32Å; L258-A262 WeakPolarHBondContact O-CB 3.38Å; L258-A262 PolarHBondContact O-N 3.28Å
259D96.4Very high95.8Very high1 Ų129.2 Ų29.21%0.00515%0.149CC..Hα-helixtrans-62.3-35.8-179.2-54.2-35.3000111.7S203 M204 S206 H255 S256 G263S203-D259 VanDerWaalsContact OG-CG 3.27Å; S203-D259 PolarHBondContact OG-OD2 3.32Å; M204-D259 WeakPolarHBondContact CB-OD1 3.34Å; S206-D259 PolarHBondContact N-O 2.92Å; H255-D259 HydrophobicContact CB-CB 4.04Å; H255-D259 IonicContact ND1-OD2 3.99Å; S256-D259 WeakPolarHBondContact CB-OD2 3.35Å; S256-D259 PolarHBondContact N-OD2 3.43Å; S256-D259 PolarHBondContact O-N 2.94Å; S256-D259 PolarHBondContact OG-N 3.13Å; S256-D259 PolarHBondContact OG-OD1 2.97Å; S256-D259 PolarHBondContact OG-OD2 2.84Å; D259-G263 PolarHBondContact O-N 3.36Å
260I97.4Very high95.9Very high15 Ų1529.5 Ų29.58%0.07715%0.15CC..Hα-helixtrans-70.5-49.3177.1-58.9-58.7000111.1A209 C246 R249 I250 H255 S256 I257 L258 A262 G263 F264A209-I260 HydrophobicContact CB-CD1 3.94Å; A209-I260 HydrophobicContact CB-CG2 4.31Å; C246-I260 HydrophobicContact CB-CG2 3.6Å; R249-I260 HydrophobicContact CB-CD1 3.71Å; R249-I260 HydrophobicContact CG-CD1 4.27Å; I250-I260 HydrophobicContact CD1-CG1 4.3Å; I250-I260 HydrophobicContact CG1-CG1 4Å; H255-I260 HydrophobicContact CB-CD1 3.93Å; H255-I260 HydrophobicContact CB-CG1 4.35Å; S256-I260 WeakPolarHBondContact O-CG1 3.33Å; S256-I260 PolarHBondContact O-N 3.38Å; I257-I260 PolarHBondContact O-N 2.91Å; L258-I260 PolarHBondContact O-N 3.5Å; I260-A262 VanDerWaalsContact C-N 3.28Å; I260-A262 PolarHBondContact O-N 3.42Å; I260-G263 PolarHBondContact O-N 3.15Å; I260-F264 WeakPolarHBondContact O-CB 3.43Å; I260-F264 PolarHBondContact O-N 2.89Å
261I97Very high96.1Very high69 Ų6929.4 Ų29.435%0.35415%0.149SC..Hα-helixtrans-60-43.5178-68.9169.1000110.2L14 I257 L258 F264 L265L14-I261 HydrophobicContact CD1-CD1 4.06Å; L14-I261 HydrophobicContact CD2-CD1 4.22Å; I257-I261 HydrophobicContact CG2-CD1 3.84Å; I257-I261 HydrophobicContact CG2-CG1 4.39Å; I257-I261 WeakPolarHBondContact O-CG1 3.49Å; I257-I261 PolarHBondContact O-N 3.47Å; L258-I261 PolarHBondContact O-N 2.73Å; I261-F264 PolarHBondContact O-N 3.41Å; I261-L265 HydrophobicContact CG2-CD1 3.8Å; I261-L265 HydrophobicContact CG2-CG 4.29Å; I261-L265 WeakPolarHBondContact O-CB 3.1Å; I261-L265 WeakPolarHBondContact O-CG 3.31Å; I261-L265 PolarHBondContact O-N 3.13Å
262A97.4Very high96.3Very high23 Ų2332.7 Ų32.719%0.1918%0.177CC..Hα-helixtrans-63.3-45.4177.600000112.2M204 L258 I260 Y266M204-A262 HydrophobicContact CE-CB 3.26Å; M204-A262 HydrophobicContact CG-CB 4.2Å; L258-A262 VanDerWaalsContact O-CB 3.32Å; L258-A262 WeakPolarHBondContact O-CB 3.38Å; L258-A262 PolarHBondContact O-N 3.28Å; I260-A262 VanDerWaalsContact C-N 3.28Å; I260-A262 PolarHBondContact O-N 3.42Å; A262-Y266 WeakPolarHBondContact O-CB 3.34Å; A262-Y266 PolarHBondContact O-N 3.31Å
263G97.8Very high96.6Very high0 Ų035.7 Ų35.70%020%0.195CC..Hα-helixtrans-61.3-44.1175.900000113M210 D259 I260 T267M210-G263 WeakPolarHBondContact CG-O 3.35Å; D259-G263 PolarHBondContact O-N 3.36Å; I260-G263 PolarHBondContact O-N 3.15Å; G263-T267 WeakPolarHBondContact O-CB 3.46Å; G263-T267 PolarHBondContact O-N 2.88Å; G263-T267 PolarHBondContact O-OG1 2.89Å
264F97.9Very high97Very high78 Ų7839.3 Ų39.334%0.34221%0.211SC..Hα-helixtrans-59.6-56.8176.2177.2-93.4000111.5T213 I260 I261 Y266 T267 I268T213-F264 HydrophobicContact CG2-CD2 3.57Å; T213-F264 HydrophobicContact CG2-CE2 3.7Å; T213-F264 HydrophobicContact CG2-CG 4.45Å; T213-F264 WeakPolarHBondContact OG1-CD2 3.33Å; I260-F264 WeakPolarHBondContact O-CB 3.43Å; I260-F264 PolarHBondContact O-N 2.89Å; I261-F264 PolarHBondContact O-N 3.41Å; F264-Y266 VanDerWaalsContact C-N 3.31Å; F264-Y266 PolarHBondContact O-N 2.86Å; F264-T267 WeakPolarHBondContact O-CB 3.41Å; F264-T267 PolarHBondContact O-N 2.77Å; F264-T267 VanDerWaalsContact O-N 3.16Å; F264-I268 HydrophobicContact CD1-CG1 4.48Å; F264-I268 HydrophobicContact CE1-CG1 4.09Å; F264-I268 HydrophobicContact CZ-CD1 4.36Å; F264-I268 HydrophobicContact CZ-CG1 4.22Å; F264-I268 WeakPolarHBondContact O-CG1 3.34Å; F264-I268 PolarHBondContact O-N 3.15Å; F264-I268 VanDerWaalsContact O-N 3.08Å
265L98.1Very high97.4Very high104 Ų10442.5 Ų42.555%0.54522%0.224SC..Hα-helixtrans-62.9-38.7-178.2-68177.4000112.1I261 T267 I268 L269I261-L265 HydrophobicContact CG2-CD1 3.8Å; I261-L265 HydrophobicContact CG2-CG 4.29Å; I261-L265 WeakPolarHBondContact O-CB 3.1Å; I261-L265 WeakPolarHBondContact O-CG 3.31Å; I261-L265 PolarHBondContact O-N 3.13Å; L265-T267 VanDerWaalsContact C-N 3.3Å; L265-T267 PolarHBondContact O-N 3.43Å; L265-I268 PolarHBondContact O-N 2.83Å; L265-L269 PolarHBondContact O-N 3.32Å
266Y98.4Very high97.5Very high55 Ų5546.7 Ų46.722%0.21625%0.251CS..Hα-helixtrans-65.6-36.9177.8-172.9-145.2000111.7L173 T177 P205 M210 A262 F264 L269 I270L173-Y266 HydrophobicContact CB-CE1 4.46Å; T177-Y266 HydrophobicContact CG2-CE1 4.28Å; T177-Y266 WeakPolarHBondContact OG1-CE1 3.28Å; T177-Y266 PolarHBondContact OG1-OH 2.92Å; P205-Y266 HydrophobicContact CG-CD1 4.07Å; M210-Y266 HydrophobicContact CE-CD1 3.44Å; M210-Y266 VanDerWaalsContact CE-CD1 3.44Å; M210-Y266 HydrophobicContact CE-CE1 3.83Å; M210-Y266 HydrophobicContact CE-CG 4.34Å; M210-Y266 HydrophobicContact SD-CD1 4.08Å; A262-Y266 WeakPolarHBondContact O-CB 3.34Å; A262-Y266 PolarHBondContact O-N 3.31Å; F264-Y266 VanDerWaalsContact C-N 3.31Å; F264-Y266 PolarHBondContact O-N 2.86Å; Y266-L269 HydrophobicContact CD2-CD2 4.27Å; Y266-L269 WeakPolarHBondContact O-CB 3.46Å; Y266-L269 PolarHBondContact O-N 2.67Å; Y266-I270 HydrophobicContact CD1-CD1 4.04Å; Y266-I270 HydrophobicContact CD2-CD1 4.2Å; Y266-I270 HydrophobicContact CD2-CG1 4.18Å; Y266-I270 HydrophobicContact CE1-CD1 3.85Å; Y266-I270 HydrophobicContact CE2-CD1 4.01Å; Y266-I270 HydrophobicContact CE2-CG1 3.95Å; Y266-I270 HydrophobicContact CG-CD1 4.21Å; Y266-I270 VanDerWaalsContact O-CG1 3.3Å; Y266-I270 WeakPolarHBondContact O-CG1 3.25Å; Y266-I270 PolarHBondContact O-N 3.41Å
267T98.6Very high97.6Very high0 Ų051.6 Ų51.60%027%0.273CS..Hα-helixtrans-64.8-43.2174.2-58.40000112V170 M210 T213 A214 G263 F264 L265 L269 I270 L271V170-T267 HydrophobicContact CG1-CG2 4.39Å; V170-T267 HydrophobicContact CG2-CG2 4.49Å; M210-T267 WeakPolarHBondContact CA-OG1 3.44Å; M210-T267 VanDerWaalsContact CB-OG1 3.23Å; M210-T267 WeakPolarHBondContact CB-OG1 3.45Å; M210-T267 WeakPolarHBondContact CG-OG1 3.17Å; M210-T267 PolarHBondContact O-OG1 2.98Å; T213-T267 HydrophobicContact CG2-CG2 3.94Å; A214-T267 HydrophobicContact CB-CG2 3.6Å; G263-T267 WeakPolarHBondContact O-CB 3.46Å; G263-T267 PolarHBondContact O-N 2.88Å; G263-T267 PolarHBondContact O-OG1 2.89Å; F264-T267 WeakPolarHBondContact O-CB 3.41Å; F264-T267 PolarHBondContact O-N 2.77Å; F264-T267 VanDerWaalsContact O-N 3.16Å; L265-T267 VanDerWaalsContact C-N 3.3Å; L265-T267 PolarHBondContact O-N 3.43Å; T267-L269 VanDerWaalsContact C-N 3.26Å; T267-L269 PolarHBondContact O-N 2.83Å; T267-I270 PolarHBondContact O-N 3.06Å; T267-L271 HydrophobicContact CG2-CD1 4.23Å; T267-L271 HydrophobicContact CG2-CG 4.33Å; T267-L271 WeakPolarHBondContact O-CB 3.41Å; T267-L271 WeakPolarHBondContact O-CG 3.38Å; T267-L271 PolarHBondContact O-N 3.08Å
268I98.4Very high97.7Very high68 Ų6849.4 Ų49.435%0.34926%0.261SS..Hα-helixtrans-59.3-41.2174.9-60.7-56.2000110.6T213 I217 F264 L265 L271 A272T213-I268 HydrophobicContact CG2-CD1 4.07Å; I217-I268 HydrophobicContact CD1-CD1 3.53Å; F264-I268 HydrophobicContact CD1-CG1 4.48Å; F264-I268 HydrophobicContact CE1-CG1 4.09Å; F264-I268 HydrophobicContact CZ-CD1 4.36Å; F264-I268 HydrophobicContact CZ-CG1 4.22Å; F264-I268 WeakPolarHBondContact O-CG1 3.34Å; F264-I268 PolarHBondContact O-N 3.15Å; F264-I268 VanDerWaalsContact O-N 3.08Å; L265-I268 PolarHBondContact O-N 2.83Å; I268-L271 PolarHBondContact O-N 2.88Å; I268-A272 VanDerWaalsContact O-CB 3.3Å; I268-A272 WeakPolarHBondContact O-CB 3.45Å; I268-A272 PolarHBondContact O-N 3.24Å
269L98.4Very high97.6Very high102 Ų10251.5 Ų51.553%0.53427%0.272SS..Hα-helixtrans-62.4-47.6175178.263.3000112L265 Y266 T267 L271 A272 V273L265-L269 PolarHBondContact O-N 3.32Å; Y266-L269 HydrophobicContact CD2-CD2 4.27Å; Y266-L269 WeakPolarHBondContact O-CB 3.46Å; Y266-L269 PolarHBondContact O-N 2.67Å; T267-L269 VanDerWaalsContact C-N 3.26Å; T267-L269 PolarHBondContact O-N 2.83Å; L269-L271 VanDerWaalsContact C-N 3.34Å; L269-L271 PolarHBondContact O-N 3.42Å; L269-A272 PolarHBondContact O-N 2.83Å; L269-V273 HydrophobicContact CD1-CG2 4.24Å; L269-V273 WeakPolarHBondContact O-CG2 3.38Å; L269-V273 PolarHBondContact O-N 3.21Å
270I98.4Very high97.6Very high5 Ų557.1 Ų57.13%0.02630%0.302CS..Hα-helixtrans-59.7-46.5177.7-67.5166.6000110.1L169 V170 L173 M210 Y266 T267 V273 F274L169-I270 HydrophobicContact CD2-CG2 3.74Å; L169-I270 HydrophobicContact CG-CG2 4.01Å; V170-I270 HydrophobicContact CG2-CB 4.45Å; V170-I270 HydrophobicContact CG2-CG2 3.79Å; L173-I270 HydrophobicContact CB-CD1 3.96Å; L173-I270 HydrophobicContact CD1-CD1 3.89Å; L173-I270 HydrophobicContact CD1-CG1 3.89Å; L173-I270 HydrophobicContact CD1-CG2 4.18Å; M210-I270 HydrophobicContact CE-CD1 3.74Å; Y266-I270 HydrophobicContact CD1-CD1 4.04Å; Y266-I270 HydrophobicContact CD2-CD1 4.2Å; Y266-I270 HydrophobicContact CD2-CG1 4.18Å; Y266-I270 HydrophobicContact CE1-CD1 3.85Å; Y266-I270 HydrophobicContact CE2-CD1 4.01Å; Y266-I270 HydrophobicContact CE2-CG1 3.95Å; Y266-I270 HydrophobicContact CG-CD1 4.21Å; Y266-I270 VanDerWaalsContact O-CG1 3.3Å; Y266-I270 WeakPolarHBondContact O-CG1 3.25Å; Y266-I270 PolarHBondContact O-N 3.41Å; T267-I270 PolarHBondContact O-N 3.06Å; I270-V273 PolarHBondContact O-N 3.34Å; I270-F274 HydrophobicContact CG2-CD2 3.97Å; I270-F274 WeakPolarHBondContact O-CB 3.27Å; I270-F274 WeakPolarHBondContact O-CD2 3.19Å; I270-F274 PolarHBondContact O-N 3.18Å
271L98.5Very high97.6Very high14 Ų1459.4 Ų59.47%0.07331%0.314CS..Hα-helixtrans-62.1-45.9177.4-70.8179.4000111.6I166 I217 S218 T267 I268 L269 V273 F274 Y275I166-L271 HydrophobicContact CG2-CD2 3.55Å; I217-L271 HydrophobicContact CB-CD1 4.07Å; I217-L271 HydrophobicContact CD1-CD1 4.37Å; I217-L271 HydrophobicContact CG2-CD1 3.72Å; S218-L271 WeakPolarHBondContact OG-CD2 3.43Å; T267-L271 HydrophobicContact CG2-CD1 4.23Å; T267-L271 HydrophobicContact CG2-CG 4.33Å; T267-L271 WeakPolarHBondContact O-CB 3.41Å; T267-L271 WeakPolarHBondContact O-CG 3.38Å; T267-L271 PolarHBondContact O-N 3.08Å; I268-L271 PolarHBondContact O-N 2.88Å; L269-L271 VanDerWaalsContact C-N 3.34Å; L269-L271 PolarHBondContact O-N 3.42Å; L271-V273 PolarHBondContact O-N 3.07Å; L271-F274 PolarHBondContact O-N 3.15Å; L271-Y275 WeakPolarHBondContact O-CA 3.5Å; L271-Y275 WeakPolarHBondContact O-CB 3.48Å; L271-Y275 PolarHBondContact O-N 3.38Å
272A98.1Very high97.5Very high70 Ų7056.3 Ų56.358%0.57930%0.298SS*.Hα-helixtrans-58.7-36.7179.100000112.6I268 L269I268-A272 VanDerWaalsContact O-CB 3.3Å; I268-A272 WeakPolarHBondContact O-CB 3.45Å; I268-A272 PolarHBondContact O-N 3.24Å; L269-A272 PolarHBondContact O-N 2.83Å
273V97.9Very high97.4Very high72 Ų7259 Ų5944%0.43631%0.309SS..Hα-helixtrans-80.7-46.9179.6174.80000111.8L269 I270 L271 F277L269-V273 HydrophobicContact CD1-CG2 4.24Å; L269-V273 WeakPolarHBondContact O-CG2 3.38Å; L269-V273 PolarHBondContact O-N 3.21Å; I270-V273 PolarHBondContact O-N 3.34Å; L271-V273 PolarHBondContact O-N 3.07Å; V273-F277 VanDerWaalsContact O-CD2 3.27Å; V273-F277 WeakPolarHBondContact O-CD2 3.48Å; V273-F277 WeakPolarHBondContact O-CE2 3.43Å
274F97.2Very high97.3Very high76 Ų7662 Ų6233%0.33332%0.322SS..Hα-helixtrans-102.5-22.2-164.9-69.6-84.2000115L169 L173 I270 L271 P276 F277 V278L169-F274 HydrophobicContact CD1-CD1 4.36Å; L169-F274 HydrophobicContact CD1-CE1 4.33Å; L169-F274 HydrophobicContact CD1-CE2 4.48Å; L169-F274 HydrophobicContact CD1-CG 4.45Å; L169-F274 HydrophobicContact CD1-CZ 4.38Å; L169-F274 HydrophobicContact CD2-CB 3.21Å; L169-F274 HydrophobicContact CD2-CD1 3.79Å; L169-F274 HydrophobicContact CD2-CD2 3.64Å; L169-F274 HydrophobicContact CD2-CE2 4.38Å; L169-F274 HydrophobicContact CD2-CG 3.29Å; L169-F274 HydrophobicContact CG-CD2 4.48Å; L169-F274 HydrophobicContact CG-CG 4.41Å; L173-F274 HydrophobicContact CD1-CE2 4.08Å; I270-F274 HydrophobicContact CG2-CD2 3.97Å; I270-F274 WeakPolarHBondContact O-CB 3.27Å; I270-F274 WeakPolarHBondContact O-CD2 3.19Å; I270-F274 PolarHBondContact O-N 3.18Å; L271-F274 PolarHBondContact O-N 3.15Å; F274-P276 VanDerWaalsContact C-CD 3.41Å; F274-P276 VanDerWaalsContact C-N 3.32Å; F274-F277 PolarHBondContact O-N 3.5Å; F274-V278 PolarHBondContact O-N 3.25Å
275Y97.5Very high97.2Very high68 Ų6859.1 Ų59.127%0.26731%0.31SS..G310 helixtrans-52.9-42.7176.7178.7-100.4000113.2I166 L221 L222 L271 F277 V278I166-Y275 HydrophobicContact CD1-CD2 4.1Å; L221-Y275 HydrophobicContact CB-CE2 3.76Å; L221-Y275 HydrophobicContact CD1-CD1 4.49Å; L221-Y275 HydrophobicContact CD1-CD2 4.11Å; L221-Y275 HydrophobicContact CD1-CE1 4.4Å; L221-Y275 HydrophobicContact CD1-CE2 4Å; L221-Y275 HydrophobicContact CD1-CG 4.35Å; L221-Y275 PolarHBondContact O-OH 2.77Å; L222-Y275 HydrophobicContact CD2-CE2 3.99Å; L222-Y275 HydrophobicContact CG-CE2 4.27Å; L271-Y275 WeakPolarHBondContact O-CA 3.5Å; L271-Y275 WeakPolarHBondContact O-CB 3.48Å; L271-Y275 PolarHBondContact O-N 3.38Å; Y275-F277 PolarHBondContact O-N 3.16Å; Y275-V278 WeakPolarHBondContact O-CB 3.35Å; Y275-V278 WeakPolarHBondContact O-CG2 3.44Å; Y275-V278 PolarHBondContact O-N 3.3Å; Y275-V278 VanDerWaalsContact O-N 3.1Å
276P97.4Very high97Very high88 Ų8854.7 Ų54.757%0.57129%0.287SS*.G310 helixtrans-59.6-20.8177.3-24.936000114.8F274F274-P276 VanDerWaalsContact C-CD 3.41Å; F274-P276 VanDerWaalsContact C-N 3.32Å
277F97.4Very high96.8Very high106 Ų10655.7 Ų55.747%0.46530%0.299SS..G310 helixtrans-98-6.1-178.5-57.4-77.5000113.3V273 F274 Y275 D279 L280 I281V273-F277 VanDerWaalsContact O-CD2 3.27Å; V273-F277 WeakPolarHBondContact O-CD2 3.48Å; V273-F277 WeakPolarHBondContact O-CE2 3.43Å; F274-F277 PolarHBondContact O-N 3.5Å; Y275-F277 PolarHBondContact O-N 3.16Å; F277-D279 VanDerWaalsContact C-N 3.29Å; F277-D279 PolarHBondContact O-N 3.06Å; F277-L280 HydrophobicContact CD1-CD2 4.44Å; F277-L280 WeakPolarHBondContact O-CB 3.1Å; F277-L280 PolarHBondContact O-N 3.14Å; F277-L280 VanDerWaalsContact O-N 3.14Å; F277-I281 HydrophobicContact CB-CD1 4.29Å; F277-I281 VanDerWaalsContact O-CG1 3.29Å; F277-I281 WeakPolarHBondContact O-CG1 3.2Å; F277-I281 PolarHBondContact O-N 3.16Å
278V97.1Very high96.6Very high3 Ų359.3 Ų59.32%0.01832%0.316CS..Hα-helixtrans-59.2-42.2-176.2170.80000111.3R162 I166 F274 Y275 I281 D282R162-V278 HydrophobicContact CB-CG1 3.64Å; R162-V278 HydrophobicContact CG-CG1 3.77Å; I166-V278 HydrophobicContact CD1-CG1 4.38Å; I166-V278 HydrophobicContact CD1-CG2 3.92Å; I166-V278 HydrophobicContact CG1-CG1 4.35Å; I166-V278 HydrophobicContact CG1-CG2 3.53Å; F274-V278 PolarHBondContact O-N 3.25Å; Y275-V278 WeakPolarHBondContact O-CB 3.35Å; Y275-V278 WeakPolarHBondContact O-CG2 3.44Å; Y275-V278 PolarHBondContact O-N 3.3Å; Y275-V278 VanDerWaalsContact O-N 3.1Å; V278-I281 PolarHBondContact O-N 2.8Å; V278-D282 WeakPolarHBondContact O-CB 3.49Å; V278-D282 PolarHBondContact O-N 2.94Å
279D94.6Very high96.4Very high64 Ų6463.7 Ų63.734%0.34233%0.332SS..Hα-helixtrans-65.9-40.8178.4-73.825.5000111.4R162 F277 N283R162-D279 IonicContact CZ-OD1 3.29Å; R162-D279 IonicContact CZ-OD2 3.73Å; R162-D279 IonicContact NE-OD1 3.1Å; R162-D279 IonicContact NH1-OD1 3.14Å; R162-D279 PolarHBondContact NH1-OD1 3Å; R162-D279 IonicContact NH1-OD2 3.26Å; R162-D279 PolarHBondContact NH1-OD2 3.18Å; R162-D279 IonicContact NH2-OD1 2.71Å; R162-D279 IonicContact NH2-OD2 3.62Å; R162-D279 PolarHBondContact NH2-OD2 2.9Å; F277-D279 VanDerWaalsContact C-N 3.29Å; F277-D279 PolarHBondContact O-N 3.06Å; D279-N283 VanDerWaalsContact O-CB 3.26Å; D279-N283 WeakPolarHBondContact O-CB 3.39Å; D279-N283 VanDerWaalsContact O-CG 3.27Å; D279-N283 PolarHBondContact O-N 3.35Å; D279-N283 PolarHBondContact O-ND2 3.31Å
280L96.7Very high96.3Very high119 Ų11965 Ų6562%0.62333%0.331SS*.Hα-helixtrans-62.5-44.5175.8178.464.7000111F277 F284F277-L280 HydrophobicContact CD1-CD2 4.44Å; F277-L280 WeakPolarHBondContact O-CB 3.1Å; F277-L280 PolarHBondContact O-N 3.14Å; F277-L280 VanDerWaalsContact O-N 3.14Å; L280-F284 VanDerWaalsContact O-CB 3.31Å; L280-F284 WeakPolarHBondContact O-CB 3Å; L280-F284 PolarHBondContact O-N 2.98Å
281I96.9Very high96.1Very high64 Ų6464.8 Ų64.833%0.32833%0.33SS..Hα-helixtrans-64.8-48.3179.5-66.5163.3000110.7V165 F277 V278 F284 N285V165-I281 HydrophobicContact CG1-CB 4.35Å; V165-I281 HydrophobicContact CG1-CD1 4.27Å; V165-I281 HydrophobicContact CG1-CG2 3.87Å; V165-I281 HydrophobicContact CG2-CG2 4.23Å; F277-I281 HydrophobicContact CB-CD1 4.29Å; F277-I281 VanDerWaalsContact O-CG1 3.29Å; F277-I281 WeakPolarHBondContact O-CG1 3.2Å; F277-I281 PolarHBondContact O-N 3.16Å; V278-I281 PolarHBondContact O-N 2.8Å; I281-F284 PolarHBondContact O-N 3.03Å; I281-N285 WeakPolarHBondContact O-CB 3.45Å; I281-N285 PolarHBondContact O-N 2.97Å; I281-N285 PolarHBondContact O-ND2 3.45Å; I281-N285 PolarHBondContact O-OD1 2.88Å
282D95.6Very high96Very high4 Ų465.7 Ų65.72%0.02134%0.336CS..Hα-helixtrans-63.8-42.7179.8-17662.2000111.7R161 R162 V278 N285 Q286R161-D282 WeakPolarHBondContact CB-OD1 3.45Å; R161-D282 IonicContact NE-OD1 3.9Å; R161-D282 PolarHBondContact NE-OD1 2.94Å; R161-D282 IonicContact NE-OD2 3.24Å; R161-D282 IonicContact NH2-OD2 2.81Å; R162-D282 HydrophobicContact CG-CB 3.99Å; R162-D282 IonicContact NE-OD2 3.57Å; V278-D282 WeakPolarHBondContact O-CB 3.49Å; V278-D282 PolarHBondContact O-N 2.94Å; D282-N285 PolarHBondContact O-N 3.47Å; D282-Q286 WeakPolarHBondContact O-CG 3.2Å; D282-Q286 PolarHBondContact O-N 3.4Å; D282-Q286 PolarHBondContact OD2-NE2 3.46Å
283N94.8Very high96Very high78 Ų7868.4 Ų68.442%0.41734%0.341SS..Hα-helixtrans-63.1-43.9175.5-78.1-52.4000112D279 Q286 T287D279-N283 VanDerWaalsContact O-CB 3.26Å; D279-N283 WeakPolarHBondContact O-CB 3.39Å; D279-N283 VanDerWaalsContact O-CG 3.27Å; D279-N283 PolarHBondContact O-N 3.35Å; D279-N283 PolarHBondContact O-ND2 3.31Å; N283-Q286 PolarHBondContact O-N 3.29Å; N283-T287 WeakPolarHBondContact O-CB 3.34Å; N283-T287 PolarHBondContact O-N 3.25Å; N283-T287 PolarHBondContact O-OG1 2.83Å
284F96.6Very high95.9Very high65 Ų6568.8 Ų68.829%0.28534%0.339SS..Hα-helixtrans-59.1-47.7174.6172.7-93.7000111.2L280 I281 Q286 T287 H288 A291 I294L280-F284 VanDerWaalsContact O-CB 3.31Å; L280-F284 WeakPolarHBondContact O-CB 3Å; L280-F284 PolarHBondContact O-N 2.98Å; I281-F284 PolarHBondContact O-N 3.03Å; F284-Q286 VanDerWaalsContact C-N 3.26Å; F284-Q286 PolarHBondContact O-N 3.04Å; F284-T287 PolarHBondContact O-N 3.1Å; F284-H288 HydrophobicContact CD2-CB 3.76Å; F284-H288 HydrophobicContact CE2-CB 3.76Å; F284-H288 AromaticContact CE2-CD2 3.87Å; F284-H288 AromaticContact CE2-CG 3.58Å; F284-H288 AromaticContact CE2-ND1 3.91Å; F284-H288 HydrophobicContact CG-CB 4.42Å; F284-H288 HydrophobicContact CZ-CB 4.41Å; F284-H288 WeakPolarHBondContact O-CB 3.36Å; F284-H288 PolarHBondContact O-N 3.15Å; F284-H288 VanDerWaalsContact O-N 3.15Å; F284-A291 HydrophobicContact CD1-CB 4.5Å; F284-A291 HydrophobicContact CE1-CB 4.16Å; F284-A291 WeakPolarHBondContact O-CB 3.27Å; F284-I294 HydrophobicContact CE1-CB 4.41Å; F284-I294 HydrophobicContact CE1-CG2 4.09Å; F284-I294 HydrophobicContact CE2-CD1 4.5Å; F284-I294 HydrophobicContact CZ-CB 4.19Å; F284-I294 HydrophobicContact CZ-CD1 3.77Å; F284-I294 HydrophobicContact CZ-CG2 3.96Å
285N95.5Very high95.9Very high17 Ų1765.3 Ų65.39%0.09132%0.324CS..Hα-helixtrans-57.9-40.4-179.8-71-16.9000111.7I281 D282 A291 I295 A330 H334I281-N285 WeakPolarHBondContact O-CB 3.45Å; I281-N285 PolarHBondContact O-N 2.97Å; I281-N285 PolarHBondContact O-ND2 3.45Å; I281-N285 PolarHBondContact O-OD1 2.88Å; D282-N285 PolarHBondContact O-N 3.47Å; N285-A291 WeakPolarHBondContact O-CB 3.37Å; N285-I295 HydrophobicContact CB-CD1 4.07Å; N285-I295 WeakPolarHBondContact OD1-CD1 3.47Å; N285-I295 WeakPolarHBondContact OD1-CG1 3.42Å; N285-A330 HydrophobicContact CB-CB 4.33Å; N285-H334 WeakPolarHBondContact O-CB 3.42Å; N285-H334 PolarHBondContact O-ND1 3.05Å
286Q93.2Very high95.8Very high10 Ų1065.5 Ų65.55%0.04733%0.329CS..Hα-helixtrans-78.2-45.7-178.5-70.8-17267.400113.6D282 N283 F284 H334 Y337D282-Q286 WeakPolarHBondContact O-CG 3.2Å; D282-Q286 PolarHBondContact O-N 3.4Å; D282-Q286 PolarHBondContact OD2-NE2 3.46Å; N283-Q286 PolarHBondContact O-N 3.29Å; F284-Q286 VanDerWaalsContact C-N 3.26Å; F284-Q286 PolarHBondContact O-N 3.04Å; Q286-H334 PolarHBondContact O-CE1 3Å; Q286-H334 PolarHBondContact O-ND1 2.76Å; Q286-Y337 HydrophobicContact CB-CD2 4.29Å; Q286-Y337 HydrophobicContact CB-CG 4.11Å; Q286-Y337 WeakPolarHBondContact O-CD1 3.22Å; Q286-Y337 VanDerWaalsContact OE1-CD2 3.3Å
287T93.4Very high95.8Very high76 Ų7663.1 Ų63.147%0.46632%0.321SS..Hα-helixtrans-100.4-26.5-161.961.90000114.5N283 F284 K289 Y337N283-T287 WeakPolarHBondContact O-CB 3.34Å; N283-T287 PolarHBondContact O-N 3.25Å; N283-T287 PolarHBondContact O-OG1 2.83Å; F284-T287 PolarHBondContact O-N 3.1Å; T287-K289 PolarHBondContact O-N 2.99Å; T287-Y337 HydrophobicContact CG2-CE1 3.97Å
288H95.4Very high95.8Very high77 Ų7762.6 Ų62.636%0.35632%0.322SS..  trans-79.4125.6-172-171.8-80.7000111.2F284 Y290 A291 H334F284-H288 HydrophobicContact CD2-CB 3.76Å; F284-H288 HydrophobicContact CE2-CB 3.76Å; F284-H288 AromaticContact CE2-CD2 3.87Å; F284-H288 AromaticContact CE2-CG 3.58Å; F284-H288 AromaticContact CE2-ND1 3.91Å; F284-H288 HydrophobicContact CG-CB 4.42Å; F284-H288 HydrophobicContact CZ-CB 4.41Å; F284-H288 WeakPolarHBondContact O-CB 3.36Å; F284-H288 PolarHBondContact O-N 3.15Å; F284-H288 VanDerWaalsContact O-N 3.15Å; H288-Y290 AromaticContact CE1-CD2 3.9Å; H288-Y290 PolarHBondContact ND1-N 3.38Å; H288-Y290 PolarHBondContact O-N 3.29Å; H288-Y290 VanDerWaalsContact O-N 3.07Å; H288-A291 HydrophobicContact CB-CB 4.19Å; H288-A291 WeakPolarHBondContact O-CB 3.32Å; H288-A291 PolarHBondContact O-N 2.89Å; H288-H334 PolarHBondContact O-CE1 2.87Å
289K94.3Very high95.8Very high160 Ų16063.6 Ų63.670%0.69633%0.327SS*.THydrogen-bonded Turntrans-50.8-38.7-174.9-177.2178-178.9179.80114.6T287T287-K289 PolarHBondContact O-N 2.99Å
290Y95.4Very high95.7Very high130 Ų13064.3 Ų64.351%0.5133%0.33SS..THydrogen-bonded Turntrans-96.310.3-179.7-55.4-65.2000113.7H288 L293 I294H288-Y290 AromaticContact CE1-CD2 3.9Å; H288-Y290 PolarHBondContact ND1-N 3.38Å; H288-Y290 PolarHBondContact O-N 3.29Å; H288-Y290 VanDerWaalsContact O-N 3.07Å; Y290-L293 PolarHBondContact O-N 3.29Å; Y290-I294 WeakPolarHBondContact O-CG1 3.22Å; Y290-I294 PolarHBondContact O-N 2.9Å; Y290-I294 VanDerWaalsContact O-N 3.15Å
291A95.4Very high95.7Very high0 Ų061.3 Ų61.30%032%0.322CS..Hα-helixtrans-54.6-47.5-177.500000112.8F284 N285 H288 L293 I294 I295F284-A291 HydrophobicContact CD1-CB 4.5Å; F284-A291 HydrophobicContact CE1-CB 4.16Å; F284-A291 WeakPolarHBondContact O-CB 3.27Å; N285-A291 WeakPolarHBondContact O-CB 3.37Å; H288-A291 HydrophobicContact CB-CB 4.19Å; H288-A291 WeakPolarHBondContact O-CB 3.32Å; H288-A291 PolarHBondContact O-N 2.89Å; A291-L293 VanDerWaalsContact C-N 3.32Å; A291-L293 PolarHBondContact O-N 2.94Å; A291-I294 PolarHBondContact O-N 2.69Å; A291-I294 VanDerWaalsContact O-N 3.13Å; A291-I295 HydrophobicContact CB-CD1 4.03Å; A291-I295 WeakPolarHBondContact O-CB 3.09Å; A291-I295 WeakPolarHBondContact O-CD1 3.32Å; A291-I295 WeakPolarHBondContact O-CG1 3.38Å; A291-I295 PolarHBondContact O-N 2.96Å
292P96.3Very high95.5Very high32 Ų3260.8 Ų60.821%0.20832%0.32CS..Hα-helixtrans-57.2-42.2-178.3-27.436.3000113.7I296 H334P292-I296 WeakPolarHBondContact O-CB 3.28Å; P292-I296 WeakPolarHBondContact O-CD1 3.25Å; P292-I296 VanDerWaalsContact O-CG1 3.24Å; P292-I296 WeakPolarHBondContact O-CG1 3.49Å; P292-I296 PolarHBondContact O-N 3.4Å; P292-H334 HydrophobicContact CG-CB 4.25Å; P292-H334 VanDerWaalsContact CG-CD2 3.41Å; P292-H334 WeakPolarHBondContact CG-CD2 3.35Å
293L96.4Very high95.3Very high128 Ų12860.8 Ų60.867%0.6732%0.321SS*.Hα-helixtrans-66.6-43.5178.3-66.4176.2000111.6Y290 A291 G297Y290-L293 PolarHBondContact O-N 3.29Å; A291-L293 VanDerWaalsContact C-N 3.32Å; A291-L293 PolarHBondContact O-N 2.94Å; L293-G297 PolarHBondContact O-N 3.43Å
294I97.1Very high95Very high79 Ų7962.4 Ų62.441%0.40533%0.329SS..Hα-helixtrans-67.1-42.5179.1-66167.9000110.6F284 Y290 A291 G297 L298F284-I294 HydrophobicContact CE1-CB 4.41Å; F284-I294 HydrophobicContact CE1-CG2 4.09Å; F284-I294 HydrophobicContact CE2-CD1 4.5Å; F284-I294 HydrophobicContact CZ-CB 4.19Å; F284-I294 HydrophobicContact CZ-CD1 3.77Å; F284-I294 HydrophobicContact CZ-CG2 3.96Å; Y290-I294 WeakPolarHBondContact O-CG1 3.22Å; Y290-I294 PolarHBondContact O-N 2.9Å; Y290-I294 VanDerWaalsContact O-N 3.15Å; A291-I294 PolarHBondContact O-N 2.69Å; A291-I294 VanDerWaalsContact O-N 3.13Å; I294-G297 PolarHBondContact O-N 2.84Å; I294-L298 WeakPolarHBondContact O-CB 3.18Å; I294-L298 PolarHBondContact O-N 2.91Å
295I96.6Very high94.7Very high4 Ų464.6 Ų64.62%0.02134%0.338CS..Hα-helixtrans-59.3-53.1177-70.5159.6000110N285 A291 L298 H299 A327 A330N285-I295 HydrophobicContact CB-CD1 4.07Å; N285-I295 WeakPolarHBondContact OD1-CD1 3.47Å; N285-I295 WeakPolarHBondContact OD1-CG1 3.42Å; A291-I295 HydrophobicContact CB-CD1 4.03Å; A291-I295 WeakPolarHBondContact O-CB 3.09Å; A291-I295 WeakPolarHBondContact O-CD1 3.32Å; A291-I295 WeakPolarHBondContact O-CG1 3.38Å; A291-I295 PolarHBondContact O-N 2.96Å; I295-L298 PolarHBondContact O-N 2.68Å; I295-H299 PolarHBondContact O-N 3.21Å; I295-H299 PolarHBondContact O-ND1 3.39Å; I295-A327 HydrophobicContact CG2-CB 3.99Å; I295-A330 HydrophobicContact CD1-CB 3.82Å; I295-A330 HydrophobicContact CG1-CB 4.45Å; I295-A330 HydrophobicContact CG2-CB 4.02Å
296I96.7Very high94.3Very high71 Ų7163.8 Ų63.836%0.36433%0.334SS..Hα-helixtrans-61.9-47.5-179.5-68.7167.4000109.9P292 L298 H299 L300P292-I296 WeakPolarHBondContact O-CB 3.28Å; P292-I296 WeakPolarHBondContact O-CD1 3.25Å; P292-I296 VanDerWaalsContact O-CG1 3.24Å; P292-I296 WeakPolarHBondContact O-CG1 3.49Å; P292-I296 PolarHBondContact O-N 3.4Å; I296-L298 PolarHBondContact O-N 3.26Å; I296-H299 PolarHBondContact O-N 2.81Å; I296-L300 HydrophobicContact CG2-CD1 3.77Å; I296-L300 HydrophobicContact CG2-CG 4.33Å; I296-L300 WeakPolarHBondContact O-CB 3.49Å; I296-L300 VanDerWaalsContact O-CG 3.23Å; I296-L300 WeakPolarHBondContact O-CG 3.48Å; I296-L300 PolarHBondContact O-N 2.92Å
297G96.8Very high93.7Very high39 Ų3965.1 Ų65.140%0.40234%0.34SS..Hα-helixtrans-59.6-44.8178.400000112.9L293 I294 A301L293-G297 PolarHBondContact O-N 3.43Å; I294-G297 PolarHBondContact O-N 2.84Å; G297-A301 WeakPolarHBondContact O-CB 3.31Å; G297-A301 PolarHBondContact O-N 3.42Å
298L96.5Very high93.2Very high95 Ų9566.3 Ų66.350%0.49735%0.347SS..Hα-helixtrans-63-49.9177.617763.2000111.6I294 I295 I296 L300 A301 L302I294-L298 WeakPolarHBondContact O-CB 3.18Å; I294-L298 PolarHBondContact O-N 2.91Å; I295-L298 PolarHBondContact O-N 2.68Å; I296-L298 PolarHBondContact O-N 3.26Å; L298-L300 VanDerWaalsContact C-N 3.32Å; L298-L300 PolarHBondContact O-N 3.39Å; L298-A301 PolarHBondContact O-N 2.85Å; L298-L302 HydrophobicContact CD1-CD1 4.29Å; L298-L302 HydrophobicContact CD1-CG 4.24Å; L298-L302 HydrophobicContact CG-CD1 4.16Å; L298-L302 HydrophobicContact CG-CG 4.49Å; L298-L302 VanDerWaalsContact O-CG 3.29Å; L298-L302 WeakPolarHBondContact O-CG 3.39Å; L298-L302 PolarHBondContact O-N 3.45Å
299H96.6Very high92.4Very high24 Ų2464.4 Ų64.411%0.11134%0.339CS..Hα-helixtrans-65.6-36.3-178.7-7473.1000111.8I295 I296 G303 L323 A327 Y417I295-H299 PolarHBondContact O-N 3.21Å; I295-H299 PolarHBondContact O-ND1 3.39Å; I296-H299 PolarHBondContact O-N 2.81Å; H299-G303 PolarHBondContact O-N 2.87Å; H299-L323 HydrophobicContact CB-CB 4.35Å; H299-L323 PolarHBondContact CD2-O 3.08Å; H299-A327 HydrophobicContact CB-CB 4.08Å; H299-Y417 HydrophobicContact CB-CE2 4.19Å
300L94.5Very high91.1Very high79 Ų7957.3 Ų57.341%0.41431%0.309SS..Hα-helixtrans-64.3-44.5171.8-71.6173.8000111.8I296 L298 L302 G303 I304 Y417I296-L300 HydrophobicContact CG2-CD1 3.77Å; I296-L300 HydrophobicContact CG2-CG 4.33Å; I296-L300 WeakPolarHBondContact O-CB 3.49Å; I296-L300 VanDerWaalsContact O-CG 3.23Å; I296-L300 WeakPolarHBondContact O-CG 3.48Å; I296-L300 PolarHBondContact O-N 2.92Å; L298-L300 VanDerWaalsContact C-N 3.32Å; L298-L300 PolarHBondContact O-N 3.39Å; L300-L302 VanDerWaalsContact C-N 3.35Å; L300-L302 PolarHBondContact O-N 2.86Å; L300-G303 PolarHBondContact O-N 3.19Å; L300-I304 VanDerWaalsContact O-CG1 3.31Å; L300-I304 WeakPolarHBondContact O-CG1 3.44Å; L300-I304 PolarHBondContact O-N 3.33Å; L300-Y417 HydrophobicContact CD2-CD1 4.02Å; L300-Y417 HydrophobicContact CD2-CD2 4.48Å; L300-Y417 HydrophobicContact CD2-CE1 3.61Å; L300-Y417 HydrophobicContact CD2-CE2 4.11Å; L300-Y417 HydrophobicContact CD2-CG 4.44Å; L300-Y417 HydrophobicContact CG-CE1 4.18Å
301A94.7Very high89.3Confident56 Ų5656.9 Ų56.946%0.46332%0.32SS..Hα-helixtrans-61.6-42.3177.400000112G297 L298 I304 F305G297-A301 WeakPolarHBondContact O-CB 3.31Å; G297-A301 PolarHBondContact O-N 3.42Å; L298-A301 PolarHBondContact O-N 2.85Å; A301-I304 PolarHBondContact O-N 2.92Å; A301-F305 WeakPolarHBondContact O-CB 3.37Å; A301-F305 PolarHBondContact O-N 3.33Å
302L94.3Very high87.5Confident52 Ų5265.1 Ų65.127%0.27235%0.351SS..Hα-helixtrans-62.5-42.5173.6-69.4176.8000111.8Y172 L298 L300 F305 S306 L323Y172-L302 HydrophobicContact CE1-CB 4.35Å; Y172-L302 HydrophobicContact CE1-CD1 4.46Å; Y172-L302 HydrophobicContact CE1-CD2 3.85Å; Y172-L302 HydrophobicContact CE1-CG 4.44Å; Y172-L302 HydrophobicContact CE2-CB 3.82Å; Y172-L302 WeakPolarHBondContact CE2-O 3.25Å; Y172-L302 WeakPolarHBondContact OH-CA 3.22Å; Y172-L302 WeakPolarHBondContact OH-CD2 3.05Å; Y172-L302 PolarHBondContact OH-O 3.46Å; L298-L302 HydrophobicContact CD1-CD1 4.29Å; L298-L302 HydrophobicContact CD1-CG 4.24Å; L298-L302 HydrophobicContact CG-CD1 4.16Å; L298-L302 HydrophobicContact CG-CG 4.49Å; L298-L302 VanDerWaalsContact O-CG 3.29Å; L298-L302 WeakPolarHBondContact O-CG 3.39Å; L298-L302 PolarHBondContact O-N 3.45Å; L300-L302 VanDerWaalsContact C-N 3.35Å; L300-L302 PolarHBondContact O-N 2.86Å; L302-F305 PolarHBondContact O-N 3.06Å; L302-S306 PolarHBondContact O-N 3.31Å; L302-L323 HydrophobicContact CB-CD1 4.19Å; L302-L323 HydrophobicContact CB-CD2 4.23Å; L302-L323 HydrophobicContact CD1-CD2 4.31Å
303G91.1Very high86Confident5 Ų564.1 Ų64.15%0.05235%0.345CS..Hα-helixtrans-59.7-51.7175.300000111.7H299 L300 F305 S306 F307 L323H299-G303 PolarHBondContact O-N 2.87Å; L300-G303 PolarHBondContact O-N 3.19Å; G303-F305 VanDerWaalsContact C-N 3.31Å; G303-F305 PolarHBondContact O-N 3.2Å; G303-S306 PolarHBondContact O-N 3.46Å; G303-F307 WeakPolarHBondContact O-CD2 3.43Å; G303-F307 WeakPolarHBondContact O-CE2 3.34Å; G303-F307 WeakPolarHBondContact O-CG 3.5Å; G303-F307 PolarHBondContact O-N 2.87Å; G303-L323 VanDerWaalsContact CA-CD1 3.47Å
304I89.3Confident84.6Confident112 Ų11258.5 Ų58.557%0.57432%0.316SS*.Hα-helixtrans-56.6-47.1177.2-67165.2000110.5L300 A301 S306 F307 T308L300-I304 VanDerWaalsContact O-CG1 3.31Å; L300-I304 WeakPolarHBondContact O-CG1 3.44Å; L300-I304 PolarHBondContact O-N 3.33Å; A301-I304 PolarHBondContact O-N 2.92Å; I304-S306 PolarHBondContact O-N 2.94Å; I304-F307 PolarHBondContact O-N 2.79Å; I304-T308 WeakPolarHBondContact O-CG2 3.3Å; I304-T308 PolarHBondContact O-N 3.26Å
305F89.7Confident83.4Confident110 Ų11054.9 Ų54.948%0.48230%0.298SS..Hα-helixtrans-56.9-51.3176.8173.9-97.6000111.6Y172 A301 L302 G303 F307 T308 L309Y172-F305 WeakPolarHBondContact OH-CD1 3.49Å; A301-F305 WeakPolarHBondContact O-CB 3.37Å; A301-F305 PolarHBondContact O-N 3.33Å; L302-F305 PolarHBondContact O-N 3.06Å; G303-F305 VanDerWaalsContact C-N 3.31Å; G303-F305 PolarHBondContact O-N 3.2Å; F305-F307 PolarHBondContact O-N 3.45Å; F305-T308 PolarHBondContact O-N 3.11Å; F305-T308 PolarHBondContact O-OG1 3.05Å; F305-L309 HydrophobicContact CD1-CD1 4.45Å; F305-L309 HydrophobicContact CE1-CD1 3.95Å; F305-L309 HydrophobicContact CE1-CD2 4.46Å; F305-L309 HydrophobicContact CE1-CG 4.46Å; F305-L309 HydrophobicContact CZ-CD1 4.47Å; F305-L309 HydrophobicContact CZ-CD2 4.18Å
306S86.5Confident82.7Confident0 Ų055.7 Ų55.70%030%0.3CS..Hα-helixtrans-56.7-39.2177.7173.10000112.1L302 G303 I304 T308 L309L302-S306 PolarHBondContact O-N 3.31Å; G303-S306 PolarHBondContact O-N 3.46Å; I304-S306 PolarHBondContact O-N 2.94Å; S306-T308 VanDerWaalsContact C-N 3.26Å; S306-T308 PolarHBondContact O-N 2.94Å; S306-L309 WeakPolarHBondContact O-CB 3.46Å; S306-L309 PolarHBondContact O-N 3.42Å; S306-L309 VanDerWaalsContact O-N 3.09Å
307F81.6Confident82.3Confident38 Ų3852.3 Ų52.317%0.16728%0.283CS..Hα-helixtrans-69.7-21.8-179.7-54.1-31.9000113.6G303 I304 F305 L309 R316 T319 A320 L413G303-F307 WeakPolarHBondContact O-CD2 3.43Å; G303-F307 WeakPolarHBondContact O-CE2 3.34Å; G303-F307 WeakPolarHBondContact O-CG 3.5Å; G303-F307 PolarHBondContact O-N 2.87Å; I304-F307 PolarHBondContact O-N 2.79Å; F305-F307 PolarHBondContact O-N 3.45Å; F307-L309 VanDerWaalsContact C-N 3.26Å; F307-L309 PolarHBondContact O-N 3.27Å; F307-R316 HydrophobicContact CD1-CB 3.88Å; F307-R316 HydrophobicContact CD1-CG 3.83Å; F307-R316 HydrophobicContact CE1-CB 3.79Å; F307-R316 HydrophobicContact CE1-CG 4.24Å; F307-R316 WeakPolarHBondContact CE1-O 3.5Å; F307-R316 PolarHBondContact O-NH2 2.99Å; F307-T319 HydrophobicContact CE1-CG2 4.38Å; F307-A320 HydrophobicContact CZ-CB 4.09Å; F307-L413 HydrophobicContact CD1-CD1 4.2Å; F307-L413 HydrophobicContact CD2-CD1 3.59Å; F307-L413 HydrophobicContact CE1-CD1 4.12Å; F307-L413 HydrophobicContact CE1-CD2 3.92Å; F307-L413 HydrophobicContact CE2-CB 4.27Å; F307-L413 HydrophobicContact CE2-CD1 3.52Å; F307-L413 HydrophobicContact CE2-CD2 4.38Å; F307-L413 HydrophobicContact CE2-CG 4.27Å; F307-L413 HydrophobicContact CG-CD1 3.96Å; F307-L413 HydrophobicContact CZ-CB 4.33Å; F307-L413 HydrophobicContact CZ-CD1 3.79Å; F307-L413 HydrophobicContact CZ-CD2 3.8Å; F307-L413 HydrophobicContact CZ-CG 4.18Å
308T82.3Confident81.9Confident102 Ų10251.7 Ų51.763%0.62627%0.27SS*.Hα-helixtrans-72.8-15.917266.50000113.8I304 F305 S306I304-T308 WeakPolarHBondContact O-CG2 3.3Å; I304-T308 PolarHBondContact O-N 3.26Å; F305-T308 PolarHBondContact O-N 3.11Å; F305-T308 PolarHBondContact O-OG1 3.05Å; S306-T308 VanDerWaalsContact C-N 3.26Å; S306-T308 PolarHBondContact O-N 2.94Å
309L77.9Confident81.7Confident36 Ų3647.1 Ų47.119%0.18825%0.247CC..THydrogen-bonded Turntrans-81-19.4-172.5-63175.7000114.6C176 D179 I180 R182 F305 S306 F307C176-L309 HydrophobicContact CB-CD1 3.97Å; D179-L309 HydrophobicContact CB-CB 4.07Å; I180-L309 HydrophobicContact CD1-CD1 4.29Å; I180-L309 HydrophobicContact CG1-CD1 4.19Å; I180-L309 HydrophobicContact CG1-CD2 4.33Å; R182-L309 PolarHBondContact NH2-O 3.45Å; F305-L309 HydrophobicContact CD1-CD1 4.45Å; F305-L309 HydrophobicContact CE1-CD1 3.95Å; F305-L309 HydrophobicContact CE1-CD2 4.46Å; F305-L309 HydrophobicContact CE1-CG 4.46Å; F305-L309 HydrophobicContact CZ-CD1 4.47Å; F305-L309 HydrophobicContact CZ-CD2 4.18Å; S306-L309 WeakPolarHBondContact O-CB 3.46Å; S306-L309 PolarHBondContact O-N 3.42Å; S306-L309 VanDerWaalsContact O-N 3.09Å; F307-L309 VanDerWaalsContact C-N 3.26Å; F307-L309 PolarHBondContact O-N 3.27Å
310D67.3Low81.5Confident11 Ų1146.1 Ų46.16%0.05924%0.242CC..  trans-139170.3178.4-158.96000111.8D179 R182 Y202 R316D179-D310 HydrophobicContact CB-CB 4.32Å; R182-D310 IonicContact CZ-OD1 3.56Å; R182-D310 IonicContact NE-OD1 3.6Å; R182-D310 IonicContact NH1-OD1 3.89Å; R182-D310 IonicContact NH2-OD1 2.67Å; Y202-D310 WeakPolarHBondContact CE2-OD2 3.37Å; Y202-D310 PolarHBondContact OH-OD1 3.35Å; Y202-D310 PolarHBondContact OH-OD2 3.15Å; D310-R316 PolarHBondContact O-NH2 3.25Å
311T58.7Low81.6Confident122 Ų12243.4 Ų43.475%0.74823%0.227SC*.SBendtrans-96.2-35.3178.630.60000112.8R316T311-R316 PolarHBondContact O-NH1 3.18Å
312W56.5Low81.6Confident173 Ų17341 Ų4166%0.65521%0.207SC*.SBendtrans-170.4117.7172-170.484000112
313S64.8Low81.8Confident10 Ų1038.7 Ų38.77%0.0720%0.195CC..  trans-151.2153.3173.8620000110.3S315 R316S313-S315 PolarHBondContact O-N 3.15Å; S313-S315 PolarHBondContact OG-OG 3.15Å; S313-R316 PolarHBondContact O-N 3.07Å
314T67.4Low82.1Confident10 Ų1038.4 Ų38.46%0.06119%0.192CC..THydrogen-bonded Turntrans-66.6-16.3177.850.20000113.1L113 S200 E201 R316 G317L113-T314 HydrophobicContact CD1-CG2 4.47Å; S200-T314 PolarHBondContact OG-OG1 2.77Å; E201-T314 WeakPolarHBondContact CG-OG1 3.48Å; E201-T314 PolarHBondContact OE1-OG1 2.9Å; T314-R316 PolarHBondContact O-N 3.47Å; T314-G317 PolarHBondContact O-N 2.82Å
315S72.8Confident82.5Confident3 Ų334 Ų342%0.02117%0.171CC..Hα-helixtrans-62.4-26.2178.960.40000113.1D179 S313 G317 D318 T319D179-S315 PolarHBondContact OD1-OG 3.01Å; S313-S315 PolarHBondContact O-N 3.15Å; S313-S315 PolarHBondContact OG-OG 3.15Å; S315-G317 PolarHBondContact O-N 2.92Å; S315-D318 PolarHBondContact O-N 3.15Å; S315-T319 PolarHBondContact O-N 3.47Å; S315-T319 PolarHBondContact O-OG1 2.95Å
316R81.7Confident82.9Confident22 Ų2229 Ų298%0.08315%0.151CC..Hα-helixtrans-63.8-42.2179.6-64.6179.3158.1166.8-13.4113F307 D310 T311 S313 T314 D318 T319 A320 M409 L413F307-R316 HydrophobicContact CD1-CB 3.88Å; F307-R316 HydrophobicContact CD1-CG 3.83Å; F307-R316 HydrophobicContact CE1-CB 3.79Å; F307-R316 HydrophobicContact CE1-CG 4.24Å; F307-R316 WeakPolarHBondContact CE1-O 3.5Å; F307-R316 PolarHBondContact O-NH2 2.99Å; D310-R316 PolarHBondContact O-NH2 3.25Å; T311-R316 PolarHBondContact O-NH1 3.18Å; S313-R316 PolarHBondContact O-N 3.07Å; T314-R316 PolarHBondContact O-N 3.47Å; R316-D318 VanDerWaalsContact C-N 3.29Å; R316-D318 PolarHBondContact O-N 2.88Å; R316-T319 PolarHBondContact O-N 3.17Å; R316-A320 PolarHBondContact O-N 3.39Å; R316-M409 PolarHBondContact NH1-SD 3.39Å; R316-L413 HydrophobicContact CB-CD2 3.88Å
317G86.7Confident83.4Confident0 Ų029.2 Ų29.20%015%0.153CC..Hα-helixtrans-61.2-43.3176.300000110.8T314 S315 A320 E321 R416T314-G317 PolarHBondContact O-N 2.82Å; S315-G317 PolarHBondContact O-N 2.92Å; G317-A320 PolarHBondContact O-N 3.16Å; G317-E321 WeakPolarHBondContact O-CB 3.36Å; G317-E321 PolarHBondContact O-N 3.2Å; G317-R416 VanDerWaalsContact C-NH1 3.34Å; G317-R416 WeakPolarHBondContact O-CD 3.43Å
318D88.6Confident84.2Confident25 Ų2527.7 Ų27.713%0.13415%0.147CC..Hα-helixtrans-64.8-42.2176.6-69.35.7000111.2S315 R316 A320 E321 I322 R416S315-D318 PolarHBondContact O-N 3.15Å; R316-D318 VanDerWaalsContact C-N 3.29Å; R316-D318 PolarHBondContact O-N 2.88Å; D318-A320 PolarHBondContact O-N 3.42Å; D318-E321 WeakPolarHBondContact O-CB 3.3Å; D318-E321 PolarHBondContact O-N 3.32Å; D318-I322 WeakPolarHBondContact O-CB 2.96Å; D318-I322 VanDerWaalsContact O-CD1 3.29Å; D318-I322 WeakPolarHBondContact O-CD1 3.39Å; D318-I322 WeakPolarHBondContact O-CG1 3.15Å; D318-I322 PolarHBondContact O-N 3.34Å; D318-R416 IonicContact OD1-NH1 2.7Å; D318-R416 PolarHBondContact OD1-NH1 3.22Å; D318-R416 VanDerWaalsContact OD1-NH1 3.1Å
319T92.4Very high85Confident0 Ų023.3 Ų23.30%012%0.12CC..Hα-helixtrans-60.2-45.1174.5-64.70000112Y172 Q175 F307 S315 R316 E321 I322 L323Y172-T319 HydrophobicContact CD2-CG2 3.99Å; Y172-T319 HydrophobicContact CE2-CG2 4.23Å; Q175-T319 WeakPolarHBondContact CB-OG1 3.39Å; F307-T319 HydrophobicContact CE1-CG2 4.38Å; S315-T319 PolarHBondContact O-N 3.47Å; S315-T319 PolarHBondContact O-OG1 2.95Å; R316-T319 PolarHBondContact O-N 3.17Å; T319-E321 VanDerWaalsContact C-N 3.29Å; T319-E321 PolarHBondContact O-N 2.87Å; T319-I322 PolarHBondContact O-N 3.27Å; T319-L323 HydrophobicContact CG2-CD1 3.72Å; T319-L323 HydrophobicContact CG2-CG 4.32Å; T319-L323 WeakPolarHBondContact O-CB 3.21Å; T319-L323 WeakPolarHBondContact O-CG 3.29Å; T319-L323 PolarHBondContact O-N 2.85Å
320A93.9Very high85.9Confident2 Ų222 Ų222%0.01711%0.114CC..Hα-helixtrans-60.7-40.4176.300000111.8F307 R316 G317 D318 G324 L413 R416F307-A320 HydrophobicContact CZ-CB 4.09Å; R316-A320 PolarHBondContact O-N 3.39Å; G317-A320 PolarHBondContact O-N 3.16Å; D318-A320 PolarHBondContact O-N 3.42Å; A320-G324 PolarHBondContact O-N 3.18Å; A320-L413 HydrophobicContact CB-CB 4.36Å; A320-L413 HydrophobicContact CB-CD2 4.14Å; A320-R416 HydrophobicContact CB-CB 4.21Å
321E95Very high87.4Confident22 Ų2222 Ų2210%0.10312%0.115CC..Hα-helixtrans-68.3-43.5177.7172.5166.717300113E141 G317 D318 T319 S325 R416 Y420E141-E321 WeakPolarHBondContact CG-OE1 3.08Å; G317-E321 WeakPolarHBondContact O-CB 3.36Å; G317-E321 PolarHBondContact O-N 3.2Å; D318-E321 WeakPolarHBondContact O-CB 3.3Å; D318-E321 PolarHBondContact O-N 3.32Å; T319-E321 VanDerWaalsContact C-N 3.29Å; T319-E321 PolarHBondContact O-N 2.87Å; E321-S325 VanDerWaalsContact O-CB 3.31Å; E321-S325 WeakPolarHBondContact O-CB 3.3Å; E321-S325 PolarHBondContact O-N 2.98Å; E321-S325 PolarHBondContact O-OG 3.43Å; E321-R416 HydrophobicContact CB-CB 4.44Å; E321-R416 IonicContact OE2-NH1 3.56Å; E321-R416 PolarHBondContact OE2-NH1 3.12Å; E321-Y420 HydrophobicContact CB-CD2 4.03Å; E321-Y420 HydrophobicContact CB-CE2 4.36Å; E321-Y420 HydrophobicContact CB-CG 4.37Å; E321-Y420 VanDerWaalsContact CD-CE2 3.42Å; E321-Y420 HydrophobicContact CG-CD1 3.85Å; E321-Y420 HydrophobicContact CG-CD2 3.6Å; E321-Y420 HydrophobicContact CG-CE1 3.99Å; E321-Y420 HydrophobicContact CG-CE2 3.8Å; E321-Y420 HydrophobicContact CG-CG 3.64Å; E321-Y420 WeakPolarHBondContact OE1-CE1 3.36Å; E321-Y420 PolarHBondContact OE1-OH 2.89Å; E321-Y420 WeakPolarHBondContact OE2-CE2 3.27Å
322I96.1Very high89.2Confident7 Ų716.2 Ų16.24%0.0368%0.079CC..Hα-helixtrans-61-51.6175.2-69.2155.2000110.3W167 V168 M171 Q175 D318 T319 S325 G326W167-I322 HydrophobicContact CH2-CB 4.13Å; W167-I322 HydrophobicContact CH2-CG1 3.79Å; W167-I322 HydrophobicContact CH2-CG2 4.07Å; W167-I322 HydrophobicContact CZ2-CG1 4.04Å; W167-I322 HydrophobicContact CZ3-CB 4.47Å; W167-I322 HydrophobicContact CZ3-CG2 4.01Å; V168-I322 HydrophobicContact CB-CG2 4.41Å; V168-I322 HydrophobicContact CG1-CG2 4.25Å; V168-I322 HydrophobicContact CG2-CG2 4.42Å; M171-I322 HydrophobicContact CB-CD1 3.73Å; M171-I322 HydrophobicContact CB-CG1 4.27Å; M171-I322 HydrophobicContact CB-CG2 4.08Å; M171-I322 HydrophobicContact CE-CD1 4.26Å; Q175-I322 HydrophobicContact CG-CD1 4.3Å; D318-I322 WeakPolarHBondContact O-CB 2.96Å; D318-I322 VanDerWaalsContact O-CD1 3.29Å; D318-I322 WeakPolarHBondContact O-CD1 3.39Å; D318-I322 WeakPolarHBondContact O-CG1 3.15Å; D318-I322 PolarHBondContact O-N 3.34Å; T319-I322 PolarHBondContact O-N 3.27Å; I322-S325 PolarHBondContact O-N 2.87Å; I322-G326 PolarHBondContact O-N 2.99Å
323L97.5Very high91.1Very high2 Ų28.3 Ų8.31%0.015%0.05CC..Hα-helixtrans-67-40-178.4-69.7172.2000111.8V168 Y172 H299 L302 G303 T319 G326 A327 Y417V168-L323 HydrophobicContact CG1-CD2 4.32Å; Y172-L323 HydrophobicContact CD2-CD1 3.93Å; Y172-L323 HydrophobicContact CD2-CD2 3.85Å; Y172-L323 HydrophobicContact CD2-CG 4.1Å; Y172-L323 HydrophobicContact CE2-CD1 3.98Å; Y172-L323 HydrophobicContact CE2-CD2 4.39Å; Y172-L323 HydrophobicContact CG-CD2 4.27Å; H299-L323 HydrophobicContact CB-CB 4.35Å; H299-L323 PolarHBondContact CD2-O 3.08Å; L302-L323 HydrophobicContact CB-CD1 4.19Å; L302-L323 HydrophobicContact CB-CD2 4.23Å; L302-L323 HydrophobicContact CD1-CD2 4.31Å; G303-L323 VanDerWaalsContact CA-CD1 3.47Å; T319-L323 HydrophobicContact CG2-CD1 3.72Å; T319-L323 HydrophobicContact CG2-CG 4.32Å; T319-L323 WeakPolarHBondContact O-CB 3.21Å; T319-L323 WeakPolarHBondContact O-CG 3.29Å; T319-L323 PolarHBondContact O-N 2.85Å; L323-G326 PolarHBondContact O-N 3.23Å; L323-A327 WeakPolarHBondContact O-CB 3.41Å; L323-A327 PolarHBondContact O-N 3.14Å; L323-Y417 HydrophobicContact CB-CD2 4.37Å; L323-Y417 HydrophobicContact CB-CE2 4.12Å
324G97.5Very high92.6Very high0 Ų08.4 Ų8.40%05%0.05CC..Hα-helixtrans-58.9-51.8173.500000111.2A320 G326 A327 G328 G421A320-G324 PolarHBondContact O-N 3.18Å; G324-G326 VanDerWaalsContact C-N 3.33Å; G324-G326 PolarHBondContact O-N 2.77Å; G324-A327 PolarHBondContact O-N 3.45Å; G324-G328 PolarHBondContact O-N 3.35Å; G324-G421 WeakPolarHBondContact O-CA 3.39Å
325S97.4Very high94Very high19 Ų199.6 Ų9.613%0.1336%0.057CC..Hα-helixtrans-56.7-45.3177.7-58.60000112.2E321 I322 G328 I329E321-S325 VanDerWaalsContact O-CB 3.31Å; E321-S325 WeakPolarHBondContact O-CB 3.3Å; E321-S325 PolarHBondContact O-N 2.98Å; E321-S325 PolarHBondContact O-OG 3.43Å; I322-S325 PolarHBondContact O-N 2.87Å; S325-G328 PolarHBondContact O-N 2.83Å; S325-I329 WeakPolarHBondContact O-CB 3.32Å; S325-I329 WeakPolarHBondContact O-CG1 3.43Å; S325-I329 PolarHBondContact O-N 3.23Å
326G97.9Very high95Very high5 Ų59.8 Ų9.85%0.0526%0.058CC..Hα-helixtrans-59.6-51.1176.500000113.2I322 L323 G324 G328 I329 A330I322-G326 PolarHBondContact O-N 2.99Å; L323-G326 PolarHBondContact O-N 3.23Å; G324-G326 VanDerWaalsContact C-N 3.33Å; G324-G326 PolarHBondContact O-N 2.77Å; G326-G328 VanDerWaalsContact C-N 3.32Å; G326-G328 PolarHBondContact O-N 3.41Å; G326-I329 PolarHBondContact O-N 3.12Å; G326-A330 WeakPolarHBondContact O-CB 3.06Å; G326-A330 PolarHBondContact O-N 2.83Å
327A98.3Very high95.5Very high5 Ų514 Ų144%0.0418%0.075CC..Hα-helixtrans-60.6-42.9177.800000111.7I295 H299 L323 G324 C331I295-A327 HydrophobicContact CG2-CB 3.99Å; H299-A327 HydrophobicContact CB-CB 4.08Å; L323-A327 WeakPolarHBondContact O-CB 3.41Å; L323-A327 PolarHBondContact O-N 3.14Å; G324-A327 PolarHBondContact O-N 3.45Å; A327-C331 WeakPolarHBondContact O-CB 3.43Å; A327-C331 PolarHBondContact O-N 2.98Å; A327-C331 PolarHBondContact O-SG 2.87Å
328G98.2Very high95.8Very high5 Ų518.8 Ų18.85%0.05210%0.1CC..Hα-helixtrans-59.8-5317700000113.1G324 S325 G326 A330 C331 G332 G421 F425G324-G328 PolarHBondContact O-N 3.35Å; S325-G328 PolarHBondContact O-N 2.83Å; G326-G328 VanDerWaalsContact C-N 3.32Å; G326-G328 PolarHBondContact O-N 3.41Å; G328-A330 VanDerWaalsContact C-N 3.32Å; G328-A330 PolarHBondContact O-N 3.39Å; G328-C331 PolarHBondContact O-N 3.4Å; G328-G332 PolarHBondContact O-N 3.25Å; G328-G421 WeakPolarHBondContact CA-O 3.48Å; G328-F425 VanDerWaalsContact C-N 3.34Å; G328-F425 VanDerWaalsContact O-CA 3.24Å; G328-F425 WeakPolarHBondContact O-CA 3.42Å; G328-F425 PolarHBondContact O-N 3.05Å
329I97.9Very high95.9Very high10 Ų1022.8 Ų22.85%0.05112%0.119CC..Hα-helixtrans-59.8-44.3179.8-74.2173.9000110.6V164 S325 G326 S333 G424 T428V164-I329 HydrophobicContact CB-CD1 4.35Å; V164-I329 HydrophobicContact CB-CG2 4.24Å; V164-I329 HydrophobicContact CG1-CB 4.23Å; V164-I329 HydrophobicContact CG1-CD1 3.72Å; V164-I329 HydrophobicContact CG1-CG2 3.99Å; V164-I329 HydrophobicContact CG2-CD1 3.79Å; V164-I329 HydrophobicContact CG2-CG2 4.32Å; S325-I329 WeakPolarHBondContact O-CB 3.32Å; S325-I329 WeakPolarHBondContact O-CG1 3.43Å; S325-I329 PolarHBondContact O-N 3.23Å; G326-I329 PolarHBondContact O-N 3.12Å; I329-S333 WeakPolarHBondContact O-CB 3.47Å; I329-S333 PolarHBondContact O-N 3.16Å; I329-S333 PolarHBondContact O-OG 3.47Å; I329-G424 WeakPolarHBondContact CG1-O 3.47Å; I329-T428 HydrophobicContact CB-CG2 4.28Å; I329-T428 HydrophobicContact CG1-CG2 4.39Å; I329-T428 HydrophobicContact CG2-CG2 3.73Å; I329-T428 PolarHBondContact O-OG1 3.04Å
330A97.8Very high95.7Very high8 Ų824.8 Ų24.87%0.06614%0.14CC..Hα-helixtrans-66.4-44.9179.300000112.3N285 I295 G326 G328 S333 H334N285-A330 HydrophobicContact CB-CB 4.33Å; I295-A330 HydrophobicContact CD1-CB 3.82Å; I295-A330 HydrophobicContact CG1-CB 4.45Å; I295-A330 HydrophobicContact CG2-CB 4.02Å; G326-A330 WeakPolarHBondContact O-CB 3.06Å; G326-A330 PolarHBondContact O-N 2.83Å; G328-A330 VanDerWaalsContact C-N 3.32Å; G328-A330 PolarHBondContact O-N 3.39Å; A330-S333 PolarHBondContact O-N 3.26Å; A330-H334 PolarHBondContact O-N 3.23Å
331C98.1Very high95.1Very high12 Ų1226.1 Ų26.18%0.08115%0.147CC..Hα-helixtrans-65.4-41.5176.1-67.60000112.3A327 G328 S333 H334 V335 F425A327-C331 WeakPolarHBondContact O-CB 3.43Å; A327-C331 PolarHBondContact O-N 2.98Å; A327-C331 PolarHBondContact O-SG 2.87Å; G328-C331 PolarHBondContact O-N 3.4Å; C331-S333 VanDerWaalsContact C-N 3.32Å; C331-H334 WeakPolarHBondContact O-CB 3.42Å; C331-H334 PolarHBondContact O-N 2.88Å; C331-V335 WeakPolarHBondContact O-CG2 3.23Å; C331-V335 PolarHBondContact O-N 3.37Å; C331-V335 VanDerWaalsContact O-N 3.15Å; C331-F425 HydrophobicContact CB-CD2 4.09Å; C331-F425 HydrophobicContact CB-CE2 4.43Å
332G97.3Very high94.2Very high0 Ų027 Ų270%015%0.154CC..Hα-helixtrans-65.6-38.3176.700000111.4G328 H334 V335 T336 F425 T428G328-G332 PolarHBondContact O-N 3.25Å; G332-H334 VanDerWaalsContact C-N 3.34Å; G332-H334 PolarHBondContact O-N 3.08Å; G332-V335 PolarHBondContact O-N 3.3Å; G332-T336 WeakPolarHBondContact O-CB 3.11Å; G332-T336 PolarHBondContact O-N 3.38Å; G332-T336 PolarHBondContact O-OG1 2.98Å; G332-F425 VanDerWaalsContact N-CD2 3.32Å; G332-T428 VanDerWaalsContact CA-OG1 3.26Å; G332-T428 WeakPolarHBondContact CA-OG1 3.45Å
333S95.6Very high93.1Very high7 Ų733.9 Ų33.95%0.04919%0.19CC..Hα-helixtrans-62.4-40.3174.1-58.50000112.2R161 I329 A330 C331 V335 T336 Y337 T428R161-S333 VanDerWaalsContact CD-CB 3.45Å; R161-S333 WeakPolarHBondContact CD-OG 3.23Å; R161-S333 WeakPolarHBondContact CG-OG 3.16Å; I329-S333 WeakPolarHBondContact O-CB 3.47Å; I329-S333 PolarHBondContact O-N 3.16Å; I329-S333 PolarHBondContact O-OG 3.47Å; A330-S333 PolarHBondContact O-N 3.26Å; C331-S333 VanDerWaalsContact C-N 3.32Å; S333-V335 PolarHBondContact O-N 2.8Å; S333-T336 PolarHBondContact O-N 3.12Å; S333-Y337 WeakPolarHBondContact O-CB 3.43Å; S333-Y337 PolarHBondContact O-N 3.34Å; S333-T428 PolarHBondContact N-OG1 2.98Å; S333-T428 WeakPolarHBondContact OG-CG2 3.35Å
334H96.5Very high92.1Very high12 Ų1236.8 Ų36.86%0.05621%0.205CC..Hα-helixtrans-57.8-46.8173.6-174.881000112.1N285 Q286 H288 P292 A330 C331 G332 Y337 N338N285-H334 WeakPolarHBondContact O-CB 3.42Å; N285-H334 PolarHBondContact O-ND1 3.05Å; Q286-H334 PolarHBondContact O-CE1 3Å; Q286-H334 PolarHBondContact O-ND1 2.76Å; H288-H334 PolarHBondContact O-CE1 2.87Å; P292-H334 HydrophobicContact CG-CB 4.25Å; P292-H334 VanDerWaalsContact CG-CD2 3.41Å; P292-H334 WeakPolarHBondContact CG-CD2 3.35Å; A330-H334 PolarHBondContact O-N 3.23Å; C331-H334 WeakPolarHBondContact O-CB 3.42Å; C331-H334 PolarHBondContact O-N 2.88Å; G332-H334 VanDerWaalsContact C-N 3.34Å; G332-H334 PolarHBondContact O-N 3.08Å; H334-Y337 PolarHBondContact O-N 2.88Å; H334-N338 PolarHBondContact CD2-ND2 3Å; H334-N338 VanDerWaalsContact CD2-ND2 3.25Å; H334-N338 PolarHBondContact NE2-ND2 3.42Å; H334-N338 VanDerWaalsContact O-CG 3.3Å; H334-N338 PolarHBondContact O-N 2.92Å; H334-N338 PolarHBondContact O-ND2 3.21Å
335V96.1Very high91.3Very high36 Ų3639 Ų3922%0.21822%0.219CC..Hα-helixtrans-66.3-44.7178.9178.10000111C331 G332 S333 Y337 N338 M339 F425 F429C331-V335 WeakPolarHBondContact O-CG2 3.23Å; C331-V335 PolarHBondContact O-N 3.37Å; C331-V335 VanDerWaalsContact O-N 3.15Å; G332-V335 PolarHBondContact O-N 3.3Å; S333-V335 PolarHBondContact O-N 2.8Å; V335-Y337 VanDerWaalsContact C-N 3.31Å; V335-Y337 PolarHBondContact O-N 3.31Å; V335-N338 PolarHBondContact O-N 2.7Å; V335-M339 HydrophobicContact CG1-CE 3.85Å; V335-M339 HydrophobicContact CG1-CG 4.44Å; V335-M339 HydrophobicContact CG1-SD 4.35Å; V335-M339 WeakPolarHBondContact O-CG 3.28Å; V335-M339 PolarHBondContact O-N 2.93Å; V335-F425 HydrophobicContact CG2-CE2 3.93Å; V335-F425 HydrophobicContact CG2-CZ 4.09Å; V335-F429 HydrophobicContact CB-CD2 4.18Å; V335-F429 HydrophobicContact CB-CG 4.34Å; V335-F429 HydrophobicContact CG1-CD1 4.28Å; V335-F429 HydrophobicContact CG1-CD2 3.61Å; V335-F429 HydrophobicContact CG1-CE1 4.16Å; V335-F429 HydrophobicContact CG1-CE2 3.52Å; V335-F429 HydrophobicContact CG1-CG 4.01Å; V335-F429 HydrophobicContact CG1-CZ 3.79Å
336T94.1Very high90.3Very high6 Ų641 Ų414%0.03723%0.234CC..Hα-helixtrans-59.3-41.4177.4-62.70000112.1G332 S333 M339 G340 L341 V342 T428 F429G332-T336 WeakPolarHBondContact O-CB 3.11Å; G332-T336 PolarHBondContact O-N 3.38Å; G332-T336 PolarHBondContact O-OG1 2.98Å; S333-T336 PolarHBondContact O-N 3.12Å; T336-M339 PolarHBondContact O-N 3.18Å; T336-G340 PolarHBondContact O-N 2.85Å; T336-L341 HydrophobicContact CG2-CB 3.79Å; T336-L341 PolarHBondContact O-N 3.33Å; T336-L341 VanDerWaalsContact O-N 3.13Å; T336-V342 HydrophobicContact CG2-CB 3.99Å; T336-V342 HydrophobicContact CG2-CG2 3.58Å; T336-T428 PolarHBondContact OG1-O 3.41Å; T336-F429 WeakPolarHBondContact OG1-CA 3.33Å
337Y92.8Very high89.6Confident112 Ų11247.7 Ų47.744%0.43927%0.267SS..Hα-helixtrans-62.6-50.5174.4-179.2-94.8000111.4Q286 T287 S333 H334 V335 M339 G340Q286-Y337 HydrophobicContact CB-CD2 4.29Å; Q286-Y337 HydrophobicContact CB-CG 4.11Å; Q286-Y337 WeakPolarHBondContact O-CD1 3.22Å; Q286-Y337 VanDerWaalsContact OE1-CD2 3.3Å; T287-Y337 HydrophobicContact CG2-CE1 3.97Å; S333-Y337 WeakPolarHBondContact O-CB 3.43Å; S333-Y337 PolarHBondContact O-N 3.34Å; H334-Y337 PolarHBondContact O-N 2.88Å; V335-Y337 VanDerWaalsContact C-N 3.31Å; V335-Y337 PolarHBondContact O-N 3.31Å; Y337-M339 PolarHBondContact O-N 2.75Å; Y337-G340 PolarHBondContact O-N 2.89Å
338N92.1Very high88.9Confident99 Ų9954.8 Ų54.853%0.52931%0.305SS..Hα-helixtrans-63.2-27.3179.8-71.1-22.1000113.6H334 V335H334-N338 PolarHBondContact CD2-ND2 3Å; H334-N338 VanDerWaalsContact CD2-ND2 3.25Å; H334-N338 PolarHBondContact NE2-ND2 3.42Å; H334-N338 VanDerWaalsContact O-CG 3.3Å; H334-N338 PolarHBondContact O-N 2.92Å; H334-N338 PolarHBondContact O-ND2 3.21Å; V335-N338 PolarHBondContact O-N 2.7Å
339M91.3Very high88.4Confident109 Ų10959.2 Ų59.254%0.53733%0.326SS..THydrogen-bonded Turntrans-86.7-4.1175.1-68.2-163.7-176.800113.8V335 T336 Y337 L341 F429V335-M339 HydrophobicContact CG1-CE 3.85Å; V335-M339 HydrophobicContact CG1-CG 4.44Å; V335-M339 HydrophobicContact CG1-SD 4.35Å; V335-M339 WeakPolarHBondContact O-CG 3.28Å; V335-M339 PolarHBondContact O-N 2.93Å; T336-M339 PolarHBondContact O-N 3.18Å; Y337-M339 PolarHBondContact O-N 2.75Å; M339-L341 HydrophobicContact CB-CD1 4.14Å; M339-L341 HydrophobicContact CB-CG 3.92Å; M339-L341 PolarHBondContact O-N 3.49Å; M339-L341 HydrophobicContact SD-CD1 4.45Å; M339-F429 HydrophobicContact CE-CE2 3.94Å; M339-F429 HydrophobicContact CE-CZ 3.75Å; M339-F429 HydrophobicContact SD-CE2 3.45Å; M339-F429 WeakPolarHBondContact SD-CE2 3.48Å; M339-F429 HydrophobicContact SD-CZ 3.8Å
340G87.6Confident87.9Confident42 Ų4261.2 Ų61.243%0.43334%0.337SS..THydrogen-bonded Turntrans64.724.3-178.300000114.1T336 Y337T336-G340 PolarHBondContact O-N 2.85Å; Y337-G340 PolarHBondContact O-N 2.89Å
341L82.4Confident87.5Confident31 Ų3163.5 Ų63.516%0.16235%0.351CS..  trans-75.3-25.1-177.5-71.1173.8000113T336 M339 F429 Y433 F436T336-L341 HydrophobicContact CG2-CB 3.79Å; T336-L341 PolarHBondContact O-N 3.33Å; T336-L341 VanDerWaalsContact O-N 3.13Å; M339-L341 HydrophobicContact CB-CD1 4.14Å; M339-L341 HydrophobicContact CB-CG 3.92Å; M339-L341 PolarHBondContact O-N 3.49Å; M339-L341 HydrophobicContact SD-CD1 4.45Å; L341-F429 HydrophobicContact CD1-CD2 4.13Å; L341-F429 HydrophobicContact CD1-CE2 3.96Å; L341-Y433 HydrophobicContact CD1-CD2 3.95Å; L341-Y433 HydrophobicContact CD2-CD2 4.1Å; L341-F436 HydrophobicContact CD2-CB 4.41Å; L341-F436 HydrophobicContact CD2-CD1 4.22Å; L341-F436 HydrophobicContact CD2-CG 4.18Å
342V75.7Confident87.1Confident41 Ų4164.3 Ų64.325%0.24835%0.354CS..  trans-133.7117.1177.9177.20000107.9P157 T336P157-V342 HydrophobicContact CB-CG1 3.86Å; P157-V342 HydrophobicContact CG-CG1 3.81Å; T336-V342 HydrophobicContact CG2-CB 3.99Å; T336-V342 HydrophobicContact CG2-CG2 3.58Å
343L73.3Confident86.6Confident151 Ų15167.3 Ų67.379%0.79138%0.379SS*.  trans-106.7122.8175-78.5133.9000108.8
344D77.1Confident85.9Confident62 Ų6269.6 Ų69.633%0.33240%0.404SS..PPolyproline II helixtrans-68138.4175.1-79.6-40.7000110.1L158 R161L158-D344 WeakPolarHBondContact CB-OD1 3.34Å; R161-D344 IonicContact NH2-OD1 3.65Å; R161-D344 IonicContact NH2-OD2 2.81Å; R161-D344 PolarHBondContact NH2-OD2 3.31Å
345P79.5Confident85.2Confident46 Ų4672.5 Ų72.530%0.29942%0.424SS..PPolyproline II helixtrans-55.9143.8176.1-23.132.6000111.6I349 L352P345-I349 HydrophobicContact CB-CD1 3.55Å; P345-I349 HydrophobicContact CB-CG1 4.09Å; P345-L352 HydrophobicContact CB-CD2 4.22Å; P345-L352 HydrophobicContact CG-CD1 4.38Å; P345-L352 HydrophobicContact CG-CD2 4.38Å
346S77.2Confident84.6Confident63 Ų6375.7 Ų75.744%0.44145%0.445SS..PPolyproline II helixtrans-62.9153.4175.965.20000111.5D348 I349S346-D348 PolarHBondContact O-N 3.01Å; S346-I349 WeakPolarHBondContact O-CG1 3.44Å; S346-I349 PolarHBondContact O-N 2.65Å
347L82.6Confident84.2Confident144 Ų14482.4 Ų82.475%0.75448%0.479SS*.G310 helixtrans-64.1-27.1-179.6-65.9176.4000112.5I349 L350L347-I349 PolarHBondContact O-N 3.26Å; L347-L350 HydrophobicContact CD2-CD1 3.94Å; L347-L350 PolarHBondContact O-N 2.97Å
348D84.6Confident84.1Confident155 Ų15580.1 Ų80.183%0.82948%0.477SS*.G310 helixtrans-68.8-18.2-177.2-55.4-38.2000114S346S346-D348 PolarHBondContact O-N 3.01Å
349I87Confident84.1Confident97 Ų9782.5 Ų82.550%0.49749%0.487SS..G310 helixtrans-98.75.2179.659.7165.4000113.2P345 S346 L347 L352P345-I349 HydrophobicContact CB-CD1 3.55Å; P345-I349 HydrophobicContact CB-CG1 4.09Å; S346-I349 WeakPolarHBondContact O-CG1 3.44Å; S346-I349 PolarHBondContact O-N 2.65Å; L347-I349 PolarHBondContact O-N 3.26Å; I349-L352 HydrophobicContact CD1-CD2 4.27Å
350L88.1Confident84.1Confident52 Ų5282 Ų8227%0.27249%0.49SS..PPolyproline II helixtrans-85146.2175.2-60.3-176.5000111.3R226 L347 L352R226-L350 HydrophobicContact CG-CD2 4.16Å; L347-L350 HydrophobicContact CD2-CD1 3.94Å; L347-L350 PolarHBondContact O-N 2.97Å; L350-L352 HydrophobicContact CD2-CD1 4.27Å; L350-L352 HydrophobicContact CD2-CD2 4.07Å; L350-L352 HydrophobicContact CD2-CG 3.7Å
351P89.4Confident84.2Confident56 Ų5682.9 Ų82.936%0.36449%0.485SS..SBendcis-77141.6-3.529.3-33.5000112.8G225 R226 Q228 A353G225-P351 WeakPolarHBondContact O-CB 3.48Å; R226-P351 CarbonylContact O-C 3.55Å; R226-P351 WeakPolarHBondContact O-CA 3.45Å; Q228-P351 HydrophobicContact CG-CB 3.61Å; Q228-P351 HydrophobicContact CG-CG 3.51Å; Q228-P351 PolarHBondContact NE2-O 2.62Å; P351-A353 PolarHBondContact O-N 3.39Å
352L89.2Confident84.6Confident29 Ų2987.2 Ų87.215%0.15250%0.502CS..BIsolated β-bridgetrans-63.7123.9177.5-60.5170.4000110.6R226 W227 Q228 P345 I349 L350R226-L352 HydrophobicContact CG-CD1 4.49Å; R226-L352 WeakPolarHBondContact O-CB 3.46Å; R226-L352 PolarHBondContact O-N 2.79Å; W227-L352 HydrophobicContact CD2-CB 4.01Å; W227-L352 HydrophobicContact CD2-CD1 4.22Å; W227-L352 HydrophobicContact CE3-CB 3.77Å; W227-L352 HydrophobicContact CH2-CB 4.45Å; W227-L352 HydrophobicContact CH2-CD1 4.2Å; W227-L352 HydrophobicContact CZ2-CD1 3.81Å; W227-L352 HydrophobicContact CZ3-CB 4Å; Q228-L352 PolarHBondContact N-O 2.8Å; P345-L352 HydrophobicContact CB-CD2 4.22Å; P345-L352 HydrophobicContact CG-CD1 4.38Å; P345-L352 HydrophobicContact CG-CD2 4.38Å; I349-L352 HydrophobicContact CD1-CD2 4.27Å; L350-L352 HydrophobicContact CD2-CD1 4.27Å; L350-L352 HydrophobicContact CD2-CD2 4.07Å; L350-L352 HydrophobicContact CD2-CG 3.7Å
353A87Confident85.5Confident64 Ų6487 Ų8753%0.52951%0.508SS..PPolyproline II helixtrans-71.8135.7168.600000109.8P351P351-A353 PolarHBondContact O-N 3.39Å
354G80.5Confident86.4Confident54 Ų5483.5 Ų83.556%0.55749%0.487SS*.PPolyproline II helixtrans-61.6123.8174.100000110.3
355P81Confident87.3Confident74 Ų7481.5 Ų81.548%0.48148%0.478SS..PPolyproline II helixtrans-62.2147.6177.826.4-33.8000109.8I357 L361P355-I357 PolarHBondContact O-N 2.98Å; P355-L361 HydrophobicContact CB-CD2 4.28Å; P355-L361 HydrophobicContact CG-CD2 3.87Å
356P84.9Confident88Confident103 Ų10382.9 Ų82.967%0.66948%0.483SS*.PPolyproline II helixtrans-57.8134.1175.724.5-32.7000109.5T358P356-T358 VanDerWaalsContact C-N 3.26Å; P356-T358 HydrophobicContact CG-CG2 4.42Å; P356-T358 PolarHBondContact O-N 2.9Å
357I84.6Confident88.9Confident146 Ų14683.5 Ų83.575%0.74948%0.48SS*.  trans-7187.3179.1-55.5176.2000108.1P355P355-I357 PolarHBondContact O-N 2.98Å
358T91.3Very high89.5Confident65 Ų6577.6 Ų77.640%0.39945%0.448SS..  trans-87.3152.817559.90000110.3P356 T360 L361 F362P356-T358 VanDerWaalsContact C-N 3.26Å; P356-T358 HydrophobicContact CG-CG2 4.42Å; P356-T358 PolarHBondContact O-N 2.9Å; T358-T360 PolarHBondContact O-N 3.44Å; T358-L361 PolarHBondContact O-N 3.24Å; T358-L361 VanDerWaalsContact O-N 3.14Å; T358-L361 WeakPolarHBondContact OG1-CB 3.25Å; T358-L361 PolarHBondContact OG1-N 3.14Å; T358-L361 VanDerWaalsContact OG1-N 3.16Å; T358-F362 PolarHBondContact O-N 3.46Å
359M91.6Very high90.1Very high148 Ų14872 Ų7273%0.72942%0.418SS*.Hα-helixtrans-57.6-32173.3-67.6-60.210900111.8G363M359-G363 PolarHBondContact O-N 3.02Å
360T90.7Very high90.5Very high98 Ų9872.4 Ų72.460%0.60142%0.421SS*.Hα-helixtrans-66.5-46.5175.6-49.20000112T358 G363 K364T358-T360 PolarHBondContact O-N 3.44Å; T360-G363 PolarHBondContact O-N 3.45Å; T360-K364 WeakPolarHBondContact O-CB 3.42Å; T360-K364 WeakPolarHBondContact O-CG 3.44Å; T360-K364 PolarHBondContact O-N 3.11Å
361L90.1Very high90.9Very high62 Ų6272.6 Ų72.633%0.32542%0.421SS..Hα-helixtrans-62.8-45.6177.1179.362.4000110.9P355 T358 K364 A365P355-L361 HydrophobicContact CB-CD2 4.28Å; P355-L361 HydrophobicContact CG-CD2 3.87Å; T358-L361 PolarHBondContact O-N 3.24Å; T358-L361 VanDerWaalsContact O-N 3.14Å; T358-L361 WeakPolarHBondContact OG1-CB 3.25Å; T358-L361 PolarHBondContact OG1-N 3.14Å; T358-L361 VanDerWaalsContact OG1-N 3.16Å; L361-K364 PolarHBondContact O-N 2.92Å; L361-A365 WeakPolarHBondContact O-CB 3.46Å; L361-A365 PolarHBondContact O-N 3.25Å
362F92Very high91.3Very high121 Ų12170 Ų7053%0.53140%0.404SS..Hα-helixtrans-61.9-45.3177.3-175.2-107.8000112.1T358 A365 I366T358-F362 PolarHBondContact O-N 3.46Å; F362-A365 PolarHBondContact O-N 3.47Å; F362-I366 HydrophobicContact CD1-CD1 3.83Å; F362-I366 HydrophobicContact CE1-CD1 3.34Å; F362-I366 HydrophobicContact CE1-CG1 4.42Å; F362-I366 HydrophobicContact CE2-CD1 4.32Å; F362-I366 HydrophobicContact CZ-CD1 3.62Å; F362-I366 HydrophobicContact CZ-CG1 4.42Å; F362-I366 PolarHBondContact O-N 3.4Å
363G93.6Very high91.6Very high36 Ų3669.6 Ų69.637%0.37140%0.402SS..Hα-helixtrans-62.2-43.7176.200000112.8M359 T360 A365 I366 L367M359-G363 PolarHBondContact O-N 3.02Å; T360-G363 PolarHBondContact O-N 3.45Å; G363-A365 VanDerWaalsContact C-N 3.33Å; G363-A365 PolarHBondContact O-N 2.93Å; G363-I366 PolarHBondContact O-N 2.89Å; G363-L367 WeakPolarHBondContact O-CB 3.44Å; G363-L367 PolarHBondContact O-N 3.45Å
364K93.2Very high92.1Very high79 Ų7970.8 Ų70.834%0.34340%0.402SS..Hα-helixtrans-60.5-42.8173.2-78.5-173.1174.2-167.50111.4T360 L361 L367 R368T360-K364 WeakPolarHBondContact O-CB 3.42Å; T360-K364 WeakPolarHBondContact O-CG 3.44Å; T360-K364 PolarHBondContact O-N 3.11Å; L361-K364 PolarHBondContact O-N 2.92Å; K364-L367 PolarHBondContact O-N 3.28Å; K364-R368 WeakPolarHBondContact O-CG 3.42Å; K364-R368 PolarHBondContact O-N 3.01Å
365A94.3Very high92.9Very high19 Ų1971.1 Ų71.116%0.15739%0.389CS..Hα-helixtrans-64.2-43-179.100000112.6N154 L361 F362 G363 I369N154-A365 HydrophobicContact CB-CB 4.4Å; N154-A365 WeakPolarHBondContact OD1-CA 3.23Å; N154-A365 WeakPolarHBondContact OD1-CB 3.48Å; L361-A365 WeakPolarHBondContact O-CB 3.46Å; L361-A365 PolarHBondContact O-N 3.25Å; F362-A365 PolarHBondContact O-N 3.47Å; G363-A365 VanDerWaalsContact C-N 3.33Å; G363-A365 PolarHBondContact O-N 2.93Å; A365-I369 WeakPolarHBondContact O-CG1 3.08Å; A365-I369 PolarHBondContact O-N 3.39Å; A365-I369 VanDerWaalsContact O-N 3.1Å
366I95.1Very high93.6Very high76 Ų7667.7 Ų67.739%0.3937%0.366SS..Hα-helixtrans-61.3-46.8172.9-69.6171.9000110.4F362 G363 R368 I369 L370F362-I366 HydrophobicContact CD1-CD1 3.83Å; F362-I366 HydrophobicContact CE1-CD1 3.34Å; F362-I366 HydrophobicContact CE1-CG1 4.42Å; F362-I366 HydrophobicContact CE2-CD1 4.32Å; F362-I366 HydrophobicContact CZ-CD1 3.62Å; F362-I366 HydrophobicContact CZ-CG1 4.42Å; F362-I366 PolarHBondContact O-N 3.4Å; G363-I366 PolarHBondContact O-N 2.89Å; I366-R368 PolarHBondContact O-N 3.27Å; I366-I369 PolarHBondContact O-N 2.89Å; I366-L370 HydrophobicContact CG2-CD1 3.71Å; I366-L370 HydrophobicContact CG2-CG 4.11Å; I366-L370 WeakPolarHBondContact O-CG 3.44Å; I366-L370 PolarHBondContact O-N 2.9Å
367L95.9Very high94.1Very high75 Ų7567 Ų6739%0.39336%0.357SS..Hα-helixtrans-61.7-43.9-178.1-173.762.1000112.1G363 K364 I369 L370 I371 I440G363-L367 WeakPolarHBondContact O-CB 3.44Å; G363-L367 PolarHBondContact O-N 3.45Å; K364-L367 PolarHBondContact O-N 3.28Å; L367-I369 PolarHBondContact O-N 3.32Å; L367-L370 PolarHBondContact O-N 3.43Å; L367-I371 HydrophobicContact CD1-CD1 3.66Å; L367-I371 HydrophobicContact CD1-CG1 4.04Å; L367-I371 HydrophobicContact CD2-CD1 4.43Å; L367-I371 HydrophobicContact CG-CD1 3.73Å; L367-I371 HydrophobicContact CG-CG1 4.39Å; L367-I371 WeakPolarHBondContact O-CB 3.5Å; L367-I371 WeakPolarHBondContact O-CG1 3.39Å; L367-I371 PolarHBondContact O-N 3.4Å; L367-I440 HydrophobicContact CD2-CD1 4.12Å; L367-I440 HydrophobicContact CD2-CG2 4.05Å; L367-I440 HydrophobicContact CG-CD1 4.07Å
368R96.3Very high94.7Very high21 Ų2164.6 Ų64.68%0.07934%0.344CS..Hα-helixtrans-58.2-47.7174.4-73.7175.1-168.3158.53.1111.2W153 N154 K364 I366 G372 F435 I440 S441W153-R368 WeakPolarHBondContact O-CD 3.07Å; W153-R368 PolarHBondContact O-NH1 3.34Å; W153-R368 VanDerWaalsContact O-NH1 3.16Å; N154-R368 WeakPolarHBondContact OD1-CD 3.23Å; K364-R368 WeakPolarHBondContact O-CG 3.42Å; K364-R368 PolarHBondContact O-N 3.01Å; I366-R368 PolarHBondContact O-N 3.27Å; R368-G372 WeakPolarHBondContact O-CA 3.01Å; R368-G372 PolarHBondContact O-N 3.49Å; R368-F435 HydrophobicContact CB-CD2 4.46Å; R368-F435 HydrophobicContact CB-CE1 4.17Å; R368-F435 HydrophobicContact CB-CE2 3.8Å; R368-F435 HydrophobicContact CB-CZ 3.62Å; R368-F435 HydrophobicContact CG-CD1 4.39Å; R368-F435 HydrophobicContact CG-CD2 4Å; R368-F435 HydrophobicContact CG-CE1 4.24Å; R368-F435 HydrophobicContact CG-CE2 3.84Å; R368-F435 HydrophobicContact CG-CG 4.28Å; R368-F435 HydrophobicContact CG-CZ 3.96Å; R368-F435 WeakPolarHBondContact O-CZ 3.33Å; R368-I440 HydrophobicContact CG-CD1 3.99Å; R368-I440 HydrophobicContact CG-CG1 4.27Å; R368-I440 PolarHBondContact NE-O 3.03Å; R368-I440 PolarHBondContact NH2-O 3.35Å; R368-S441 PolarHBondContact NH2-O 3.34Å; R368-S441 PolarHBondContact NH2-OXT 3.35Å
369I96.1Very high95Very high36 Ų3662.5 Ų62.519%0.18533%0.331CS..Hα-helixtrans-62.8-47.4178.6-69.6-72.8000111.1F150 W153 N154 A365 I366 L367 M373F150-I369 HydrophobicContact CB-CD1 3.92Å; F150-I369 HydrophobicContact CD2-CD1 3.84Å; F150-I369 HydrophobicContact CD2-CG1 4.05Å; F150-I369 HydrophobicContact CG-CD1 4.4Å; W153-I369 HydrophobicContact CE3-CD1 3.81Å; W153-I369 HydrophobicContact CZ3-CD1 4.15Å; N154-I369 WeakPolarHBondContact ND2-CG1 3.32Å; A365-I369 WeakPolarHBondContact O-CG1 3.08Å; A365-I369 PolarHBondContact O-N 3.39Å; A365-I369 VanDerWaalsContact O-N 3.1Å; I366-I369 PolarHBondContact O-N 2.89Å; L367-I369 PolarHBondContact O-N 3.32Å; I369-M373 HydrophobicContact CG2-CG 4.06Å; I369-M373 WeakPolarHBondContact O-CB 3.43Å; I369-M373 WeakPolarHBondContact O-CG 3.47Å; I369-M373 PolarHBondContact O-N 2.69Å
370L96.2Very high95.1Very high107 Ų10758.3 Ų58.356%0.5631%0.307SS*.Hα-helixtrans-61.8-51.5-179.3-69.3177.3000111.9I366 L367 V374I366-L370 HydrophobicContact CG2-CD1 3.71Å; I366-L370 HydrophobicContact CG2-CG 4.11Å; I366-L370 WeakPolarHBondContact O-CG 3.44Å; I366-L370 PolarHBondContact O-N 2.9Å; L367-L370 PolarHBondContact O-N 3.43Å; L370-V374 WeakPolarHBondContact O-CB 3.43Å; L370-V374 VanDerWaalsContact O-CG2 3.25Å; L370-V374 WeakPolarHBondContact O-CG2 3.43Å; L370-V374 PolarHBondContact O-N 3.01Å
371I96.8Very high95.3Very high56 Ų5657.3 Ų57.329%0.28730%0.298SS..Hα-helixtrans-63.5-49.3180-66.7175.6000110.5L367 M373 V374 F375 I434 F435 I438 I440L367-I371 HydrophobicContact CD1-CD1 3.66Å; L367-I371 HydrophobicContact CD1-CG1 4.04Å; L367-I371 HydrophobicContact CD2-CD1 4.43Å; L367-I371 HydrophobicContact CG-CD1 3.73Å; L367-I371 HydrophobicContact CG-CG1 4.39Å; L367-I371 WeakPolarHBondContact O-CB 3.5Å; L367-I371 WeakPolarHBondContact O-CG1 3.39Å; L367-I371 PolarHBondContact O-N 3.4Å; I371-M373 PolarHBondContact O-N 3.44Å; I371-V374 PolarHBondContact O-N 3.42Å; I371-F375 PolarHBondContact O-N 2.87Å; I371-I434 HydrophobicContact CG2-CG2 4.37Å; I371-F435 HydrophobicContact CB-CE1 4.32Å; I371-F435 HydrophobicContact CG2-CE1 4.21Å; I371-I438 HydrophobicContact CD1-CD1 3.86Å; I371-I440 HydrophobicContact CD1-CD1 3.99Å
372G96.9Very high95.7Very high0 Ų057.6 Ų57.60%030%0.302CS..Hα-helixtrans-61.7-43-178.800000112.3W153 R368 F375 V376W153-G372 VanDerWaalsContact CH2-C 3.47Å; R368-G372 WeakPolarHBondContact O-CA 3.01Å; R368-G372 PolarHBondContact O-N 3.49Å; G372-F375 PolarHBondContact O-N 3.27Å; G372-V376 WeakPolarHBondContact O-CB 3.24Å; G372-V376 VanDerWaalsContact O-CG2 3.29Å; G372-V376 WeakPolarHBondContact O-CG2 3.46Å; G372-V376 PolarHBondContact O-N 3.47Å
373M96Very high95.9Very high22 Ų2253.3 Ų53.311%0.10829%0.285CS..Hα-helixtrans-68-41.1178.3-73.1-47.6-52.700112.6I145 L146 W153 I369 I371 F375 V376 L377I145-M373 HydrophobicContact CG2-CE 3.4Å; I145-M373 HydrophobicContact CG2-SD 4.42Å; L146-M373 HydrophobicContact CD2-CE 4.07Å; L146-M373 HydrophobicContact CD2-CG 4.07Å; L146-M373 HydrophobicContact CD2-SD 3.97Å; W153-M373 HydrophobicContact CH2-SD 4.24Å; W153-M373 HydrophobicContact CZ3-CG 4.41Å; W153-M373 HydrophobicContact CZ3-SD 4.22Å; I369-M373 HydrophobicContact CG2-CG 4.06Å; I369-M373 WeakPolarHBondContact O-CB 3.43Å; I369-M373 WeakPolarHBondContact O-CG 3.47Å; I369-M373 PolarHBondContact O-N 2.69Å; I371-M373 PolarHBondContact O-N 3.44Å; M373-F375 VanDerWaalsContact C-N 3.31Å; M373-F375 PolarHBondContact O-N 3.27Å; M373-V376 PolarHBondContact O-N 2.95Å; M373-L377 WeakPolarHBondContact O-CB 3.37Å; M373-L377 VanDerWaalsContact O-CG 3.23Å; M373-L377 WeakPolarHBondContact O-CG 3.46Å; M373-L377 PolarHBondContact O-N 3.41Å
374V96.8Very high95.9Very high89 Ų8953.5 Ų53.554%0.53928%0.275SS..Hα-helixtrans-58.2-47.3173.3168.70000110.1L370 I371 L377 I378L370-V374 WeakPolarHBondContact O-CB 3.43Å; L370-V374 VanDerWaalsContact O-CG2 3.25Å; L370-V374 WeakPolarHBondContact O-CG2 3.43Å; L370-V374 PolarHBondContact O-N 3.01Å; I371-V374 PolarHBondContact O-N 3.42Å; V374-L377 PolarHBondContact O-N 3.28Å; V374-I378 HydrophobicContact CG1-CD1 3.83Å; V374-I378 VanDerWaalsContact O-CG1 3.28Å; V374-I378 WeakPolarHBondContact O-CG1 3.44Å; V374-I378 PolarHBondContact O-N 3.04Å
375F97Very high95.9Very high60 Ų6056.4 Ų56.426%0.26329%0.288SS..Hα-helixtrans-60.7-48.7178-173.1-89.3000112.2I371 G372 M373 L377 I378 V379 F430 V431 I434I371-F375 PolarHBondContact O-N 2.87Å; G372-F375 PolarHBondContact O-N 3.27Å; M373-F375 VanDerWaalsContact C-N 3.31Å; M373-F375 PolarHBondContact O-N 3.27Å; F375-L377 VanDerWaalsContact C-N 3.32Å; F375-L377 PolarHBondContact O-N 3.06Å; F375-I378 WeakPolarHBondContact O-CB 3.17Å; F375-I378 PolarHBondContact O-N 3.03Å; F375-V379 HydrophobicContact CD1-CG2 3.87Å; F375-V379 HydrophobicContact CE1-CG2 3.49Å; F375-V379 VanDerWaalsContact CE1-CG2 3.49Å; F375-V379 HydrophobicContact CZ-CG2 4.01Å; F375-V379 WeakPolarHBondContact O-CG2 3.25Å; F375-V379 PolarHBondContact O-N 3.17Å; F375-F430 HydrophobicContact CE1-CB 3.71Å; F375-F430 HydrophobicContact CE1-CG 4.42Å; F375-F430 HydrophobicContact CZ-CB 3.91Å; F375-F430 HydrophobicContact CZ-CG 4.39Å; F375-V431 HydrophobicContact CB-CG2 4.17Å; F375-V431 HydrophobicContact CD1-CG2 3.52Å; F375-V431 HydrophobicContact CE1-CG2 4.25Å; F375-V431 HydrophobicContact CG-CG2 4.08Å; F375-I434 HydrophobicContact CD2-CD1 3.57Å; F375-I434 HydrophobicContact CE2-CD1 3.55Å; F375-I434 HydrophobicContact CG-CD1 4.11Å; F375-I434 HydrophobicContact CZ-CD1 4.07Å
376V96.2Very high95.9Very high2 Ų259.9 Ų59.91%0.01230%0.303CS..Hα-helixtrans-60.5-40.4179.51650000111.9W153 G372 M373 V379 R380 V423 I427 V431W153-V376 HydrophobicContact CH2-CG2 4.2Å; W153-V376 HydrophobicContact CZ2-CG2 4.35Å; G372-V376 WeakPolarHBondContact O-CB 3.24Å; G372-V376 VanDerWaalsContact O-CG2 3.29Å; G372-V376 WeakPolarHBondContact O-CG2 3.46Å; G372-V376 PolarHBondContact O-N 3.47Å; M373-V376 PolarHBondContact O-N 2.95Å; V376-V379 PolarHBondContact O-N 3.14Å; V376-R380 WeakPolarHBondContact O-CB 3.19Å; V376-R380 PolarHBondContact O-N 3.5Å; V376-V423 HydrophobicContact CG1-CG1 3.66Å; V376-V423 HydrophobicContact CG1-CG2 4.41Å; V376-I427 HydrophobicContact CG2-CG1 3.79Å; V376-V431 HydrophobicContact CG2-CG2 4.28Å
377L95.3Very high95.9Very high90 Ų9056.6 Ų56.647%0.47129%0.286SS..Hα-helixtrans-67.5-38.6177-69.8174.8000112.1M373 V374 F375 R380 D381M373-L377 WeakPolarHBondContact O-CB 3.37Å; M373-L377 VanDerWaalsContact O-CG 3.23Å; M373-L377 WeakPolarHBondContact O-CG 3.46Å; M373-L377 PolarHBondContact O-N 3.41Å; V374-L377 PolarHBondContact O-N 3.28Å; F375-L377 VanDerWaalsContact C-N 3.32Å; F375-L377 PolarHBondContact O-N 3.06Å; L377-R380 PolarHBondContact O-N 3.14Å; L377-D381 PolarHBondContact O-N 2.64Å
378I97.2Very high95.8Very high95 Ų9553.2 Ų53.249%0.48727%0.268SS..Hα-helixtrans-61.9-48.8173-69.2165.7000110.1V374 F375 R380 D381 V382V374-I378 HydrophobicContact CG1-CD1 3.83Å; V374-I378 VanDerWaalsContact O-CG1 3.28Å; V374-I378 WeakPolarHBondContact O-CG1 3.44Å; V374-I378 PolarHBondContact O-N 3.04Å; F375-I378 WeakPolarHBondContact O-CB 3.17Å; F375-I378 PolarHBondContact O-N 3.03Å; I378-R380 VanDerWaalsContact C-N 3.3Å; I378-R380 PolarHBondContact O-N 2.95Å; I378-D381 PolarHBondContact O-N 3.43Å; I378-V382 HydrophobicContact CG2-CG2 4.16Å; I378-V382 WeakPolarHBondContact O-CB 3.32Å; I378-V382 VanDerWaalsContact O-CG2 3.31Å; I378-V382 WeakPolarHBondContact O-CG2 3.44Å; I378-V382 PolarHBondContact O-N 3.04Å
379V97.1Very high95.6Very high21 Ų2155.1 Ų55.113%0.12728%0.284CS..Hα-helixtrans-57.1-45.9176.5170.70000110.4F375 V376 D381 V382 M383 M422 V423F375-V379 HydrophobicContact CD1-CG2 3.87Å; F375-V379 HydrophobicContact CE1-CG2 3.49Å; F375-V379 VanDerWaalsContact CE1-CG2 3.49Å; F375-V379 HydrophobicContact CZ-CG2 4.01Å; F375-V379 WeakPolarHBondContact O-CG2 3.25Å; F375-V379 PolarHBondContact O-N 3.17Å; V376-V379 PolarHBondContact O-N 3.14Å; V379-D381 PolarHBondContact O-N 2.74Å; V379-V382 PolarHBondContact O-N 3.46Å; V379-M383 HydrophobicContact CG1-CG 3.94Å; V379-M383 VanDerWaalsContact O-CB 3.22Å; V379-M383 WeakPolarHBondContact O-CB 3.4Å; V379-M383 WeakPolarHBondContact O-CG 3.09Å; V379-M383 PolarHBondContact O-N 2.93Å; V379-M422 HydrophobicContact CG1-CB 4.2Å; V379-V423 HydrophobicContact CG1-CG2 4.45Å
380R95.1Very high95.5Very high59 Ų5957.6 Ų57.622%0.22330%0.297CS..Hα-helixtrans-58.5-45178-173-177-179.7-162.41.1112.2E141 V376 L377 I378 K384 T419 Y420 V423E141-R380 IonicContact OE1-CZ 3.94Å; E141-R380 VanDerWaalsContact OE1-CZ 3.24Å; E141-R380 IonicContact OE1-NE 3.08Å; E141-R380 IonicContact OE1-NH1 3.68Å; E141-R380 IonicContact OE1-NH2 2.97Å; E141-R380 PolarHBondContact OE1-NH2 3.28Å; E141-R380 IonicContact OE2-NH2 3.31Å; V376-R380 WeakPolarHBondContact O-CB 3.19Å; V376-R380 PolarHBondContact O-N 3.5Å; L377-R380 PolarHBondContact O-N 3.14Å; I378-R380 VanDerWaalsContact C-N 3.3Å; I378-R380 PolarHBondContact O-N 2.95Å; R380-K384 WeakPolarHBondContact O-CB 3.35Å; R380-K384 WeakPolarHBondContact O-CG 3.47Å; R380-K384 PolarHBondContact O-N 3.32Å; R380-T419 HydrophobicContact CG-CG2 4Å; R380-Y420 PolarHBondContact NE-OH 3.06Å; R380-Y420 PolarHBondContact NH2-OH 3.48Å; R380-V423 HydrophobicContact CB-CG2 3.84Å; R380-V423 HydrophobicContact CG-CG2 4.33Å
381D95.1Very high95.3Very high77 Ų7752.7 Ų52.741%0.41227%0.272SS..Hα-helixtrans-68.4-46.6-179.9-175.462.1000112.1L377 I378 V379 K384 K385L377-D381 PolarHBondContact O-N 2.64Å; I378-D381 PolarHBondContact O-N 3.43Å; V379-D381 PolarHBondContact O-N 2.74Å; D381-K384 PolarHBondContact O-N 3.36Å; D381-K385 WeakPolarHBondContact O-CG 3.47Å; D381-K385 PolarHBondContact O-N 3.4Å; D381-K385 IonicContact OD1-NZ 3.82Å; D381-K385 VanDerWaalsContact OD2-CE 3.27Å; D381-K385 WeakPolarHBondContact OD2-CE 3.37Å; D381-K385 IonicContact OD2-NZ 2.69Å; D381-K385 PolarHBondContact OD2-NZ 2.96Å
382V97Very high95.1Very high68 Ų6850.2 Ų50.241%0.41226%0.259SS..Hα-helixtrans-59.8-49.1177170.70000110.4I378 V379 K384 K385 I386I378-V382 HydrophobicContact CG2-CG2 4.16Å; I378-V382 WeakPolarHBondContact O-CB 3.32Å; I378-V382 VanDerWaalsContact O-CG2 3.31Å; I378-V382 WeakPolarHBondContact O-CG2 3.44Å; I378-V382 PolarHBondContact O-N 3.04Å; V379-V382 PolarHBondContact O-N 3.46Å; V382-K384 VanDerWaalsContact C-N 3.34Å; V382-K384 PolarHBondContact O-N 2.83Å; V382-K385 PolarHBondContact O-N 3.29Å; V382-K385 VanDerWaalsContact O-N 3.15Å; V382-I386 HydrophobicContact CG1-CD1 3.68Å; V382-I386 WeakPolarHBondContact O-CG1 3.16Å; V382-I386 PolarHBondContact O-N 3.43Å
383M96.6Very high94.8Very high32 Ų3258.2 Ų58.216%0.15829%0.294CS..Hα-helixtrans-64.6-37.2-179.5-69-56.3-55.200112.1V379 I386 T387 I418 T419 M422V379-M383 HydrophobicContact CG1-CG 3.94Å; V379-M383 VanDerWaalsContact O-CB 3.22Å; V379-M383 WeakPolarHBondContact O-CB 3.4Å; V379-M383 WeakPolarHBondContact O-CG 3.09Å; V379-M383 PolarHBondContact O-N 2.93Å; M383-I386 PolarHBondContact O-N 3.21Å; M383-T387 HydrophobicContact CE-CG2 3.9Å; M383-T387 VanDerWaalsContact O-CB 3.29Å; M383-T387 WeakPolarHBondContact O-CB 3.49Å; M383-T387 VanDerWaalsContact O-CG2 3.24Å; M383-T387 WeakPolarHBondContact O-CG2 3.25Å; M383-T387 PolarHBondContact O-N 3.43Å; M383-T387 PolarHBondContact O-OG1 2.85Å; M383-I418 HydrophobicContact CE-CG2 3.76Å; M383-T419 HydrophobicContact CB-CG2 4.07Å; M383-M422 HydrophobicContact CE-CB 4.2Å; M383-M422 HydrophobicContact CE-CG 3.57Å; M383-M422 HydrophobicContact CG-CB 3.83Å; M383-M422 HydrophobicContact CG-CG 4.22Å; M383-M422 HydrophobicContact SD-CB 4.21Å; M383-M422 HydrophobicContact SD-CG 3.94Å
384K93.3Very high94.7Very high40 Ų4062.3 Ų62.317%0.17432%0.315CS..Hα-helixtrans-61.3-44.7172.2-83.1-179.4161.2177.50112.1R380 D381 V382 I386 I388 T419R380-K384 WeakPolarHBondContact O-CB 3.35Å; R380-K384 WeakPolarHBondContact O-CG 3.47Å; R380-K384 PolarHBondContact O-N 3.32Å; D381-K384 PolarHBondContact O-N 3.36Å; V382-K384 VanDerWaalsContact C-N 3.34Å; V382-K384 PolarHBondContact O-N 2.83Å; K384-I386 PolarHBondContact O-N 3.08Å; K384-I388 HydrophobicContact CB-CD1 4.23Å; K384-I388 WeakPolarHBondContact O-CB 3.48Å; K384-I388 WeakPolarHBondContact O-CD1 3.45Å; K384-I388 WeakPolarHBondContact O-CG1 3.34Å; K384-I388 PolarHBondContact O-N 2.91Å; K384-T419 HydrophobicContact CG-CG2 3.91Å
385K93.8Very high94.5Very high139 Ų13962.6 Ų62.660%0.60431%0.309SS*.Hα-helixtrans-65-26.3178.5-75.4171.5176.6164.20113D381 V382 P389D381-K385 WeakPolarHBondContact O-CG 3.47Å; D381-K385 PolarHBondContact O-N 3.4Å; D381-K385 IonicContact OD1-NZ 3.82Å; D381-K385 VanDerWaalsContact OD2-CE 3.27Å; D381-K385 WeakPolarHBondContact OD2-CE 3.37Å; D381-K385 IonicContact OD2-NZ 2.69Å; D381-K385 PolarHBondContact OD2-NZ 2.96Å; V382-K385 PolarHBondContact O-N 3.29Å; V382-K385 VanDerWaalsContact O-N 3.15Å; K385-P389 WeakPolarHBondContact O-CD 3.4Å; K385-P389 VanDerWaalsContact O-CG 3.27Å; K385-P389 WeakPolarHBondContact O-CG 3.27Å
386I95Very high94.2Very high92 Ų9266.8 Ų66.847%0.47234%0.335SS..Hα-helixtrans-86.7-51.2176.9-65.7167.9000111.3V382 M383 K384 P389 L390V382-I386 HydrophobicContact CG1-CD1 3.68Å; V382-I386 WeakPolarHBondContact O-CG1 3.16Å; V382-I386 PolarHBondContact O-N 3.43Å; M383-I386 PolarHBondContact O-N 3.21Å; K384-I386 PolarHBondContact O-N 3.08Å; I386-P389 WeakPolarHBondContact O-CD 3.42Å; I386-L390 VanDerWaalsContact O-CB 3.29Å; I386-L390 WeakPolarHBondContact O-CB 3.49Å; I386-L390 PolarHBondContact O-N 2.9Å
387T94.5Very high93.9Very high7 Ų768 Ų684%0.04334%0.341CS..Hα-helixtrans-72.9-35.9-168.354.20000113.2M383 L390 A391 I418 T419M383-T387 HydrophobicContact CE-CG2 3.9Å; M383-T387 VanDerWaalsContact O-CB 3.29Å; M383-T387 WeakPolarHBondContact O-CB 3.49Å; M383-T387 VanDerWaalsContact O-CG2 3.24Å; M383-T387 WeakPolarHBondContact O-CG2 3.25Å; M383-T387 PolarHBondContact O-N 3.43Å; M383-T387 PolarHBondContact O-OG1 2.85Å; T387-L390 PolarHBondContact O-N 3.48Å; T387-A391 WeakPolarHBondContact O-CB 3.48Å; T387-A391 PolarHBondContact O-N 3.31Å; T387-I418 HydrophobicContact CG2-CB 3.87Å; T387-I418 HydrophobicContact CG2-CG2 3.51Å; T387-T419 PolarHBondContact OG1-OG1 3.42Å
388I92.9Very high93.5Very high4 Ų468.3 Ų68.32%0.02135%0.348CS..Hα-helixtrans-66.3-53.5-179-64.7160.7000111.2K384 L390 A391 C392 I402 R406 V411 Y415K384-I388 HydrophobicContact CB-CD1 4.23Å; K384-I388 WeakPolarHBondContact O-CB 3.48Å; K384-I388 WeakPolarHBondContact O-CD1 3.45Å; K384-I388 WeakPolarHBondContact O-CG1 3.34Å; K384-I388 PolarHBondContact O-N 2.91Å; I388-L390 VanDerWaalsContact C-N 3.27Å; I388-L390 PolarHBondContact O-N 3.25Å; I388-A391 PolarHBondContact O-N 3.27Å; I388-C392 PolarHBondContact O-N 3.45Å; I388-C392 PolarHBondContact O-SG 3.22Å; I388-I402 HydrophobicContact CD1-CG2 4.42Å; I388-I402 HydrophobicContact CG2-CG2 4.33Å; I388-R406 HydrophobicContact CD1-CG 4.44Å; I388-V411 HydrophobicContact CG2-CG1 4.06Å; I388-Y415 HydrophobicContact CD1-CD2 4.49Å; I388-Y415 HydrophobicContact CD1-CG 4.44Å; I388-Y415 HydrophobicContact CG1-CD1 4.05Å; I388-Y415 HydrophobicContact CG1-CD2 4.24Å; I388-Y415 HydrophobicContact CG1-CG 3.77Å
389P92.9Very high92.9Very high61 Ų6165.8 Ų65.840%0.39634%0.339SS..Hα-helixtrans-62.4-35.4177.3-23.636.1000112.7K385 I386 C392 K393K385-P389 WeakPolarHBondContact O-CD 3.4Å; K385-P389 VanDerWaalsContact O-CG 3.27Å; K385-P389 WeakPolarHBondContact O-CG 3.27Å; I386-P389 WeakPolarHBondContact O-CD 3.42Å; P389-C392 PolarHBondContact O-N 3.22Å; P389-K393 WeakPolarHBondContact O-CB 3.45Å; P389-K393 PolarHBondContact O-N 3.03Å
390L93.1Very high92.3Very high88 Ų8872.6 Ų72.646%0.46137%0.374SS..Hα-helixtrans-62.6-47.3176.1179.961.4000111.5I386 T387 I388 K393 I394I386-L390 VanDerWaalsContact O-CB 3.29Å; I386-L390 WeakPolarHBondContact O-CB 3.49Å; I386-L390 PolarHBondContact O-N 2.9Å; T387-L390 PolarHBondContact O-N 3.48Å; I388-L390 VanDerWaalsContact C-N 3.27Å; I388-L390 PolarHBondContact O-N 3.25Å; L390-K393 PolarHBondContact O-N 2.88Å; L390-I394 HydrophobicContact CD1-CD1 3.94Å; L390-I394 HydrophobicContact CD1-CG1 4.29Å; L390-I394 HydrophobicContact CG-CD1 3.84Å; L390-I394 VanDerWaalsContact O-CG1 3.29Å; L390-I394 WeakPolarHBondContact O-CG1 3.34Å; L390-I394 PolarHBondContact O-N 2.99Å
391A92.4Very high91.8Very high5 Ų573 Ų734%0.04138%0.381CS..Hα-helixtrans-62.3-44.4176.200000111.2T387 I388 K393 I394 F395 V411T387-A391 WeakPolarHBondContact O-CB 3.48Å; T387-A391 PolarHBondContact O-N 3.31Å; I388-A391 PolarHBondContact O-N 3.27Å; A391-K393 VanDerWaalsContact C-N 3.27Å; A391-K393 PolarHBondContact O-N 3.41Å; A391-I394 PolarHBondContact O-N 2.93Å; A391-F395 HydrophobicContact CB-CD2 4.49Å; A391-F395 WeakPolarHBondContact O-CD2 3.21Å; A391-F395 PolarHBondContact O-N 3.29Å; A391-V411 HydrophobicContact CB-CB 4.49Å; A391-V411 HydrophobicContact CB-CG1 4.24Å
392C92.2Very high91.2Very high3 Ų373.2 Ų73.22%0.0238%0.381CS..Hα-helixtrans-57.1-42.4175.6-64.20000111.8I388 P389 N396 I397 C399I388-C392 PolarHBondContact O-N 3.45Å; I388-C392 PolarHBondContact O-SG 3.22Å; P389-C392 PolarHBondContact O-N 3.22Å; C392-N396 WeakPolarHBondContact O-CA 3.09Å; C392-N396 PolarHBondContact O-N 3.32Å; C392-I397 WeakPolarHBondContact CB-O 3.27Å; C392-I397 PolarHBondContact O-N 3.24Å; C392-C399 HydrophobicContact CB-CB 3.81Å; C392-C399 VanDerWaalsContact SG-SG 3.62Å
393K92.5Very high90.4Very high168 Ų16878.8 Ų78.873%0.7340%0.395SS*.Hα-helixtrans-66.8-42.7177.2-173.5177.7-179.2179.40112.7P389 L390 A391 F395P389-K393 WeakPolarHBondContact O-CB 3.45Å; P389-K393 PolarHBondContact O-N 3.03Å; L390-K393 PolarHBondContact O-N 2.88Å; A391-K393 VanDerWaalsContact C-N 3.27Å; A391-K393 PolarHBondContact O-N 3.41Å; K393-F395 VanDerWaalsContact C-N 3.35Å
394I93.9Very high89.7Confident108 Ų10883.5 Ų83.555%0.55442%0.415SS*.Hα-helixtrans-65.1-40.7-179.9-71167.6000111L390 A391L390-I394 HydrophobicContact CD1-CD1 3.94Å; L390-I394 HydrophobicContact CD1-CG1 4.29Å; L390-I394 HydrophobicContact CG-CD1 3.84Å; L390-I394 VanDerWaalsContact O-CG1 3.29Å; L390-I394 WeakPolarHBondContact O-CG1 3.34Å; L390-I394 PolarHBondContact O-N 2.99Å; A391-I394 PolarHBondContact O-N 2.93Å
395F91Very high89.2Confident95 Ų9581.7 Ų81.742%0.41741%0.407SS..THydrogen-bonded Turntrans-95.75.8-176.7-64.4-71.3000114A391 K393 I397 E410 P414A391-F395 HydrophobicContact CB-CD2 4.49Å; A391-F395 WeakPolarHBondContact O-CD2 3.21Å; A391-F395 PolarHBondContact O-N 3.29Å; K393-F395 VanDerWaalsContact C-N 3.35Å; F395-I397 VanDerWaalsContact C-N 3.31Å; F395-I397 HydrophobicContact CB-CD1 3.88Å; F395-I397 HydrophobicContact CB-CG1 4.2Å; F395-I397 PolarHBondContact O-N 3.24Å; F395-E410 HydrophobicContact CB-CB 4.05Å; F395-E410 HydrophobicContact CD1-CB 3.87Å; F395-E410 HydrophobicContact CD1-CG 4.15Å; F395-E410 HydrophobicContact CD2-CB 3.76Å; F395-E410 WeakPolarHBondContact CD2-O 3.25Å; F395-E410 HydrophobicContact CE1-CB 4.24Å; F395-E410 HydrophobicContact CE1-CG 4.49Å; F395-E410 HydrophobicContact CE2-CB 4.16Å; F395-E410 WeakPolarHBondContact CE2-O 3.19Å; F395-E410 HydrophobicContact CG-CB 3.62Å; F395-E410 HydrophobicContact CG-CG 4.35Å; F395-E410 HydrophobicContact CZ-CB 4.38Å; F395-P414 HydrophobicContact CE2-CG 4.21Å
396N90.8Very high88.7Confident149 Ų14978.5 Ų78.580%0.79739%0.391SS*.THydrogen-bonded Turntrans53.841.7-178.2-60.4-59.2000113.9C392C392-N396 WeakPolarHBondContact O-CA 3.09Å; C392-N396 PolarHBondContact O-N 3.32Å
397I89.6Confident88.1Confident26 Ų2679 Ų7913%0.13339%0.391CS..  trans-98.5132.2178-65.7166.3000109.4C392 F395 C399 H408 E410 V411C392-I397 WeakPolarHBondContact CB-O 3.27Å; C392-I397 PolarHBondContact O-N 3.24Å; F395-I397 VanDerWaalsContact C-N 3.31Å; F395-I397 HydrophobicContact CB-CD1 3.88Å; F395-I397 HydrophobicContact CB-CG1 4.2Å; F395-I397 PolarHBondContact O-N 3.24Å; I397-C399 PolarHBondContact O-N 3.34Å; I397-H408 HydrophobicContact CD1-CB 3.78Å; I397-E410 HydrophobicContact CD1-CB 4.06Å; I397-V411 HydrophobicContact CB-CG2 4.46Å; I397-V411 HydrophobicContact CD1-CG2 3.63Å; I397-V411 HydrophobicContact CG2-CG2 4.46Å
398P88.1Confident87.6Confident98 Ų9882.8 Ų82.864%0.63641%0.408SS*.  trans-58.2128.8175.5-23.733.4000112
399C84.3Confident87.2Confident42 Ų4286 Ų8628%0.28442%0.424SS..  trans-106.714.1-175.2-161.80000113.5C392 I397 D401C392-C399 HydrophobicContact CB-CB 3.81Å; C392-C399 VanDerWaalsContact SG-SG 3.62Å; I397-C399 PolarHBondContact O-N 3.34Å; C399-D401 VanDerWaalsContact C-N 3.26Å; C399-D401 PolarHBondContact O-N 3.34Å
400D83.9Confident86.9Confident163 Ų16386.9 Ų86.987%0.87242%0.423SS*.SBendtrans-63.5-34.8-178.3-54.8-40.9000112
401D85.1Confident86.7Confident67 Ų6782.7 Ų82.736%0.35840%0.401SS..SBendtrans-118.6100.3172.7-173.8-13.2000110.1C399 R403 K404 A405C399-D401 VanDerWaalsContact C-N 3.26Å; C399-D401 PolarHBondContact O-N 3.34Å; D401-R403 PolarHBondContact O-N 3.04Å; D401-R403 VanDerWaalsContact O-N 3.16Å; D401-R403 WeakPolarHBondContact OD1-CB 3.36Å; D401-R403 PolarHBondContact OD1-N 3.41Å; D401-K404 HydrophobicContact CB-CB 4.19Å; D401-K404 HydrophobicContact CB-CD 4.1Å; D401-K404 HydrophobicContact CB-CG 4.2Å; D401-K404 PolarHBondContact O-N 2.99Å; D401-K404 VanDerWaalsContact O-N 3.09Å; D401-K404 WeakPolarHBondContact OD2-CD 3.29Å; D401-K404 WeakPolarHBondContact OD2-CE 3.04Å; D401-K404 WeakPolarHBondContact OD2-CG 3.41Å; D401-A405 PolarHBondContact O-N 3.14Å
402I82Confident86.5Confident82 Ų8283.5 Ų83.542%0.42140%0.404SS..Hα-helixtrans-56-32.1178.8-65.4173.7000111.7I388 R406I388-I402 HydrophobicContact CD1-CG2 4.42Å; I388-I402 HydrophobicContact CG2-CG2 4.33Å; I402-R406 HydrophobicContact CG2-CG 4.46Å; I402-R406 VanDerWaalsContact O-CG 3.27Å; I402-R406 WeakPolarHBondContact O-CG 3.4Å; I402-R406 PolarHBondContact O-N 2.68Å; I402-R406 VanDerWaalsContact O-N 3.12Å
403R80.1Confident86.4Confident186 Ų18684.2 Ų84.270%0.70241%0.407SS*.Hα-helixtrans-66.9-44.7178.6-92.9-179.4170.3167.5-1.7111.1D401 R406D401-R403 PolarHBondContact O-N 3.04Å; D401-R403 VanDerWaalsContact O-N 3.16Å; D401-R403 WeakPolarHBondContact OD1-CB 3.36Å; D401-R403 PolarHBondContact OD1-N 3.41Å; R403-R406 PolarHBondContact O-N 3.14Å
404K82.3Confident86.4Confident131 Ų13178.1 Ų78.157%0.5739%0.385SS*.Hα-helixtrans-67.5-42.6176.9-68.7179.8-174.2177.40111.3D401 R406 Q407 H408D401-K404 HydrophobicContact CB-CB 4.19Å; D401-K404 HydrophobicContact CB-CD 4.1Å; D401-K404 HydrophobicContact CB-CG 4.2Å; D401-K404 PolarHBondContact O-N 2.99Å; D401-K404 VanDerWaalsContact O-N 3.09Å; D401-K404 WeakPolarHBondContact OD2-CD 3.29Å; D401-K404 WeakPolarHBondContact OD2-CE 3.04Å; D401-K404 WeakPolarHBondContact OD2-CG 3.41Å; K404-R406 PolarHBondContact O-N 2.96Å; K404-Q407 WeakPolarHBondContact O-CB 3.03Å; K404-Q407 PolarHBondContact O-N 3.39Å; K404-H408 PolarHBondContact O-CD2 3.47Å
405A83.2Confident86.3Confident1 Ų173.7 Ų73.71%0.00836%0.361CS..Hα-helixtrans-55.6-40.8177.100000112.1D401 Q407 H408 V411D401-A405 PolarHBondContact O-N 3.14Å; A405-Q407 PolarHBondContact O-N 3.47Å; A405-H408 WeakPolarHBondContact O-CB 3.33Å; A405-H408 PolarHBondContact O-N 3.49Å; A405-H408 VanDerWaalsContact O-N 3.16Å; A405-V411 VanDerWaalsContact O-CB 3.32Å; A405-V411 WeakPolarHBondContact O-CB 3.35Å
406R83.8Confident86.4Confident73 Ų7370 Ų7028%0.27534%0.344SS..THydrogen-bonded Turntrans-69.2-12.6177.6-72.1176.4-170.8176.45.2115.1I388 I402 R403 K404 H408 Y415I388-R406 HydrophobicContact CD1-CG 4.44Å; I402-R406 HydrophobicContact CG2-CG 4.46Å; I402-R406 VanDerWaalsContact O-CG 3.27Å; I402-R406 WeakPolarHBondContact O-CG 3.4Å; I402-R406 PolarHBondContact O-N 2.68Å; I402-R406 VanDerWaalsContact O-N 3.12Å; R403-R406 PolarHBondContact O-N 3.14Å; K404-R406 PolarHBondContact O-N 2.96Å; R406-H408 VanDerWaalsContact C-N 3.3Å; R406-Y415 HydrophobicContact CB-CE1 4.26Å; R406-Y415 HydrophobicContact CG-CD1 4.37Å; R406-Y415 HydrophobicContact CG-CE1 3.82Å
407Q82Confident86.7Confident103 Ų10364.5 Ų64.548%0.48131%0.313SS..THydrogen-bonded Turntrans-81.1-16.3174.4-65.4173.6-29.900111.7L113 K404 A405L113-Q407 PolarHBondContact O-NE2 3.25Å; K404-Q407 WeakPolarHBondContact O-CB 3.03Å; K404-Q407 PolarHBondContact O-N 3.39Å; A405-Q407 PolarHBondContact O-N 3.47Å
408H83.3Confident87Confident86 Ų8666.8 Ų66.840%0.39833%0.325SS..SBendtrans-78.6128.5171.8-68.8-87.2000110.3I397 K404 A405 R406 E410 V411 E412I397-H408 HydrophobicContact CD1-CB 3.78Å; K404-H408 PolarHBondContact O-CD2 3.47Å; A405-H408 WeakPolarHBondContact O-CB 3.33Å; A405-H408 PolarHBondContact O-N 3.49Å; A405-H408 VanDerWaalsContact O-N 3.16Å; R406-H408 VanDerWaalsContact C-N 3.3Å; H408-E410 VanDerWaalsContact C-N 3.25Å; H408-E410 PolarHBondContact O-N 2.98Å; H408-V411 HydrophobicContact CB-CG2 4.26Å; H408-V411 PolarHBondContact O-N 2.94Å; H408-E412 PolarHBondContact O-N 3.25Å
409M84Confident87.4Confident70 Ų7062.1 Ų62.135%0.34529%0.294SS..Hα-helixtrans-61.1-37-176.7-177.6178.567.200112R316 V411 E412 L413R316-M409 PolarHBondContact NH1-SD 3.39Å; M409-V411 PolarHBondContact O-N 3.39Å; M409-E412 PolarHBondContact O-N 3.07Å; M409-L413 HydrophobicContact CG-CD1 3.26Å; M409-L413 HydrophobicContact CG-CG 3.76Å; M409-L413 WeakPolarHBondContact O-CG 3.4Å; M409-L413 PolarHBondContact O-N 3.47Å; M409-L413 VanDerWaalsContact O-N 3.09Å; M409-L413 HydrophobicContact SD-CD1 3.91Å
410E87.4Confident88Confident81 Ų8160.5 Ų60.538%0.37928%0.282SS..Hα-helixtrans-62.4-24.8178.1-57.480.5-17800112.1F395 I397 H408 P414F395-E410 HydrophobicContact CB-CB 4.05Å; F395-E410 HydrophobicContact CD1-CB 3.87Å; F395-E410 HydrophobicContact CD1-CG 4.15Å; F395-E410 HydrophobicContact CD2-CB 3.76Å; F395-E410 WeakPolarHBondContact CD2-O 3.25Å; F395-E410 HydrophobicContact CE1-CB 4.24Å; F395-E410 HydrophobicContact CE1-CG 4.49Å; F395-E410 HydrophobicContact CE2-CB 4.16Å; F395-E410 WeakPolarHBondContact CE2-O 3.19Å; F395-E410 HydrophobicContact CG-CB 3.62Å; F395-E410 HydrophobicContact CG-CG 4.35Å; F395-E410 HydrophobicContact CZ-CB 4.38Å; I397-E410 HydrophobicContact CD1-CB 4.06Å; H408-E410 VanDerWaalsContact C-N 3.25Å; H408-E410 PolarHBondContact O-N 2.98Å; E410-P414 WeakPolarHBondContact O-CD 3.14Å; E410-P414 VanDerWaalsContact O-CG 3.23Å; E410-P414 WeakPolarHBondContact O-CG 3.12Å
411V89.2Confident88.7Confident0 Ų053.3 Ų53.30%025%0.246CC..Hα-helixtrans-93.5-46.6173.3-177.80000110I388 A391 I397 A405 H408 M409 L413 P414 Y415I388-V411 HydrophobicContact CG2-CG1 4.06Å; A391-V411 HydrophobicContact CB-CB 4.49Å; A391-V411 HydrophobicContact CB-CG1 4.24Å; I397-V411 HydrophobicContact CB-CG2 4.46Å; I397-V411 HydrophobicContact CD1-CG2 3.63Å; I397-V411 HydrophobicContact CG2-CG2 4.46Å; A405-V411 VanDerWaalsContact O-CB 3.32Å; A405-V411 WeakPolarHBondContact O-CB 3.35Å; H408-V411 HydrophobicContact CB-CG2 4.26Å; H408-V411 PolarHBondContact O-N 2.94Å; M409-V411 PolarHBondContact O-N 3.39Å; V411-L413 PolarHBondContact O-N 3.17Å; V411-P414 WeakPolarHBondContact O-CD 3.46Å; V411-Y415 HydrophobicContact CG1-CD1 4.34Å; V411-Y415 WeakPolarHBondContact O-CB 3.45Å; V411-Y415 WeakPolarHBondContact O-CD1 3.46Å; V411-Y415 PolarHBondContact O-N 3.37Å; V411-Y415 VanDerWaalsContact O-N 3.14Å
412E88.8Confident89.3Confident22 Ų2253 Ų5310%0.10324%0.244CC..Hα-helixtrans-57.4-52.2-172.1-170.8173-163.500113.2H408 M409 Y415 R416H408-E412 PolarHBondContact O-N 3.25Å; M409-E412 PolarHBondContact O-N 3.07Å; E412-Y415 VanDerWaalsContact CA-CD1 3.44Å; E412-Y415 VanDerWaalsContact CA-CE1 3.44Å; E412-Y415 HydrophobicContact CB-CE1 4.15Å; E412-Y415 HydrophobicContact CG-CE1 3.89Å; E412-Y415 VanDerWaalsContact O-CD1 3.27Å; E412-Y415 WeakPolarHBondContact O-CD1 3.48Å; E412-Y415 WeakPolarHBondContact O-CE1 3.21Å; E412-R416 HydrophobicContact CG-CG 4.49Å; E412-R416 WeakPolarHBondContact O-CB 3.46Å; E412-R416 WeakPolarHBondContact O-CG 3.14Å; E412-R416 PolarHBondContact O-N 3.16Å; E412-R416 VanDerWaalsContact O-N 3.07Å; E412-R416 IonicContact OE1-CZ 3.22Å; E412-R416 VanDerWaalsContact OE1-CZ 3.29Å; E412-R416 IonicContact OE1-NE 3.95Å; E412-R416 PolarHBondContact OE1-NE 2.83Å; E412-R416 VanDerWaalsContact OE1-NE 3.14Å; E412-R416 IonicContact OE1-NH2 3.57Å; E412-R416 PolarHBondContact OE1-NH2 3.19Å
413L89.9Confident90Very high17 Ų1749.3 Ų49.39%0.08923%0.225CC..Hα-helixtrans-70-48.5-171.4-50.3174.3000111.5F307 R316 A320 M409 V411 Y415 R416 Y417F307-L413 HydrophobicContact CD1-CD1 4.2Å; F307-L413 HydrophobicContact CD2-CD1 3.59Å; F307-L413 HydrophobicContact CE1-CD1 4.12Å; F307-L413 HydrophobicContact CE1-CD2 3.92Å; F307-L413 HydrophobicContact CE2-CB 4.27Å; F307-L413 HydrophobicContact CE2-CD1 3.52Å; F307-L413 HydrophobicContact CE2-CD2 4.38Å; F307-L413 HydrophobicContact CE2-CG 4.27Å; F307-L413 HydrophobicContact CG-CD1 3.96Å; F307-L413 HydrophobicContact CZ-CB 4.33Å; F307-L413 HydrophobicContact CZ-CD1 3.79Å; F307-L413 HydrophobicContact CZ-CD2 3.8Å; F307-L413 HydrophobicContact CZ-CG 4.18Å; R316-L413 HydrophobicContact CB-CD2 3.88Å; A320-L413 HydrophobicContact CB-CB 4.36Å; A320-L413 HydrophobicContact CB-CD2 4.14Å; M409-L413 HydrophobicContact CG-CD1 3.26Å; M409-L413 HydrophobicContact CG-CG 3.76Å; M409-L413 WeakPolarHBondContact O-CG 3.4Å; M409-L413 PolarHBondContact O-N 3.47Å; M409-L413 VanDerWaalsContact O-N 3.09Å; M409-L413 HydrophobicContact SD-CD1 3.91Å; V411-L413 PolarHBondContact O-N 3.17Å; L413-Y415 PolarHBondContact O-N 2.98Å; L413-R416 PolarHBondContact O-N 3.33Å; L413-Y417 WeakPolarHBondContact O-CB 3.41Å; L413-Y417 PolarHBondContact O-N 2.95Å
414P92Very high90.9Very high40 Ų4040.5 Ų40.526%0.2619%0.192SC..Hα-helixtrans-64.3-40.7178.7-25.339000112.7F395 E410 V411 R416 I418F395-P414 HydrophobicContact CE2-CG 4.21Å; E410-P414 WeakPolarHBondContact O-CD 3.14Å; E410-P414 VanDerWaalsContact O-CG 3.23Å; E410-P414 WeakPolarHBondContact O-CG 3.12Å; V411-P414 WeakPolarHBondContact O-CD 3.46Å; P414-R416 PolarHBondContact O-N 3.39Å; P414-I418 WeakPolarHBondContact O-CB 3.43Å; P414-I418 VanDerWaalsContact O-CG1 3.23Å; P414-I418 WeakPolarHBondContact O-CG1 3.47Å; P414-I418 PolarHBondContact O-N 3.33Å
415Y92.4Very high91.6Very high15 Ų1536 Ų366%0.05917%0.173CC..Hα-helixtrans-65.1-43.6-18095.1-112.7000110.9I388 R406 V411 E412 L413 T419I388-Y415 HydrophobicContact CD1-CD2 4.49Å; I388-Y415 HydrophobicContact CD1-CG 4.44Å; I388-Y415 HydrophobicContact CG1-CD1 4.05Å; I388-Y415 HydrophobicContact CG1-CD2 4.24Å; I388-Y415 HydrophobicContact CG1-CG 3.77Å; R406-Y415 HydrophobicContact CB-CE1 4.26Å; R406-Y415 HydrophobicContact CG-CD1 4.37Å; R406-Y415 HydrophobicContact CG-CE1 3.82Å; V411-Y415 HydrophobicContact CG1-CD1 4.34Å; V411-Y415 WeakPolarHBondContact O-CB 3.45Å; V411-Y415 WeakPolarHBondContact O-CD1 3.46Å; V411-Y415 PolarHBondContact O-N 3.37Å; V411-Y415 VanDerWaalsContact O-N 3.14Å; E412-Y415 VanDerWaalsContact CA-CD1 3.44Å; E412-Y415 VanDerWaalsContact CA-CE1 3.44Å; E412-Y415 HydrophobicContact CB-CE1 4.15Å; E412-Y415 HydrophobicContact CG-CE1 3.89Å; E412-Y415 VanDerWaalsContact O-CD1 3.27Å; E412-Y415 WeakPolarHBondContact O-CD1 3.48Å; E412-Y415 WeakPolarHBondContact O-CE1 3.21Å; L413-Y415 PolarHBondContact O-N 2.98Å; Y415-T419 WeakPolarHBondContact O-CB 3.39Å; Y415-T419 PolarHBondContact O-N 2.89Å; Y415-T419 PolarHBondContact O-OG1 2.7Å
416R93.2Very high92.3Very high17 Ų1736 Ų366%0.06417%0.172CC..Hα-helixtrans-64.3-52.3178.7-74.1-168.8-173.6-147.517.3109.8G317 D318 A320 E321 E412 L413 P414 I418 T419 Y420G317-R416 VanDerWaalsContact C-NH1 3.34Å; G317-R416 WeakPolarHBondContact O-CD 3.43Å; D318-R416 IonicContact OD1-NH1 2.7Å; D318-R416 PolarHBondContact OD1-NH1 3.22Å; D318-R416 VanDerWaalsContact OD1-NH1 3.1Å; A320-R416 HydrophobicContact CB-CB 4.21Å; E321-R416 HydrophobicContact CB-CB 4.44Å; E321-R416 IonicContact OE2-NH1 3.56Å; E321-R416 PolarHBondContact OE2-NH1 3.12Å; E412-R416 HydrophobicContact CG-CG 4.49Å; E412-R416 WeakPolarHBondContact O-CB 3.46Å; E412-R416 WeakPolarHBondContact O-CG 3.14Å; E412-R416 PolarHBondContact O-N 3.16Å; E412-R416 VanDerWaalsContact O-N 3.07Å; E412-R416 IonicContact OE1-CZ 3.22Å; E412-R416 VanDerWaalsContact OE1-CZ 3.29Å; E412-R416 IonicContact OE1-NE 3.95Å; E412-R416 PolarHBondContact OE1-NE 2.83Å; E412-R416 VanDerWaalsContact OE1-NE 3.14Å; E412-R416 IonicContact OE1-NH2 3.57Å; E412-R416 PolarHBondContact OE1-NH2 3.19Å; L413-R416 PolarHBondContact O-N 3.33Å; P414-R416 PolarHBondContact O-N 3.39Å; R416-I418 PolarHBondContact O-N 3.31Å; R416-T419 PolarHBondContact O-N 2.95Å; R416-Y420 HydrophobicContact CB-CD2 4.32Å; R416-Y420 WeakPolarHBondContact O-CB 3.47Å; R416-Y420 WeakPolarHBondContact O-CD2 3.04Å; R416-Y420 PolarHBondContact O-N 2.96Å
417Y95.8Very high93Very high34 Ų3432.9 Ų32.913%0.13316%0.161CC..Hα-helixtrans-55.1-49.9-179.2-175.1-90.6000112.4H299 L300 L323 L413 G421H299-Y417 HydrophobicContact CB-CE2 4.19Å; L300-Y417 HydrophobicContact CD2-CD1 4.02Å; L300-Y417 HydrophobicContact CD2-CD2 4.48Å; L300-Y417 HydrophobicContact CD2-CE1 3.61Å; L300-Y417 HydrophobicContact CD2-CE2 4.11Å; L300-Y417 HydrophobicContact CD2-CG 4.44Å; L300-Y417 HydrophobicContact CG-CE1 4.18Å; L323-Y417 HydrophobicContact CB-CD2 4.37Å; L323-Y417 HydrophobicContact CB-CE2 4.12Å; L413-Y417 WeakPolarHBondContact O-CB 3.41Å; L413-Y417 PolarHBondContact O-N 2.95Å; Y417-G421 WeakPolarHBondContact O-CA 3.37Å; Y417-G421 PolarHBondContact O-N 3.3Å
418I96.6Very high93.7Very high74 Ų7428.3 Ų28.338%0.37914%0.14SC..Hα-helixtrans-71.3-44-176.9-62167.9000111.5M383 T387 P414 R416 G421 M422M383-I418 HydrophobicContact CE-CG2 3.76Å; T387-I418 HydrophobicContact CG2-CB 3.87Å; T387-I418 HydrophobicContact CG2-CG2 3.51Å; P414-I418 WeakPolarHBondContact O-CB 3.43Å; P414-I418 VanDerWaalsContact O-CG1 3.23Å; P414-I418 WeakPolarHBondContact O-CG1 3.47Å; P414-I418 PolarHBondContact O-N 3.33Å; R416-I418 PolarHBondContact O-N 3.31Å; I418-G421 PolarHBondContact O-N 3.05Å; I418-M422 PolarHBondContact O-N 3.26Å
419T96.6Very high94.3Very high0 Ų025 Ų250%013%0.125CC..Hα-helixtrans-60.8-50.9-180-63.50000110.6R380 M383 K384 T387 Y415 R416 M422 V423R380-T419 HydrophobicContact CG-CG2 4Å; M383-T419 HydrophobicContact CB-CG2 4.07Å; K384-T419 HydrophobicContact CG-CG2 3.91Å; T387-T419 PolarHBondContact OG1-OG1 3.42Å; Y415-T419 WeakPolarHBondContact O-CB 3.39Å; Y415-T419 PolarHBondContact O-N 2.89Å; Y415-T419 PolarHBondContact O-OG1 2.7Å; R416-T419 PolarHBondContact O-N 2.95Å; T419-M422 PolarHBondContact O-N 2.97Å; T419-V423 WeakPolarHBondContact O-CG2 3.25Å; T419-V423 PolarHBondContact O-N 3.02Å
420Y96.6Very high94.9Very high9 Ų925.3 Ų25.34%0.03512%0.124CC..Hα-helixtrans-75.6-27.3-177.1-72.7-83.1000112.5E141 I145 E321 R380 R416 V423 G424E141-Y420 VanDerWaalsContact OE1-CE1 3.25Å; E141-Y420 WeakPolarHBondContact OE1-CE1 3.3Å; E141-Y420 VanDerWaalsContact OE1-CZ 3.32Å; E141-Y420 PolarHBondContact OE1-OH 3.11Å; I145-Y420 HydrophobicContact CD1-CE1 4.5Å; E321-Y420 HydrophobicContact CB-CD2 4.03Å; E321-Y420 HydrophobicContact CB-CE2 4.36Å; E321-Y420 HydrophobicContact CB-CG 4.37Å; E321-Y420 VanDerWaalsContact CD-CE2 3.42Å; E321-Y420 HydrophobicContact CG-CD1 3.85Å; E321-Y420 HydrophobicContact CG-CD2 3.6Å; E321-Y420 HydrophobicContact CG-CE1 3.99Å; E321-Y420 HydrophobicContact CG-CE2 3.8Å; E321-Y420 HydrophobicContact CG-CG 3.64Å; E321-Y420 WeakPolarHBondContact OE1-CE1 3.36Å; E321-Y420 PolarHBondContact OE1-OH 2.89Å; E321-Y420 WeakPolarHBondContact OE2-CE2 3.27Å; R380-Y420 PolarHBondContact NE-OH 3.06Å; R380-Y420 PolarHBondContact NH2-OH 3.48Å; R416-Y420 HydrophobicContact CB-CD2 4.32Å; R416-Y420 WeakPolarHBondContact O-CB 3.47Å; R416-Y420 WeakPolarHBondContact O-CD2 3.04Å; R416-Y420 PolarHBondContact O-N 2.96Å; Y420-V423 PolarHBondContact O-N 3.42Å; Y420-G424 PolarHBondContact O-N 3.19Å
421G97.8Very high95.3Very high11 Ų1121.5 Ų21.511%0.11311%0.106CC..Hα-helixtrans-59.7-45.5165.700000112.9G324 G328 Y417 I418 G424 F425G324-G421 WeakPolarHBondContact O-CA 3.39Å; G328-G421 WeakPolarHBondContact CA-O 3.48Å; Y417-G421 WeakPolarHBondContact O-CA 3.37Å; Y417-G421 PolarHBondContact O-N 3.3Å; I418-G421 PolarHBondContact O-N 3.05Å; G421-G424 PolarHBondContact O-N 3.12Å; G421-F425 VanDerWaalsContact O-CB 3.31Å; G421-F425 WeakPolarHBondContact O-CB 3.39Å; G421-F425 PolarHBondContact O-N 3.23Å
422M98.1Very high95.6Very high61 Ų6122.2 Ų22.230%0.311%0.111SC..Hα-helixtrans-70.1-33.3176-73.8-51.4-55.800113.3V379 M383 I418 T419 F425 S426 F430V379-M422 HydrophobicContact CG1-CB 4.2Å; M383-M422 HydrophobicContact CE-CB 4.2Å; M383-M422 HydrophobicContact CE-CG 3.57Å; M383-M422 HydrophobicContact CG-CB 3.83Å; M383-M422 HydrophobicContact CG-CG 4.22Å; M383-M422 HydrophobicContact SD-CB 4.21Å; M383-M422 HydrophobicContact SD-CG 3.94Å; I418-M422 PolarHBondContact O-N 3.26Å; T419-M422 PolarHBondContact O-N 2.97Å; M422-F425 HydrophobicContact CE-CD1 4.12Å; M422-S426 VanDerWaalsContact O-CB 3.31Å; M422-S426 WeakPolarHBondContact O-CB 3.49Å; M422-S426 PolarHBondContact O-N 2.88Å; M422-S426 PolarHBondContact O-OG 3.48Å; M422-F430 HydrophobicContact CE-CE2 4.1Å
423V97.6Very high95.9Very high5 Ų526.2 Ų26.23%0.0313%0.126CC..Hα-helixtrans-60.9-51.2170.11630000110.4V376 V379 R380 T419 Y420 F425 S426 I427V376-V423 HydrophobicContact CG1-CG1 3.66Å; V376-V423 HydrophobicContact CG1-CG2 4.41Å; V379-V423 HydrophobicContact CG1-CG2 4.45Å; R380-V423 HydrophobicContact CB-CG2 3.84Å; R380-V423 HydrophobicContact CG-CG2 4.33Å; T419-V423 WeakPolarHBondContact O-CG2 3.25Å; T419-V423 PolarHBondContact O-N 3.02Å; Y420-V423 PolarHBondContact O-N 3.42Å; V423-F425 PolarHBondContact O-N 2.95Å; V423-S426 WeakPolarHBondContact O-CB 3.49Å; V423-S426 PolarHBondContact O-N 3.5Å; V423-S426 VanDerWaalsContact O-N 3.16Å; V423-I427 HydrophobicContact CG1-CD1 3.84Å; V423-I427 WeakPolarHBondContact O-CG1 3.32Å; V423-I427 PolarHBondContact O-N 3.47Å
424G97.8Very high96.1Very high1 Ų127.6 Ų27.61%0.0113%0.133CC..Hα-helixtrans-58.3-45.3177.400000112.8I329 Y420 G421 S426 I427 T428I329-G424 WeakPolarHBondContact CG1-O 3.47Å; Y420-G424 PolarHBondContact O-N 3.19Å; G421-G424 PolarHBondContact O-N 3.12Å; G424-S426 VanDerWaalsContact C-N 3.32Å; G424-S426 PolarHBondContact O-N 2.76Å; G424-I427 WeakPolarHBondContact O-CB 3.14Å; G424-I427 PolarHBondContact O-N 3.17Å; G424-T428 PolarHBondContact O-N 3.4Å; G424-T428 PolarHBondContact O-OG1 3.48Å
425F98.3Very high96.2Very high37 Ų3725.9 Ų25.916%0.16212%0.121CC..Hα-helixtrans-60.9-41.5175.4-175.4-92.6000111.8G328 C331 G332 V335 G421 M422 V423 I427 T428 F429 F430G328-F425 VanDerWaalsContact C-N 3.34Å; G328-F425 VanDerWaalsContact O-CA 3.24Å; G328-F425 WeakPolarHBondContact O-CA 3.42Å; G328-F425 PolarHBondContact O-N 3.05Å; C331-F425 HydrophobicContact CB-CD2 4.09Å; C331-F425 HydrophobicContact CB-CE2 4.43Å; G332-F425 VanDerWaalsContact N-CD2 3.32Å; V335-F425 HydrophobicContact CG2-CE2 3.93Å; V335-F425 HydrophobicContact CG2-CZ 4.09Å; G421-F425 VanDerWaalsContact O-CB 3.31Å; G421-F425 WeakPolarHBondContact O-CB 3.39Å; G421-F425 PolarHBondContact O-N 3.23Å; M422-F425 HydrophobicContact CE-CD1 4.12Å; V423-F425 PolarHBondContact O-N 2.95Å; F425-I427 VanDerWaalsContact C-N 3.33Å; F425-I427 PolarHBondContact O-N 3.06Å; F425-T428 PolarHBondContact O-N 3.46Å; F425-F429 HydrophobicContact CD1-CD1 4.28Å; F425-F429 HydrophobicContact CE1-CB 4.25Å; F425-F429 AromaticContact CE1-CD1 3.39Å; F425-F429 HydrophobicContact CE1-CD1 3.39Å; F425-F429 HydrophobicContact CE1-CE1 4.16Å; F425-F429 HydrophobicContact CE1-CG 4.2Å; F425-F429 HydrophobicContact CZ-CB 4.32Å; F425-F429 AromaticContact CZ-CD1 3.63Å; F425-F429 HydrophobicContact CZ-CD1 3.63Å; F425-F429 HydrophobicContact CZ-CE1 4.31Å; F425-F429 HydrophobicContact CZ-CG 4.2Å; F425-F429 WeakPolarHBondContact O-CB 3.36Å; F425-F429 PolarHBondContact O-N 2.97Å; F425-F430 AromaticContact CD1-CD2 3.86Å; F425-F430 HydrophobicContact CD1-CD2 3.86Å; F425-F430 AromaticContact CD1-CE2 3.62Å; F425-F430 HydrophobicContact CD1-CE2 3.62Å; F425-F430 HydrophobicContact CD1-CZ 4.44Å; F425-F430 HydrophobicContact CE1-CD2 4.01Å; F425-F430 AromaticContact CE1-CE2 3.53Å; F425-F430 HydrophobicContact CE1-CE2 3.53Å; F425-F430 AromaticContact CE1-CZ 3.9Å; F425-F430 HydrophobicContact CE1-CZ 3.9Å
426S97.9Very high96.2Very high0 Ų031.3 Ų31.30%015%0.145CC..Iπ-helixtrans-65.1-37.5177.8-60.10000112.3M422 V423 G424 T428 F430 V431M422-S426 VanDerWaalsContact O-CB 3.31Å; M422-S426 WeakPolarHBondContact O-CB 3.49Å; M422-S426 PolarHBondContact O-N 2.88Å; M422-S426 PolarHBondContact O-OG 3.48Å; V423-S426 WeakPolarHBondContact O-CB 3.49Å; V423-S426 PolarHBondContact O-N 3.5Å; V423-S426 VanDerWaalsContact O-N 3.16Å; G424-S426 VanDerWaalsContact C-N 3.32Å; G424-S426 PolarHBondContact O-N 2.76Å; S426-T428 VanDerWaalsContact C-N 3.33Å; S426-T428 PolarHBondContact O-N 2.91Å; S426-F430 PolarHBondContact O-N 2.92Å; S426-V431 WeakPolarHBondContact O-CB 3.5Å; S426-V431 WeakPolarHBondContact O-CG2 3.49Å; S426-V431 PolarHBondContact O-N 3.13Å
427I97.4Very high96.2Very high8 Ų838.1 Ų38.14%0.04118%0.176CC..Iπ-helixtrans-61.3-41.7178.3-72159.3000111.3P149 I152 W153 V376 V423 G424 F425 P432P149-I427 HydrophobicContact CB-CG2 4.05Å; P149-I427 HydrophobicContact CG-CD1 3.7Å; P149-I427 HydrophobicContact CG-CG1 3.86Å; P149-I427 HydrophobicContact CG-CG2 3.82Å; I152-I427 HydrophobicContact CD1-CG2 3.82Å; W153-I427 HydrophobicContact CZ2-CB 4.36Å; W153-I427 HydrophobicContact CZ2-CG1 4.14Å; W153-I427 HydrophobicContact CZ2-CG2 4.23Å; W153-I427 PolarHBondContact NE1-O 3.37Å; V376-I427 HydrophobicContact CG2-CG1 3.79Å; V423-I427 HydrophobicContact CG1-CD1 3.84Å; V423-I427 WeakPolarHBondContact O-CG1 3.32Å; V423-I427 PolarHBondContact O-N 3.47Å; G424-I427 WeakPolarHBondContact O-CB 3.14Å; G424-I427 PolarHBondContact O-N 3.17Å; F425-I427 VanDerWaalsContact C-N 3.33Å; F425-I427 PolarHBondContact O-N 3.06Å; I427-P432 VanDerWaalsContact O-CD 3.24Å; I427-P432 WeakPolarHBondContact O-CD 3.45Å
428T96.3Very high96.1Very high6 Ų640.2 Ų40.24%0.03719%0.189CC..Iπ-helixtrans-94-18.5-176.146.80000114.8I152 I329 G332 S333 T336 G424 F425 S426I152-T428 HydrophobicContact CD1-CG2 3.91Å; I152-T428 HydrophobicContact CG2-CG2 4.47Å; I329-T428 HydrophobicContact CB-CG2 4.28Å; I329-T428 HydrophobicContact CG1-CG2 4.39Å; I329-T428 HydrophobicContact CG2-CG2 3.73Å; I329-T428 PolarHBondContact O-OG1 3.04Å; G332-T428 VanDerWaalsContact CA-OG1 3.26Å; G332-T428 WeakPolarHBondContact CA-OG1 3.45Å; S333-T428 PolarHBondContact N-OG1 2.98Å; S333-T428 WeakPolarHBondContact OG-CG2 3.35Å; T336-T428 PolarHBondContact OG1-O 3.41Å; G424-T428 PolarHBondContact O-N 3.4Å; G424-T428 PolarHBondContact O-OG1 3.48Å; F425-T428 PolarHBondContact O-N 3.46Å; S426-T428 VanDerWaalsContact C-N 3.33Å; S426-T428 PolarHBondContact O-N 2.91Å
429F96.4Very high95.8Very high18 Ų1839.5 Ų39.58%0.07920%0.199CC..Iπ-helixtrans-120.6-70.7-178.4174.9-116000114.3V335 T336 M339 L341 F425 V431 P432 Y433V335-F429 HydrophobicContact CB-CD2 4.18Å; V335-F429 HydrophobicContact CB-CG 4.34Å; V335-F429 HydrophobicContact CG1-CD1 4.28Å; V335-F429 HydrophobicContact CG1-CD2 3.61Å; V335-F429 HydrophobicContact CG1-CE1 4.16Å; V335-F429 HydrophobicContact CG1-CE2 3.52Å; V335-F429 HydrophobicContact CG1-CG 4.01Å; V335-F429 HydrophobicContact CG1-CZ 3.79Å; T336-F429 WeakPolarHBondContact OG1-CA 3.33Å; M339-F429 HydrophobicContact CE-CE2 3.94Å; M339-F429 HydrophobicContact CE-CZ 3.75Å; M339-F429 HydrophobicContact SD-CE2 3.45Å; M339-F429 WeakPolarHBondContact SD-CE2 3.48Å; M339-F429 HydrophobicContact SD-CZ 3.8Å; L341-F429 HydrophobicContact CD1-CD2 4.13Å; L341-F429 HydrophobicContact CD1-CE2 3.96Å; F425-F429 HydrophobicContact CD1-CD1 4.28Å; F425-F429 HydrophobicContact CE1-CB 4.25Å; F425-F429 AromaticContact CE1-CD1 3.39Å; F425-F429 HydrophobicContact CE1-CD1 3.39Å; F425-F429 HydrophobicContact CE1-CE1 4.16Å; F425-F429 HydrophobicContact CE1-CG 4.2Å; F425-F429 HydrophobicContact CZ-CB 4.32Å; F425-F429 AromaticContact CZ-CD1 3.63Å; F425-F429 HydrophobicContact CZ-CD1 3.63Å; F425-F429 HydrophobicContact CZ-CE1 4.31Å; F425-F429 HydrophobicContact CZ-CG 4.2Å; F425-F429 WeakPolarHBondContact O-CB 3.36Å; F425-F429 PolarHBondContact O-N 2.97Å; F429-V431 VanDerWaalsContact C-N 3.34Å; F429-V431 PolarHBondContact O-N 2.84Å; F429-P432 WeakPolarHBondContact O-CD 3.41Å; F429-Y433 WeakPolarHBondContact O-CB 3.47Å; F429-Y433 PolarHBondContact O-N 3.16Å
430F96.9Very high95.6Very high76 Ų7640.4 Ų40.433%0.33320%0.204SC..Iπ-helixtrans-60.2-42.1-171-73.6-56.9000113F375 M422 F425 S426 Y433 I434F375-F430 HydrophobicContact CE1-CB 3.71Å; F375-F430 HydrophobicContact CE1-CG 4.42Å; F375-F430 HydrophobicContact CZ-CB 3.91Å; F375-F430 HydrophobicContact CZ-CG 4.39Å; M422-F430 HydrophobicContact CE-CE2 4.1Å; F425-F430 AromaticContact CD1-CD2 3.86Å; F425-F430 HydrophobicContact CD1-CD2 3.86Å; F425-F430 AromaticContact CD1-CE2 3.62Å; F425-F430 HydrophobicContact CD1-CE2 3.62Å; F425-F430 HydrophobicContact CD1-CZ 4.44Å; F425-F430 HydrophobicContact CE1-CD2 4.01Å; F425-F430 AromaticContact CE1-CE2 3.53Å; F425-F430 HydrophobicContact CE1-CE2 3.53Å; F425-F430 AromaticContact CE1-CZ 3.9Å; F425-F430 HydrophobicContact CE1-CZ 3.9Å; S426-F430 PolarHBondContact O-N 2.92Å; F430-Y433 PolarHBondContact O-N 3.16Å; F430-I434 VanDerWaalsContact O-CG1 3.27Å; F430-I434 WeakPolarHBondContact O-CG1 3.48Å; F430-I434 PolarHBondContact O-N 2.82Å
431V96.5Very high95Very high1 Ų144.1 Ų44.11%0.00623%0.231CC..Hα-helixtrans-69.1-49.8-1791730000111.6W153 F375 V376 S426 F429 Y433 I434 F435W153-V431 HydrophobicContact CD2-CG1 4.21Å; W153-V431 HydrophobicContact CH2-CG1 4.13Å; W153-V431 HydrophobicContact CZ2-CB 3.91Å; W153-V431 HydrophobicContact CZ2-CG1 3.51Å; W153-V431 HydrophobicContact CZ2-CG2 4.09Å; F375-V431 HydrophobicContact CB-CG2 4.17Å; F375-V431 HydrophobicContact CD1-CG2 3.52Å; F375-V431 HydrophobicContact CE1-CG2 4.25Å; F375-V431 HydrophobicContact CG-CG2 4.08Å; V376-V431 HydrophobicContact CG2-CG2 4.28Å; S426-V431 WeakPolarHBondContact O-CB 3.5Å; S426-V431 WeakPolarHBondContact O-CG2 3.49Å; S426-V431 PolarHBondContact O-N 3.13Å; F429-V431 VanDerWaalsContact C-N 3.34Å; F429-V431 PolarHBondContact O-N 2.84Å; V431-Y433 VanDerWaalsContact C-N 3.26Å; V431-Y433 PolarHBondContact O-N 3.12Å; V431-I434 WeakPolarHBondContact O-CB 3.3Å; V431-I434 PolarHBondContact O-N 3.21Å; V431-I434 VanDerWaalsContact O-N 3.09Å; V431-F435 HydrophobicContact CG1-CD1 4.29Å; V431-F435 HydrophobicContact CG1-CD2 4.22Å; V431-F435 HydrophobicContact CG1-CE1 3.59Å; V431-F435 HydrophobicContact CG1-CE2 3.49Å; V431-F435 VanDerWaalsContact CG1-CE2 3.49Å; V431-F435 HydrophobicContact CG1-CZ 3.12Å; V431-F435 WeakPolarHBondContact O-CG 3.29Å; V431-F435 PolarHBondContact O-N 3.04Å
432P94.6Very high94.8Very high14 Ų1445.8 Ų45.89%0.09124%0.237CC..Hα-helixtrans-55.4-38.6171.1-3137.9000113.9I427 F429 F435 F436I427-P432 VanDerWaalsContact O-CD 3.24Å; I427-P432 WeakPolarHBondContact O-CD 3.45Å; F429-P432 WeakPolarHBondContact O-CD 3.41Å; P432-F435 PolarHBondContact O-N 3.43Å; P432-F436 PolarHBondContact O-N 3.46Å
433Y94.6Very high94.7Very high106 Ų10645 Ų4542%0.41623%0.234SC..Hα-helixtrans-62.2-42.8174.5-178.1-100.4000112.3L341 F429 F430 V431 F435 F436 F437L341-Y433 HydrophobicContact CD1-CD2 3.95Å; L341-Y433 HydrophobicContact CD2-CD2 4.1Å; F429-Y433 WeakPolarHBondContact O-CB 3.47Å; F429-Y433 PolarHBondContact O-N 3.16Å; F430-Y433 PolarHBondContact O-N 3.16Å; V431-Y433 VanDerWaalsContact C-N 3.26Å; V431-Y433 PolarHBondContact O-N 3.12Å; Y433-F435 VanDerWaalsContact C-N 3.34Å; Y433-F435 PolarHBondContact O-N 3.08Å; Y433-F436 PolarHBondContact O-N 2.99Å; Y433-F437 WeakPolarHBondContact O-CB 3.27Å; Y433-F437 PolarHBondContact O-N 3.48Å
434I94.8Very high94.5Very high46 Ų4647.2 Ų47.224%0.23625%0.245CC..Hα-helixtrans-60.7-44.1173.4-70.3163000110.5I371 F375 F430 V431 F436 F437 I438I371-I434 HydrophobicContact CG2-CG2 4.37Å; F375-I434 HydrophobicContact CD2-CD1 3.57Å; F375-I434 HydrophobicContact CE2-CD1 3.55Å; F375-I434 HydrophobicContact CG-CD1 4.11Å; F375-I434 HydrophobicContact CZ-CD1 4.07Å; F430-I434 VanDerWaalsContact O-CG1 3.27Å; F430-I434 WeakPolarHBondContact O-CG1 3.48Å; F430-I434 PolarHBondContact O-N 2.82Å; V431-I434 WeakPolarHBondContact O-CB 3.3Å; V431-I434 PolarHBondContact O-N 3.21Å; V431-I434 VanDerWaalsContact O-N 3.09Å; I434-F436 VanDerWaalsContact C-N 3.34Å; I434-F436 PolarHBondContact O-N 2.94Å; I434-F437 PolarHBondContact O-N 3.19Å; I434-I438 HydrophobicContact CG2-CD1 4.05Å; I434-I438 VanDerWaalsContact O-CG1 3.28Å; I434-I438 WeakPolarHBondContact O-CG1 3.23Å; I434-I438 PolarHBondContact O-N 3.42Å
435F94.6Very high94.3Very high5 Ų549.9 Ų49.92%0.02226%0.259CS..Hα-helixtrans-61.9-41.7178.6-62.9-17.6000112.6W153 R368 I371 V431 P432 Y433 G439 I440 S441W153-F435 HydrophobicContact CB-CE2 3.85Å; W153-F435 AromaticContact CD1-CE2 3.89Å; W153-F435 AromaticContact CD2-CE2 3.9Å; W153-F435 HydrophobicContact CD2-CE2 3.9Å; W153-F435 HydrophobicContact CD2-CZ 4.12Å; W153-F435 HydrophobicContact CE3-CE2 4.44Å; W153-F435 HydrophobicContact CE3-CZ 4.27Å; W153-F435 AromaticContact CG-CE2 3.61Å; W153-F435 HydrophobicContact CG-CE2 3.61Å; W153-F435 HydrophobicContact CG-CZ 4.3Å; R368-F435 HydrophobicContact CB-CD2 4.46Å; R368-F435 HydrophobicContact CB-CE1 4.17Å; R368-F435 HydrophobicContact CB-CE2 3.8Å; R368-F435 HydrophobicContact CB-CZ 3.62Å; R368-F435 HydrophobicContact CG-CD1 4.39Å; R368-F435 HydrophobicContact CG-CD2 4Å; R368-F435 HydrophobicContact CG-CE1 4.24Å; R368-F435 HydrophobicContact CG-CE2 3.84Å; R368-F435 HydrophobicContact CG-CG 4.28Å; R368-F435 HydrophobicContact CG-CZ 3.96Å; R368-F435 WeakPolarHBondContact O-CZ 3.33Å; I371-F435 HydrophobicContact CB-CE1 4.32Å; I371-F435 HydrophobicContact CG2-CE1 4.21Å; V431-F435 HydrophobicContact CG1-CD1 4.29Å; V431-F435 HydrophobicContact CG1-CD2 4.22Å; V431-F435 HydrophobicContact CG1-CE1 3.59Å; V431-F435 HydrophobicContact CG1-CE2 3.49Å; V431-F435 VanDerWaalsContact CG1-CE2 3.49Å; V431-F435 HydrophobicContact CG1-CZ 3.12Å; V431-F435 WeakPolarHBondContact O-CG 3.29Å; V431-F435 PolarHBondContact O-N 3.04Å; P432-F435 PolarHBondContact O-N 3.43Å; Y433-F435 VanDerWaalsContact C-N 3.34Å; Y433-F435 PolarHBondContact O-N 3.08Å; F435-G439 PolarHBondContact O-N 3.35Å; F435-G439 VanDerWaalsContact O-N 3.14Å; F435-I440 HydrophobicContact CB-CG1 3.89Å; F435-I440 HydrophobicContact CD1-CD1 3.73Å; F435-I440 HydrophobicContact CD1-CG1 3.9Å; F435-I440 HydrophobicContact CE1-CD1 4.2Å; F435-I440 HydrophobicContact CG-CD1 4.36Å; F435-I440 HydrophobicContact CG-CG1 4.08Å; F435-I440 PolarHBondContact O-N 3.36Å; F435-S441 PolarHBondContact O-N 2.85Å; F435-S441 VanDerWaalsContact O-N 3.12Å
436F92Very high94.1Very high128 Ų12850.8 Ų50.856%0.56127%0.265SS*.Hα-helixtrans-60.3-48.9173.2177.6-98.5000111L341 P432 Y433 I434 I438 G439L341-F436 HydrophobicContact CD2-CB 4.41Å; L341-F436 HydrophobicContact CD2-CD1 4.22Å; L341-F436 HydrophobicContact CD2-CG 4.18Å; P432-F436 PolarHBondContact O-N 3.46Å; Y433-F436 PolarHBondContact O-N 2.99Å; I434-F436 VanDerWaalsContact C-N 3.34Å; I434-F436 PolarHBondContact O-N 2.94Å; F436-I438 PolarHBondContact O-N 2.93Å; F436-G439 PolarHBondContact O-N 2.82Å
437F92.1Very high93.8Very high161 Ų16154.1 Ų54.171%0.70628%0.283SS*.Hα-helixtrans-61.7-40.6-178.5-175-96.3000113.4Y433 I434 G439Y433-F437 WeakPolarHBondContact O-CB 3.27Å; Y433-F437 PolarHBondContact O-N 3.48Å; I434-F437 PolarHBondContact O-N 3.19Å; F437-G439 VanDerWaalsContact C-N 3.33Å
438I93.8Very high93.5Very high78 Ų7857.4 Ų57.440%0.430%0.3SS..THydrogen-bonded Turntrans-89.25.3179.772-168.9000113.5I371 I434 F436 I440I371-I438 HydrophobicContact CD1-CD1 3.86Å; I434-I438 HydrophobicContact CG2-CD1 4.05Å; I434-I438 VanDerWaalsContact O-CG1 3.28Å; I434-I438 WeakPolarHBondContact O-CG1 3.23Å; I434-I438 PolarHBondContact O-N 3.42Å; F436-I438 PolarHBondContact O-N 2.93Å; I438-I440 HydrophobicContact CD1-CD1 3.56Å; I438-I440 HydrophobicContact CD1-CG1 3.81Å; I438-I440 HydrophobicContact CG1-CB 4.36Å; I438-I440 HydrophobicContact CG1-CD1 4Å; I438-I440 HydrophobicContact CG1-CG1 3.66Å; I438-I440 HydrophobicContact CG1-CG2 4.13Å; I438-I440 PolarHBondContact O-N 2.97Å
439G91.8Very high93.3Very high58 Ų5861.4 Ų61.460%0.59832%0.32SS*.THydrogen-bonded Turntrans72.823174.500000115.1F435 F436 F437F435-G439 PolarHBondContact O-N 3.35Å; F435-G439 VanDerWaalsContact O-N 3.14Å; F436-G439 PolarHBondContact O-N 2.82Å; F437-G439 VanDerWaalsContact C-N 3.33Å
440I92Very high93.1Very high19 Ų1965 Ų6510%0.09734%0.34CS..  trans-1095.4177.374.1174.1000113.4L367 R368 I371 F435 I438L367-I440 HydrophobicContact CD2-CD1 4.12Å; L367-I440 HydrophobicContact CD2-CG2 4.05Å; L367-I440 HydrophobicContact CG-CD1 4.07Å; R368-I440 HydrophobicContact CG-CD1 3.99Å; R368-I440 HydrophobicContact CG-CG1 4.27Å; R368-I440 PolarHBondContact NE-O 3.03Å; R368-I440 PolarHBondContact NH2-O 3.35Å; I371-I440 HydrophobicContact CD1-CD1 3.99Å; F435-I440 HydrophobicContact CB-CG1 3.89Å; F435-I440 HydrophobicContact CD1-CD1 3.73Å; F435-I440 HydrophobicContact CD1-CG1 3.9Å; F435-I440 HydrophobicContact CE1-CD1 4.2Å; F435-I440 HydrophobicContact CG-CD1 4.36Å; F435-I440 HydrophobicContact CG-CG1 4.08Å; F435-I440 PolarHBondContact O-N 3.36Å; I438-I440 HydrophobicContact CD1-CD1 3.56Å; I438-I440 HydrophobicContact CD1-CG1 3.81Å; I438-I440 HydrophobicContact CG1-CB 4.36Å; I438-I440 HydrophobicContact CG1-CD1 4Å; I438-I440 HydrophobicContact CG1-CG1 3.66Å; I438-I440 HydrophobicContact CG1-CG2 4.13Å; I438-I440 PolarHBondContact O-N 2.97Å
441S83.4Confident92.7Very high88 Ų8864 Ų6462%0.61534%0.341SS*.  trans-54.60177.2-1710000113.9R368 F435R368-S441 PolarHBondContact NH2-O 3.34Å; R368-S441 PolarHBondContact NH2-OXT 3.35Å; F435-S441 PolarHBondContact O-N 2.85Å; F435-S441 VanDerWaalsContact O-N 3.12Å

Retrieved 441 of 441 residues in 1191.6 ms (Link to these results)

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