X5LX61_CAEEL Loading...

TLC domain-containing protein

AlphaFold DB , UniProt , Accession X5LX61, Species CAEEL (Caenorhabditis elegans), Gene hyl-1, Length 365 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
1M53.8Low83.6Confident207 Ų20788.6 Ų88.6100%1.0242%0.423SS*.  0-26.30-81.8-171.7171.100113.8Y3 W5M1-Y3 PolarHBondContact O-N 2.78Å; M1-W5 VanDerWaalsContact O-CD1 3.28Å
2S66Low84.3Confident109 Ų10982 Ų8276%0.76239%0.393SS*.THydrogen-bonded Turntrans-66.4-33.8-174.462.30000115.7F4 W5S2-F4 PolarHBondContact O-N 3.02Å; S2-W5 PolarHBondContact O-N 2.92Å
3Y79.9Confident84.8Confident169 Ų16986 Ų8666%0.66340%0.402SS*.THydrogen-bonded Turntrans-69.1-35.4-175.8-169.9-101000113.8M1 W5 H6 Y9M1-Y3 PolarHBondContact O-N 2.78Å; Y3-W5 VanDerWaalsContact C-N 3.33Å; Y3-H6 VanDerWaalsContact O-CB 3.23Å; Y3-H6 WeakPolarHBondContact O-CB 3.41Å; Y3-H6 PolarHBondContact O-N 3.31Å; Y3-Y9 HydrophobicContact CD1-CE2 4.1Å; Y3-Y9 AromaticContact CE1-CE2 3.82Å; Y3-Y9 HydrophobicContact CE1-CE2 3.82Å; Y3-Y9 WeakPolarHBondContact CE1-OH 3.21Å; Y3-Y9 WeakPolarHBondContact O-CE2 3.42Å; Y3-Y9 PolarHBondContact OH-OH 3.4Å
4F85.5Confident85.2Confident120 Ų12091.3 Ų91.353%0.52643%0.434SS..THydrogen-bonded Turntrans-67.4-36.7178.2-179.2-99.8000111.8S2 H6 W10S2-F4 PolarHBondContact O-N 3.02Å; F4-H6 PolarHBondContact O-N 3.16Å; F4-W10 HydrophobicContact CD1-CZ2 4.16Å; F4-W10 HydrophobicContact CE1-CH2 4.1Å; F4-W10 AromaticContact CE1-CZ2 3.4Å; F4-W10 HydrophobicContact CE1-CZ2 3.4Å; F4-W10 VanDerWaalsContact CE1-CZ2 3.4Å; F4-W10 AromaticContact CE2-CZ2 3.89Å; F4-W10 HydrophobicContact CE2-CZ2 3.89Å; F4-W10 AromaticContact CZ-CH2 3.84Å; F4-W10 HydrophobicContact CZ-CH2 3.84Å; F4-W10 AromaticContact CZ-CZ2 3.28Å; F4-W10 HydrophobicContact CZ-CZ2 3.28Å; F4-W10 PolarHBondContact O-NE1 3.2Å
5W89.2Confident85.7Confident70 Ų7085.9 Ų85.927%0.26541%0.41SS..THydrogen-bonded Turntrans-84.816178.8-65.6113.5000113.4M1 S2 Y3 E7 W17 F24 T181M1-W5 VanDerWaalsContact O-CD1 3.28Å; S2-W5 PolarHBondContact O-N 2.92Å; Y3-W5 VanDerWaalsContact C-N 3.33Å; W5-E7 PolarHBondContact O-N 2.94Å; W5-W17 HydrophobicContact CE3-CH2 4.04Å; W5-W17 AromaticContact CE3-CZ2 3.64Å; W5-W17 HydrophobicContact CE3-CZ2 3.64Å; W5-W17 HydrophobicContact CZ3-CH2 4.01Å; W5-W17 HydrophobicContact CZ3-CZ2 4.1Å; W5-W17 PolarHBondContact O-NE1 2.91Å; W5-F24 HydrophobicContact CH2-CB 4.48Å; W5-F24 AromaticContact CH2-CD1 3.88Å; W5-F24 HydrophobicContact CH2-CD1 3.88Å; W5-F24 AromaticContact CH2-CD2 3.32Å; W5-F24 HydrophobicContact CH2-CD2 3.32Å; W5-F24 AromaticContact CH2-CE1 3.89Å; W5-F24 HydrophobicContact CH2-CE1 3.89Å; W5-F24 AromaticContact CH2-CE2 3.34Å; W5-F24 HydrophobicContact CH2-CE2 3.34Å; W5-F24 AromaticContact CH2-CG 3.6Å; W5-F24 HydrophobicContact CH2-CG 3.6Å; W5-F24 AromaticContact CH2-CZ 3.63Å; W5-F24 HydrophobicContact CH2-CZ 3.63Å; W5-F24 AromaticContact CZ2-CD1 3.89Å; W5-F24 HydrophobicContact CZ2-CD1 3.89Å; W5-F24 HydrophobicContact CZ2-CD2 4.06Å; W5-F24 AromaticContact CZ2-CE1 3.59Å; W5-F24 HydrophobicContact CZ2-CE1 3.59Å; W5-F24 AromaticContact CZ2-CE2 3.8Å; W5-F24 HydrophobicContact CZ2-CE2 3.8Å; W5-F24 HydrophobicContact CZ2-CG 4.11Å; W5-F24 AromaticContact CZ2-CZ 3.54Å; W5-F24 HydrophobicContact CZ2-CZ 3.54Å; W5-F24 HydrophobicContact CZ3-CD2 4.06Å; W5-F24 HydrophobicContact CZ3-CE2 4.45Å; W5-F24 HydrophobicContact CZ3-CG 4.19Å; W5-T181 HydrophobicContact CH2-CG2 4.38Å; W5-T181 HydrophobicContact CZ3-CG2 3.9Å
6H90.8Very high86.3Confident94 Ų9483.6 Ų83.644%0.43540%0.403SS..  trans-65123.2175.7-168.8-112.8000110Y3 F4 P8 Y9Y3-H6 VanDerWaalsContact O-CB 3.23Å; Y3-H6 WeakPolarHBondContact O-CB 3.41Å; Y3-H6 PolarHBondContact O-N 3.31Å; F4-H6 PolarHBondContact O-N 3.16Å; H6-P8 WeakPolarHBondContact ND1-CD 3.25Å; H6-Y9 HydrophobicContact CB-CD2 4.01Å; H6-Y9 HydrophobicContact CB-CE2 4.16Å; H6-Y9 HydrophobicContact CB-CG 4.42Å; H6-Y9 WeakPolarHBondContact O-CB 3.42Å; H6-Y9 PolarHBondContact O-N 3.32Å
7E91.5Very high86.8Confident63 Ų6381.9 Ų81.929%0.29439%0.391SS..Hα-helixtrans-55.8-45-167.9-67.6168.916200114W5 Y9 W10 L11 T16 W17W5-E7 PolarHBondContact O-N 2.94Å; E7-Y9 PolarHBondContact O-N 3.44Å; E7-W10 PolarHBondContact O-N 3.33Å; E7-L11 HydrophobicContact CG-CD1 4.46Å; E7-L11 PolarHBondContact O-N 3.18Å; E7-T16 WeakPolarHBondContact OE1-CA 3.42Å; E7-T16 WeakPolarHBondContact OE1-CB 3.22Å; E7-W17 HydrophobicContact CG-CG 4.33Å; E7-W17 PolarHBondContact OE1-N 3.18Å; E7-W17 VanDerWaalsContact OE1-N 3.14Å
8P88.7Confident87.2Confident52 Ų5283 Ų8334%0.33841%0.406SS..Hα-helixtrans-52.6-24.1174.2-31.135.8000114.5H6 W10 P266 P267H6-P8 WeakPolarHBondContact ND1-CD 3.25Å; P8-W10 VanDerWaalsContact C-N 3.31Å; P8-W10 PolarHBondContact O-N 3.19Å; P8-P266 HydrophobicContact CB-CB 4Å; P8-P266 HydrophobicContact CB-CG 4.42Å; P8-P266 WeakPolarHBondContact O-CB 3.45Å; P8-P267 VanDerWaalsContact O-CA 3.23Å; P8-P267 WeakPolarHBondContact O-CA 3.39Å
9Y89.3Confident87.7Confident59 Ų5983.3 Ų83.323%0.23141%0.406CS..Hα-helixtrans-73.1-27.2179.2-64-13.6000113.6Y3 H6 E7 Y268 A269Y3-Y9 HydrophobicContact CD1-CE2 4.1Å; Y3-Y9 AromaticContact CE1-CE2 3.82Å; Y3-Y9 HydrophobicContact CE1-CE2 3.82Å; Y3-Y9 WeakPolarHBondContact CE1-OH 3.21Å; Y3-Y9 WeakPolarHBondContact O-CE2 3.42Å; Y3-Y9 PolarHBondContact OH-OH 3.4Å; H6-Y9 HydrophobicContact CB-CD2 4.01Å; H6-Y9 HydrophobicContact CB-CE2 4.16Å; H6-Y9 HydrophobicContact CB-CG 4.42Å; H6-Y9 WeakPolarHBondContact O-CB 3.42Å; H6-Y9 PolarHBondContact O-N 3.32Å; E7-Y9 PolarHBondContact O-N 3.44Å; Y9-Y268 AromaticContact CD1-CD2 3.5Å; Y9-Y268 HydrophobicContact CD1-CD2 3.5Å; Y9-Y268 VanDerWaalsContact CD1-CD2 3.5Å; Y9-Y268 AromaticContact CD1-CE2 3.38Å; Y9-Y268 HydrophobicContact CD1-CE2 3.38Å; Y9-Y268 HydrophobicContact CE1-CD2 4.15Å; Y9-Y268 AromaticContact CE1-CE2 3.63Å; Y9-Y268 HydrophobicContact CE1-CE2 3.63Å; Y9-Y268 HydrophobicContact CG-CD2 4.06Å; Y9-Y268 HydrophobicContact CG-CE2 4.36Å; Y9-Y268 PolarHBondContact O-N 2.93Å; Y9-A269 PolarHBondContact O-N 3.5Å
10W91.6Very high88.1Confident31 Ų3179.2 Ų79.212%0.11739%0.386CS..Hα-helixtrans-116-37.6-169.3-64.787.4000112.9F4 E7 P8 W17 T181 I182 A269F4-W10 HydrophobicContact CD1-CZ2 4.16Å; F4-W10 HydrophobicContact CE1-CH2 4.1Å; F4-W10 AromaticContact CE1-CZ2 3.4Å; F4-W10 HydrophobicContact CE1-CZ2 3.4Å; F4-W10 VanDerWaalsContact CE1-CZ2 3.4Å; F4-W10 AromaticContact CE2-CZ2 3.89Å; F4-W10 HydrophobicContact CE2-CZ2 3.89Å; F4-W10 AromaticContact CZ-CH2 3.84Å; F4-W10 HydrophobicContact CZ-CH2 3.84Å; F4-W10 AromaticContact CZ-CZ2 3.28Å; F4-W10 HydrophobicContact CZ-CZ2 3.28Å; F4-W10 PolarHBondContact O-NE1 3.2Å; E7-W10 PolarHBondContact O-N 3.33Å; P8-W10 VanDerWaalsContact C-N 3.31Å; P8-W10 PolarHBondContact O-N 3.19Å; W10-W17 HydrophobicContact CB-CH2 3.38Å; W10-W17 HydrophobicContact CB-CZ2 3.56Å; W10-W17 HydrophobicContact CB-CZ3 4.44Å; W10-W17 AromaticContact CD1-CZ2 3.65Å; W10-W17 HydrophobicContact CD2-CH2 4.04Å; W10-W17 HydrophobicContact CD2-CZ2 4.34Å; W10-W17 HydrophobicContact CE3-CH2 4.47Å; W10-W17 AromaticContact CG-CH2 3.54Å; W10-W17 HydrophobicContact CG-CH2 3.54Å; W10-W17 AromaticContact CG-CZ2 3.56Å; W10-W17 HydrophobicContact CG-CZ2 3.56Å; W10-T181 HydrophobicContact CE3-CG2 3.99Å; W10-T181 HydrophobicContact CZ3-CG2 4.17Å; W10-I182 HydrophobicContact CB-CG2 4.15Å; W10-I182 HydrophobicContact CE3-CG2 3.7Å; W10-A269 HydrophobicContact CD2-CB 4.15Å; W10-A269 HydrophobicContact CE3-CB 3.61Å; W10-A269 HydrophobicContact CZ3-CB 4.1Å
11L93.4Very high88.5Confident1 Ų177.7 Ų77.71%0.00538%0.383CS..SBendtrans-115.6155.2-165-55.7-179.7000112E7 V15 W17 V20 P267E7-L11 HydrophobicContact CG-CD1 4.46Å; E7-L11 PolarHBondContact O-N 3.18Å; L11-V15 HydrophobicContact CB-CB 4.23Å; L11-V15 HydrophobicContact CB-CG1 4.41Å; L11-V15 HydrophobicContact CD1-CG1 4.18Å; L11-W17 HydrophobicContact CD1-CD2 3.91Å; L11-W17 HydrophobicContact CD1-CE3 3.9Å; L11-W17 HydrophobicContact CD1-CG 4.34Å; L11-W17 HydrophobicContact CD1-CZ3 4.27Å; L11-W17 HydrophobicContact CD2-CE3 4.4Å; L11-W17 HydrophobicContact CD2-CH2 4.37Å; L11-W17 HydrophobicContact CD2-CZ3 4.02Å; L11-W17 HydrophobicContact CG-CE3 4.42Å; L11-W17 HydrophobicContact CG-CH2 4.37Å; L11-W17 HydrophobicContact CG-CZ3 4.29Å; L11-V20 HydrophobicContact CD1-CG2 3.77Å; L11-V20 HydrophobicContact CD2-CG2 3.71Å; L11-V20 HydrophobicContact CG-CG2 4.4Å; L11-P267 WeakPolarHBondContact O-CB 3.47Å
12P92.1Very high90.5Very high9 Ų968 Ų686%0.05834%0.336CS..  trans-57.5160.9170.9-22.835.3000112.2N14 V15 Y126 P127 I253P12-N14 PolarHBondContact O-N 2.96Å; P12-V15 HydrophobicContact CB-CG2 4.06Å; P12-V15 HydrophobicContact CG-CG2 4.4Å; P12-V15 PolarHBondContact O-N 3.12Å; P12-Y126 HydrophobicContact CG-CD1 4.25Å; P12-Y126 HydrophobicContact CG-CE1 3.74Å; P12-P127 HydrophobicContact CG-CG 4.31Å; P12-I253 HydrophobicContact CG-CG2 3.92Å
13R90.4Very high91.9Very high134 Ų13466.5 Ų66.551%0.50632%0.315SS..THydrogen-bonded Turntrans-56.9142.4176.1-71.3-171.9-56.4-112.3-4.1111.3V15 D256R13-V15 PolarHBondContact O-N 2.93Å; R13-D256 IonicContact CZ-OD1 3.43Å; R13-D256 IonicContact CZ-OD2 3.25Å; R13-D256 VanDerWaalsContact CZ-OD2 3.25Å; R13-D256 IonicContact NH1-OD1 3.42Å; R13-D256 PolarHBondContact NH1-OD1 3.26Å; R13-D256 IonicContact NH1-OD2 2.7Å; R13-D256 PolarHBondContact NH1-OD2 2.93Å; R13-D256 IonicContact NH2-OD1 2.66Å; R13-D256 PolarHBondContact NH2-OD1 3.06Å; R13-D256 IonicContact NH2-OD2 2.93Å; R13-D256 PolarHBondContact NH2-OD2 3Å
14N90.3Very high92.5Very high160 Ų16063.3 Ų63.386%0.85631%0.305SS*.THydrogen-bonded Turntrans63.719.8179.6-46.6-39.2000114.5P12P12-N14 PolarHBondContact O-N 2.96Å
15V93.6Very high93Very high11 Ų1162 Ų627%0.06731%0.307CS..  trans-111.1131.8171.6-176.90000109.4L11 P12 R13 E19 V20 P127 F128L11-V15 HydrophobicContact CB-CB 4.23Å; L11-V15 HydrophobicContact CB-CG1 4.41Å; L11-V15 HydrophobicContact CD1-CG1 4.18Å; P12-V15 HydrophobicContact CB-CG2 4.06Å; P12-V15 HydrophobicContact CG-CG2 4.4Å; P12-V15 PolarHBondContact O-N 3.12Å; R13-V15 PolarHBondContact O-N 2.93Å; V15-E19 HydrophobicContact CG1-CB 4.49Å; V15-V20 HydrophobicContact CG1-CG2 4.14Å; V15-P127 HydrophobicContact CB-CG 4.43Å; V15-P127 HydrophobicContact CG1-CG 3.73Å; V15-P127 HydrophobicContact CG2-CG 4.04Å; V15-F128 HydrophobicContact CG1-CE1 4.26Å; V15-F128 HydrophobicContact CG1-CZ 4.47Å; V15-F128 HydrophobicContact CG2-CZ 3.96Å
16T94.8Very high93.3Very high49 Ų4960.1 Ų60.130%0.30130%0.302SS..  trans-108.4156.8177.966.40000112.4E7 P18 E19E7-T16 WeakPolarHBondContact OE1-CA 3.42Å; E7-T16 WeakPolarHBondContact OE1-CB 3.22Å; T16-P18 VanDerWaalsContact C-CD 3.43Å; T16-E19 WeakPolarHBondContact CB-OE2 3.37Å; T16-E19 PolarHBondContact N-OE2 3.31Å; T16-E19 WeakPolarHBondContact O-CB 3.36Å; T16-E19 PolarHBondContact O-N 2.98Å; T16-E19 PolarHBondContact OG1-OE2 2.88Å
17W94.8Very high93.6Very high55 Ų5556.3 Ų56.321%0.20829%0.285CS..G310 helixtrans-54.9-38.2-179.7-70.5112.8000115.3W5 E7 W10 L11 E19 V20 K23 T181W5-W17 HydrophobicContact CE3-CH2 4.04Å; W5-W17 AromaticContact CE3-CZ2 3.64Å; W5-W17 HydrophobicContact CE3-CZ2 3.64Å; W5-W17 HydrophobicContact CZ3-CH2 4.01Å; W5-W17 HydrophobicContact CZ3-CZ2 4.1Å; W5-W17 PolarHBondContact O-NE1 2.91Å; E7-W17 HydrophobicContact CG-CG 4.33Å; E7-W17 PolarHBondContact OE1-N 3.18Å; E7-W17 VanDerWaalsContact OE1-N 3.14Å; W10-W17 HydrophobicContact CB-CH2 3.38Å; W10-W17 HydrophobicContact CB-CZ2 3.56Å; W10-W17 HydrophobicContact CB-CZ3 4.44Å; W10-W17 AromaticContact CD1-CZ2 3.65Å; W10-W17 HydrophobicContact CD2-CH2 4.04Å; W10-W17 HydrophobicContact CD2-CZ2 4.34Å; W10-W17 HydrophobicContact CE3-CH2 4.47Å; W10-W17 AromaticContact CG-CH2 3.54Å; W10-W17 HydrophobicContact CG-CH2 3.54Å; W10-W17 AromaticContact CG-CZ2 3.56Å; W10-W17 HydrophobicContact CG-CZ2 3.56Å; L11-W17 HydrophobicContact CD1-CD2 3.91Å; L11-W17 HydrophobicContact CD1-CE3 3.9Å; L11-W17 HydrophobicContact CD1-CG 4.34Å; L11-W17 HydrophobicContact CD1-CZ3 4.27Å; L11-W17 HydrophobicContact CD2-CE3 4.4Å; L11-W17 HydrophobicContact CD2-CH2 4.37Å; L11-W17 HydrophobicContact CD2-CZ3 4.02Å; L11-W17 HydrophobicContact CG-CE3 4.42Å; L11-W17 HydrophobicContact CG-CH2 4.37Å; L11-W17 HydrophobicContact CG-CZ3 4.29Å; W17-E19 PolarHBondContact O-N 3.34Å; W17-V20 PolarHBondContact O-N 3.32Å; W17-K23 PolarHBondContact O-NZ 3.33Å; W17-T181 HydrophobicContact CH2-CG2 3.85Å; W17-T181 HydrophobicContact CZ3-CG2 3.9Å
18P94.9Very high93.9Very high101 Ų10157.2 Ų57.266%0.65629%0.291SS*.G310 helixtrans-59.3-30.5176.2-27.737.4000114T16 K23T16-P18 VanDerWaalsContact C-CD 3.43Å; P18-K23 PolarHBondContact O-NZ 2.97Å
19E95Very high94.3Very high88 Ų8856.6 Ų56.641%0.41129%0.286SS..G310 helixtrans-78.3-22.9-176.9-62.1171.687.400113.1V15 T16 W17 P21 F128V15-E19 HydrophobicContact CG1-CB 4.49Å; T16-E19 WeakPolarHBondContact CB-OE2 3.37Å; T16-E19 PolarHBondContact N-OE2 3.31Å; T16-E19 WeakPolarHBondContact O-CB 3.36Å; T16-E19 PolarHBondContact O-N 2.98Å; T16-E19 PolarHBondContact OG1-OE2 2.88Å; W17-E19 PolarHBondContact O-N 3.34Å; E19-P21 VanDerWaalsContact O-CD 3.27Å; E19-P21 WeakPolarHBondContact O-CD 3.2Å; E19-F128 HydrophobicContact CB-CE1 4.05Å
20V96.3Very high94.7Very high1 Ų153.8 Ų53.81%0.00628%0.275CS..  trans-73.9119.9179.5-1760000109.6L11 V15 W17 A22 K23 N183L11-V20 HydrophobicContact CD1-CG2 3.77Å; L11-V20 HydrophobicContact CD2-CG2 3.71Å; L11-V20 HydrophobicContact CG-CG2 4.4Å; V15-V20 HydrophobicContact CG1-CG2 4.14Å; W17-V20 PolarHBondContact O-N 3.32Å; V20-A22 PolarHBondContact O-N 3.25Å; V20-K23 WeakPolarHBondContact O-CE 3.45Å; V20-K23 PolarHBondContact O-NZ 3.24Å; V20-N183 HydrophobicContact CG1-CB 3.74Å
21P96.6Very high94.9Very high48 Ų4856 Ų5631%0.31229%0.289SS..SBendtrans-61.5-43.3-176.8-29.439.1000114.2E19 K23 P127 H129E19-P21 VanDerWaalsContact O-CD 3.27Å; E19-P21 WeakPolarHBondContact O-CD 3.2Å; P21-K23 PolarHBondContact O-N 3.2Å; P21-P127 WeakPolarHBondContact CD-O 3.21Å; P21-H129 WeakPolarHBondContact CB-O 3.35Å; P21-H129 WeakPolarHBondContact CG-O 3.21Å
22A95.8Very high95.1Very high4 Ų463.9 Ų63.93%0.03332%0.32CS..SBendtrans-71.8124.8176.200000110.6V20 W180 N183 V185V20-A22 PolarHBondContact O-N 3.25Å; A22-W180 HydrophobicContact CB-CD2 4.18Å; A22-W180 HydrophobicContact CB-CG 4.46Å; A22-W180 HydrophobicContact CB-CZ2 4.16Å; A22-W180 WeakPolarHBondContact CB-O 3.36Å; A22-N183 HydrophobicContact CB-CB 4.06Å; A22-V185 HydrophobicContact CB-CG2 4.4Å
23K95Very high95.2Very high77 Ų7765.6 Ų65.634%0.33533%0.328SS..  trans-102134.6-175.8-56.4-54.1-176.1-174.30110.6W17 P18 V20 P21 V25 D26 W180W17-K23 PolarHBondContact O-NZ 3.33Å; P18-K23 PolarHBondContact O-NZ 2.97Å; V20-K23 WeakPolarHBondContact O-CE 3.45Å; V20-K23 PolarHBondContact O-NZ 3.24Å; P21-K23 PolarHBondContact O-N 3.2Å; K23-V25 HydrophobicContact CB-CG1 4.01Å; K23-V25 PolarHBondContact O-N 2.93Å; K23-D26 PolarHBondContact N-OD2 2.97Å; K23-D26 VanDerWaalsContact O-CB 3.26Å; K23-D26 WeakPolarHBondContact O-CB 3.45Å; K23-D26 VanDerWaalsContact O-CG 3.31Å; K23-D26 PolarHBondContact O-N 3.39Å; K23-W180 PolarHBondContact O-NE1 3.44Å
24F92.9Very high95.5Very high103 Ų10359.2 Ų59.245%0.45230%0.304SS..G310 helixtrans-56.5-34.5178177.9-104.2000112.6W5 D26 L27 T181W5-F24 HydrophobicContact CH2-CB 4.48Å; W5-F24 AromaticContact CH2-CD1 3.88Å; W5-F24 HydrophobicContact CH2-CD1 3.88Å; W5-F24 AromaticContact CH2-CD2 3.32Å; W5-F24 HydrophobicContact CH2-CD2 3.32Å; W5-F24 AromaticContact CH2-CE1 3.89Å; W5-F24 HydrophobicContact CH2-CE1 3.89Å; W5-F24 AromaticContact CH2-CE2 3.34Å; W5-F24 HydrophobicContact CH2-CE2 3.34Å; W5-F24 AromaticContact CH2-CG 3.6Å; W5-F24 HydrophobicContact CH2-CG 3.6Å; W5-F24 AromaticContact CH2-CZ 3.63Å; W5-F24 HydrophobicContact CH2-CZ 3.63Å; W5-F24 AromaticContact CZ2-CD1 3.89Å; W5-F24 HydrophobicContact CZ2-CD1 3.89Å; W5-F24 HydrophobicContact CZ2-CD2 4.06Å; W5-F24 AromaticContact CZ2-CE1 3.59Å; W5-F24 HydrophobicContact CZ2-CE1 3.59Å; W5-F24 AromaticContact CZ2-CE2 3.8Å; W5-F24 HydrophobicContact CZ2-CE2 3.8Å; W5-F24 HydrophobicContact CZ2-CG 4.11Å; W5-F24 AromaticContact CZ2-CZ 3.54Å; W5-F24 HydrophobicContact CZ2-CZ 3.54Å; W5-F24 HydrophobicContact CZ3-CD2 4.06Å; W5-F24 HydrophobicContact CZ3-CE2 4.45Å; W5-F24 HydrophobicContact CZ3-CG 4.19Å; F24-D26 PolarHBondContact O-N 3.32Å; F24-L27 HydrophobicContact CD2-CD1 3.8Å; F24-L27 HydrophobicContact CE2-CD1 3.85Å; F24-L27 WeakPolarHBondContact O-CB 3.43Å; F24-L27 PolarHBondContact O-N 3.5Å; F24-L27 VanDerWaalsContact O-N 3.07Å; F24-T181 HydrophobicContact CD2-CG2 4.16Å
25V95.4Very high95.7Very high91 Ų9156.9 Ų56.955%0.55229%0.29SS*.G310 helixtrans-60.6-25.4178.571.50000113.1K23 L27 L28K23-V25 HydrophobicContact CB-CG1 4.01Å; K23-V25 PolarHBondContact O-N 2.93Å; V25-L27 PolarHBondContact O-N 3.3Å; V25-L28 HydrophobicContact CG2-CD1 4.04Å; V25-L28 WeakPolarHBondContact O-CB 3.44Å; V25-L28 WeakPolarHBondContact O-CG 3.42Å; V25-L28 PolarHBondContact O-N 3.08Å; V25-L28 VanDerWaalsContact O-N 3.11Å
26D97Very high95.8Very high32 Ų3259 Ų5917%0.17130%0.304CS..G310 helixtrans-63.7-25177.9-57.4-29.3000111.5K23 F24 L28 V29 P30 W136 M140 W180K23-D26 PolarHBondContact N-OD2 2.97Å; K23-D26 VanDerWaalsContact O-CB 3.26Å; K23-D26 WeakPolarHBondContact O-CB 3.45Å; K23-D26 VanDerWaalsContact O-CG 3.31Å; K23-D26 PolarHBondContact O-N 3.39Å; F24-D26 PolarHBondContact O-N 3.32Å; D26-L28 PolarHBondContact O-N 3.25Å; D26-L28 VanDerWaalsContact O-N 3.12Å; D26-V29 WeakPolarHBondContact O-CB 3.39Å; D26-V29 WeakPolarHBondContact O-CG2 3.5Å; D26-V29 PolarHBondContact O-N 3.39Å; D26-P30 WeakPolarHBondContact O-CD 3.21Å; D26-W136 HydrophobicContact CB-CZ2 4.19Å; D26-W136 PolarHBondContact OD2-NE1 3.49Å; D26-M140 HydrophobicContact CB-CE 4.03Å; D26-M140 HydrophobicContact CB-SD 4.45Å; D26-W180 HydrophobicContact CB-CZ2 4.06Å; D26-W180 WeakPolarHBondContact OD2-CZ2 3Å
27L96.9Very high95.8Very high13 Ų1357.6 Ų57.67%0.06830%0.295CS..G310 helixtrans-68.2-8.5177.1-65.5176000113.8F24 V25 V29 P30 S177 W180F24-L27 HydrophobicContact CD2-CD1 3.8Å; F24-L27 HydrophobicContact CE2-CD1 3.85Å; F24-L27 WeakPolarHBondContact O-CB 3.43Å; F24-L27 PolarHBondContact O-N 3.5Å; F24-L27 VanDerWaalsContact O-N 3.07Å; V25-L27 PolarHBondContact O-N 3.3Å; L27-V29 VanDerWaalsContact C-N 3.31Å; L27-P30 WeakPolarHBondContact O-CD 3.38Å; L27-P30 WeakPolarHBondContact O-CG 3.24Å; L27-S177 WeakPolarHBondContact CD1-O 3.17Å; L27-W180 HydrophobicContact CD2-CB 3.91Å; L27-W180 HydrophobicContact CD2-CG 3.94Å; L27-W180 HydrophobicContact CG-CG 4.37Å
28L97.2Very high95.8Very high82 Ų8255.9 Ų55.943%0.42929%0.29SS..Hα-helixtrans-70.2-31.3166.4-63.8179.4000111.8V25 D26 I31 Y32V25-L28 HydrophobicContact CG2-CD1 4.04Å; V25-L28 WeakPolarHBondContact O-CB 3.44Å; V25-L28 WeakPolarHBondContact O-CG 3.42Å; V25-L28 PolarHBondContact O-N 3.08Å; V25-L28 VanDerWaalsContact O-N 3.11Å; D26-L28 PolarHBondContact O-N 3.25Å; D26-L28 VanDerWaalsContact O-N 3.12Å; L28-I31 WeakPolarHBondContact O-CB 3.5Å; L28-I31 PolarHBondContact O-N 3.04Å; L28-Y32 HydrophobicContact CB-CD2 4.14Å; L28-Y32 HydrophobicContact CB-CE2 3.83Å; L28-Y32 WeakPolarHBondContact O-CD2 3.34Å; L28-Y32 PolarHBondContact O-N 3.34Å
29V97.8Very high95.8Very high40 Ų4055.4 Ų55.424%0.24228%0.281CS..Hα-helixtrans-58-54.1-179.7179.30000112.3D26 L27 I31 Y32 L33 W136 M140D26-V29 WeakPolarHBondContact O-CB 3.39Å; D26-V29 WeakPolarHBondContact O-CG2 3.5Å; D26-V29 PolarHBondContact O-N 3.39Å; L27-V29 VanDerWaalsContact C-N 3.31Å; V29-I31 PolarHBondContact O-N 3.29Å; V29-Y32 CarbonylContact O-C 3.47Å; V29-Y32 PolarHBondContact O-N 3.36Å; V29-Y32 VanDerWaalsContact O-N 3.1Å; V29-L33 HydrophobicContact CG1-CD1 3.74Å; V29-L33 HydrophobicContact CG1-CG 4.03Å; V29-L33 WeakPolarHBondContact O-CB 3.35Å; V29-L33 WeakPolarHBondContact O-CG 3.37Å; V29-L33 PolarHBondContact O-N 3.5Å; V29-W136 HydrophobicContact CB-CH2 4.11Å; V29-W136 HydrophobicContact CB-CZ2 4.39Å; V29-W136 HydrophobicContact CG1-CH2 3.75Å; V29-W136 HydrophobicContact CG1-CZ2 4.49Å; V29-W136 HydrophobicContact CG1-CZ3 4.41Å; V29-W136 HydrophobicContact CG2-CH2 3.77Å; V29-W136 HydrophobicContact CG2-CZ2 3.89Å; V29-M140 HydrophobicContact CB-SD 4.39Å; V29-M140 HydrophobicContact CG1-CB 4.23Å; V29-M140 HydrophobicContact CG1-CG 4.38Å
30P97.5Very high95.8Very high0 Ų055.2 Ų55.20%028%0.282CS..Hα-helixtrans-62.2-32.1-179.822.5-33.4000112.7D26 L27 L33 A34 M140 T143 G144 Y147D26-P30 WeakPolarHBondContact O-CD 3.21Å; L27-P30 WeakPolarHBondContact O-CD 3.38Å; L27-P30 WeakPolarHBondContact O-CG 3.24Å; P30-L33 PolarHBondContact O-N 3.06Å; P30-A34 PolarHBondContact O-N 3.19Å; P30-M140 HydrophobicContact CG-SD 4.15Å; P30-T143 HydrophobicContact CB-CG2 3.74Å; P30-T143 HydrophobicContact CG-CG2 3.88Å; P30-G144 VanDerWaalsContact CB-N 3.33Å; P30-G144 WeakPolarHBondContact O-CA 3.48Å; P30-Y147 HydrophobicContact CB-CD2 4.29Å
31I95.7Very high95.7Very high78 Ų7855.6 Ų55.640%0.428%0.284SS..Hα-helixtrans-64.2-47.1174.3-61.3171.7000110L28 V29 L33 A34 Y147L28-I31 WeakPolarHBondContact O-CB 3.5Å; L28-I31 PolarHBondContact O-N 3.04Å; V29-I31 PolarHBondContact O-N 3.29Å; I31-L33 VanDerWaalsContact C-N 3.34Å; I31-A34 WeakPolarHBondContact O-CB 3.48Å; I31-A34 PolarHBondContact O-N 3.12Å; I31-Y147 HydrophobicContact CG1-CE1 4.32Å; I31-Y147 HydrophobicContact CG1-CE2 4.09Å
32Y96.2Very high95.6Very high166 Ų16654.8 Ų54.865%0.65128%0.276SS*.Hα-helixtrans-68.2-31.1176.2-68.5-55.3000113L28 V29 A34 P36L28-Y32 HydrophobicContact CB-CD2 4.14Å; L28-Y32 HydrophobicContact CB-CE2 3.83Å; L28-Y32 WeakPolarHBondContact O-CD2 3.34Å; L28-Y32 PolarHBondContact O-N 3.34Å; V29-Y32 CarbonylContact O-C 3.47Å; V29-Y32 PolarHBondContact O-N 3.36Å; V29-Y32 VanDerWaalsContact O-N 3.1Å; Y32-A34 VanDerWaalsContact C-N 3.34Å; Y32-P36 WeakPolarHBondContact O-CD 3.27Å
33L96.3Very high95.5Very high44 Ų4458.2 Ų58.223%0.2329%0.294CS..Hα-helixtrans-72.1-25.6176.2-73.7177.2000113V29 P30 I31 I35 P36 L37 M140 I141V29-L33 HydrophobicContact CG1-CD1 3.74Å; V29-L33 HydrophobicContact CG1-CG 4.03Å; V29-L33 WeakPolarHBondContact O-CB 3.35Å; V29-L33 WeakPolarHBondContact O-CG 3.37Å; V29-L33 PolarHBondContact O-N 3.5Å; P30-L33 PolarHBondContact O-N 3.06Å; I31-L33 VanDerWaalsContact C-N 3.34Å; L33-I35 VanDerWaalsContact C-N 3.34Å; L33-I35 PolarHBondContact O-N 3.44Å; L33-P36 WeakPolarHBondContact O-CD 3.48Å; L33-L37 HydrophobicContact CB-CD1 4.4Å; L33-L37 WeakPolarHBondContact O-CB 3.36Å; L33-L37 VanDerWaalsContact O-CG 3.26Å; L33-L37 WeakPolarHBondContact O-CG 3.38Å; L33-L37 PolarHBondContact O-N 3.47Å; L33-M140 HydrophobicContact CD1-CB 4.44Å; L33-I141 HydrophobicContact CD1-CG1 4.48Å
34A96.3Very high95.6Very high1 Ų158.3 Ų58.31%0.00829%0.292CS..Hα-helixtrans-59.7-41.6-176.900000112.8P30 I31 Y32 L37 V38 I151P30-A34 PolarHBondContact O-N 3.19Å; I31-A34 WeakPolarHBondContact O-CB 3.48Å; I31-A34 PolarHBondContact O-N 3.12Å; Y32-A34 VanDerWaalsContact C-N 3.34Å; A34-L37 PolarHBondContact O-N 2.86Å; A34-V38 WeakPolarHBondContact O-CG2 3.47Å; A34-V38 PolarHBondContact O-N 2.68Å; A34-I151 HydrophobicContact CB-CD1 3.89Å
35I93.3Very high95.7Very high110 Ų11053.5 Ų53.556%0.56427%0.271SS*.Hα-helixtrans-67.1-52.9-179.9-63.3170.4000111.4L33 L37 V38 I39L33-I35 VanDerWaalsContact C-N 3.34Å; L33-I35 PolarHBondContact O-N 3.44Å; I35-L37 VanDerWaalsContact C-N 3.26Å; I35-L37 PolarHBondContact O-N 3.02Å; I35-V38 PolarHBondContact O-N 3.17Å; I35-V38 VanDerWaalsContact O-N 3.11Å; I35-I39 HydrophobicContact CG2-CD1 4.18Å; I35-I39 WeakPolarHBondContact O-CG1 3.45Å; I35-I39 PolarHBondContact O-N 3.42Å
36P95.6Very high95.6Very high55 Ų5549.1 Ų49.136%0.35725%0.245SC..Hα-helixtrans-52.5-40.6170.7-27.633.9000113.4Y32 L33 V38 I39 I40Y32-P36 WeakPolarHBondContact O-CD 3.27Å; L33-P36 WeakPolarHBondContact O-CD 3.48Å; P36-V38 VanDerWaalsContact C-N 3.33Å; P36-V38 PolarHBondContact O-N 3.27Å; P36-I39 CarbonylContact O-C 3.56Å; P36-I39 WeakPolarHBondContact O-CB 3.1Å; P36-I39 PolarHBondContact O-N 2.75Å; P36-I39 VanDerWaalsContact O-N 3.12Å; P36-I40 WeakPolarHBondContact O-CB 3.43Å; P36-I40 WeakPolarHBondContact O-CG1 3.47Å; P36-I40 PolarHBondContact O-N 2.9Å
37L96.2Very high95.4Very high20 Ų2050.4 Ų50.411%0.10525%0.254CS..Hα-helixtrans-64-36.6178-75.3169000112.6L33 A34 I35 I40 R41 Y98 G144 F145L33-L37 HydrophobicContact CB-CD1 4.4Å; L33-L37 WeakPolarHBondContact O-CB 3.36Å; L33-L37 VanDerWaalsContact O-CG 3.26Å; L33-L37 WeakPolarHBondContact O-CG 3.38Å; L33-L37 PolarHBondContact O-N 3.47Å; A34-L37 PolarHBondContact O-N 2.86Å; I35-L37 VanDerWaalsContact C-N 3.26Å; I35-L37 PolarHBondContact O-N 3.02Å; L37-I40 PolarHBondContact O-N 3.46Å; L37-R41 WeakPolarHBondContact O-CB 3.33Å; L37-R41 PolarHBondContact O-N 3.18Å; L37-Y98 HydrophobicContact CD2-CE2 4.45Å; L37-G144 VanDerWaalsContact CD1-C 3.48Å; L37-F145 HydrophobicContact CD1-CB 4.26Å
38V94.6Very high95.2Very high19 Ų1953.1 Ų53.112%0.11527%0.267CS..Hα-helixtrans-65.4-41171.4173.80000111.1A34 I35 P36 R41 I42 I151 F155A34-V38 WeakPolarHBondContact O-CG2 3.47Å; A34-V38 PolarHBondContact O-N 2.68Å; I35-V38 PolarHBondContact O-N 3.17Å; I35-V38 VanDerWaalsContact O-N 3.11Å; P36-V38 VanDerWaalsContact C-N 3.33Å; P36-V38 PolarHBondContact O-N 3.27Å; V38-R41 WeakPolarHBondContact O-CB 3.48Å; V38-R41 PolarHBondContact O-N 3.49Å; V38-I42 HydrophobicContact CG1-CD1 4.12Å; V38-I42 WeakPolarHBondContact O-CG1 3.38Å; V38-I42 PolarHBondContact O-N 3.37Å; V38-I151 HydrophobicContact CG2-CB 4.44Å; V38-I151 HydrophobicContact CG2-CG2 4.23Å; V38-F155 HydrophobicContact CG1-CZ 4.07Å
39I93.6Very high95Very high91 Ų9149.2 Ų49.247%0.46725%0.247SC..Hα-helixtrans-64.3-46.6176.4-63.9168.6000110.5I35 P36 R41 I42 L43I35-I39 HydrophobicContact CG2-CD1 4.18Å; I35-I39 WeakPolarHBondContact O-CG1 3.45Å; I35-I39 PolarHBondContact O-N 3.42Å; P36-I39 CarbonylContact O-C 3.56Å; P36-I39 WeakPolarHBondContact O-CB 3.1Å; P36-I39 PolarHBondContact O-N 2.75Å; P36-I39 VanDerWaalsContact O-N 3.12Å; I39-R41 VanDerWaalsContact C-N 3.29Å; I39-R41 PolarHBondContact O-N 2.95Å; I39-I42 PolarHBondContact O-N 3.41Å; I39-I42 VanDerWaalsContact O-N 3.13Å; I39-L43 HydrophobicContact CG2-CD1 3.96Å; I39-L43 HydrophobicContact CG2-CG 4.33Å; I39-L43 WeakPolarHBondContact O-CG 3.24Å; I39-L43 PolarHBondContact O-N 3.27Å
40I95.7Very high94.7Very high84 Ų8447.3 Ų47.343%0.43124%0.236SC..Hα-helixtrans-59.6-41.8176.9-66.5164.4000110P36 L37 I42 L43 W44 W94P36-I40 WeakPolarHBondContact O-CB 3.43Å; P36-I40 WeakPolarHBondContact O-CG1 3.47Å; P36-I40 PolarHBondContact O-N 2.9Å; L37-I40 PolarHBondContact O-N 3.46Å; I40-I42 PolarHBondContact O-N 3.27Å; I40-L43 PolarHBondContact O-N 2.68Å; I40-W44 VanDerWaalsContact O-CB 3.25Å; I40-W44 WeakPolarHBondContact O-CB 3.33Å; I40-W44 PolarHBondContact O-N 2.88Å; I40-W94 HydrophobicContact CB-CH2 4.28Å; I40-W94 HydrophobicContact CG2-CH2 3.59Å; I40-W94 HydrophobicContact CG2-CZ3 3.97Å
41R94.8Very high94.4Very high9 Ų949.3 Ų49.33%0.03425%0.248CC..Hα-helixtrans-55.3-52.2172.7172.3178.9178.3-163.7-2.7111.4L37 V38 I39 L43 W44 E45 W94 D156L37-R41 WeakPolarHBondContact O-CB 3.33Å; L37-R41 PolarHBondContact O-N 3.18Å; V38-R41 WeakPolarHBondContact O-CB 3.48Å; V38-R41 PolarHBondContact O-N 3.49Å; I39-R41 VanDerWaalsContact C-N 3.29Å; I39-R41 PolarHBondContact O-N 2.95Å; R41-L43 VanDerWaalsContact C-N 3.32Å; R41-L43 PolarHBondContact O-N 3.4Å; R41-W44 PolarHBondContact O-N 2.89Å; R41-E45 HydrophobicContact CG-CG 4.3Å; R41-E45 IonicContact CZ-OE1 3.81Å; R41-E45 IonicContact NE-OE1 3.63Å; R41-E45 PolarHBondContact NE-OE1 3.34Å; R41-E45 IonicContact NH2-OE1 3.5Å; R41-E45 PolarHBondContact NH2-OE1 2.87Å; R41-E45 WeakPolarHBondContact O-CB 3.46Å; R41-E45 VanDerWaalsContact O-CG 3.3Å; R41-E45 WeakPolarHBondContact O-CG 3.01Å; R41-E45 PolarHBondContact O-N 3.34Å; R41-W94 HydrophobicContact CB-CD2 3.88Å; R41-W94 VanDerWaalsContact CB-CE2 3.47Å; R41-W94 HydrophobicContact CB-CE3 4.47Å; R41-W94 HydrophobicContact CB-CG 4.27Å; R41-W94 HydrophobicContact CB-CH2 4.34Å; R41-W94 HydrophobicContact CB-CZ2 3.73Å; R41-W94 HydrophobicContact CG-CD2 3.87Å; R41-W94 HydrophobicContact CG-CG 3.72Å; R41-D156 IonicContact CZ-OD1 2.69Å; R41-D156 IonicContact NH1-OD1 2.88Å; R41-D156 PolarHBondContact NH1-OD1 2.62Å; R41-D156 IonicContact NH1-OD2 3.02Å; R41-D156 PolarHBondContact NH1-OD2 3.49Å; R41-D156 IonicContact NH2-OD1 2.9Å; R41-D156 PolarHBondContact NH2-OD1 3.1Å; R41-D156 IonicContact NH2-OD2 3.63Å
42I93.6Very high94.2Very high31 Ų3151.5 Ų51.516%0.15925%0.252CS..Hα-helixtrans-61.7-43-177.9-66.7166.3000110.5V38 I39 I40 S46 F80V38-I42 HydrophobicContact CG1-CD1 4.12Å; V38-I42 WeakPolarHBondContact O-CG1 3.38Å; V38-I42 PolarHBondContact O-N 3.37Å; I39-I42 PolarHBondContact O-N 3.41Å; I39-I42 VanDerWaalsContact O-N 3.13Å; I40-I42 PolarHBondContact O-N 3.27Å; I42-S46 WeakPolarHBondContact O-CB 3.4Å; I42-S46 PolarHBondContact O-N 2.85Å; I42-S46 PolarHBondContact O-OG 2.83Å; I42-F80 HydrophobicContact CD1-CD1 4.4Å; I42-F80 HydrophobicContact CD1-CD2 4.49Å; I42-F80 HydrophobicContact CD1-CG 4.4Å; I42-F80 HydrophobicContact CG1-CB 4.48Å; I42-F80 HydrophobicContact CG1-CG 4.37Å; I42-F80 HydrophobicContact CG2-CD1 4.35Å
43L95Very high93.8Very high76 Ų7643.6 Ų43.640%0.39822%0.221SC..Hα-helixtrans-66-40.4176.9-67.5174.9000112.2I39 I40 R41 S46 T47 M76I39-L43 HydrophobicContact CG2-CD1 3.96Å; I39-L43 HydrophobicContact CG2-CG 4.33Å; I39-L43 WeakPolarHBondContact O-CG 3.24Å; I39-L43 PolarHBondContact O-N 3.27Å; I40-L43 PolarHBondContact O-N 2.68Å; R41-L43 VanDerWaalsContact C-N 3.32Å; R41-L43 PolarHBondContact O-N 3.4Å; L43-S46 PolarHBondContact O-N 2.89Å; L43-S46 PolarHBondContact O-OG 3.41Å; L43-S46 VanDerWaalsContact O-OG 3.09Å; L43-T47 VanDerWaalsContact O-CB 3.31Å; L43-T47 WeakPolarHBondContact O-CB 3.5Å; L43-T47 WeakPolarHBondContact O-CG2 3.35Å; L43-T47 PolarHBondContact O-N 3.44Å; L43-T47 PolarHBondContact O-OG1 3.15Å; L43-M76 HydrophobicContact CD2-CE 4.17Å
44W95.9Very high93.3Very high80 Ų8045.4 Ų45.430%0.30323%0.225SC..Hα-helixtrans-66.1-48.4177.3-178.9-87.6000111.5I40 R41 S46 I48 G49 W94I40-W44 VanDerWaalsContact O-CB 3.25Å; I40-W44 WeakPolarHBondContact O-CB 3.33Å; I40-W44 PolarHBondContact O-N 2.88Å; R41-W44 PolarHBondContact O-N 2.89Å; W44-S46 VanDerWaalsContact C-N 3.3Å; W44-S46 PolarHBondContact O-N 2.96Å; W44-I48 HydrophobicContact CD2-CB 4.29Å; W44-I48 HydrophobicContact CD2-CD1 3.82Å; W44-I48 HydrophobicContact CE3-CD1 3.31Å; W44-I48 HydrophobicContact CE3-CG1 4.49Å; W44-I48 HydrophobicContact CH2-CD1 3.52Å; W44-I48 HydrophobicContact CH2-CG2 4.3Å; W44-I48 HydrophobicContact CZ2-CB 4.4Å; W44-I48 HydrophobicContact CZ2-CD1 4.02Å; W44-I48 HydrophobicContact CZ2-CG2 3.83Å; W44-I48 HydrophobicContact CZ3-CD1 3.14Å; W44-I48 PolarHBondContact O-N 2.84Å; W44-G49 PolarHBondContact O-N 3.45Å; W44-W94 HydrophobicContact CB-CE3 3.52Å; W44-W94 HydrophobicContact CB-CZ3 3.57Å; W44-W94 AromaticContact CD1-CE3 3.5Å; W44-W94 VanDerWaalsContact CD1-CE3 3.5Å; W44-W94 HydrophobicContact CD2-CE3 4.24Å; W44-W94 HydrophobicContact CD2-CZ3 4.25Å; W44-W94 AromaticContact CG-CE3 3.45Å; W44-W94 HydrophobicContact CG-CE3 3.45Å; W44-W94 VanDerWaalsContact CG-CE3 3.45Å; W44-W94 AromaticContact CG-CZ3 3.73Å; W44-W94 HydrophobicContact CG-CZ3 3.73Å
45E94.8Very high92.8Very high1 Ų152 Ų521%0.00525%0.254CS..Iπ-helixtrans-58.8-43.4176.3-70.9179.6179.400110.4R41 G49 V50 H75 K87 L90 W94R41-E45 HydrophobicContact CG-CG 4.3Å; R41-E45 IonicContact CZ-OE1 3.81Å; R41-E45 IonicContact NE-OE1 3.63Å; R41-E45 PolarHBondContact NE-OE1 3.34Å; R41-E45 IonicContact NH2-OE1 3.5Å; R41-E45 PolarHBondContact NH2-OE1 2.87Å; R41-E45 WeakPolarHBondContact O-CB 3.46Å; R41-E45 VanDerWaalsContact O-CG 3.3Å; R41-E45 WeakPolarHBondContact O-CG 3.01Å; R41-E45 PolarHBondContact O-N 3.34Å; E45-G49 CarbonylContact O-C 3.56Å; E45-G49 VanDerWaalsContact O-CA 3.3Å; E45-G49 WeakPolarHBondContact O-CA 3.48Å; E45-G49 PolarHBondContact O-N 2.9Å; E45-V50 WeakPolarHBondContact O-CG2 3.41Å; E45-V50 PolarHBondContact O-N 3.39Å; E45-H75 VanDerWaalsContact CB-NE2 3.3Å; E45-H75 WeakPolarHBondContact CB-NE2 3.43Å; E45-H75 IonicContact OE2-CE1 3.38Å; E45-H75 PolarHBondContact OE2-CE1 2.88Å; E45-H75 IonicContact OE2-NE2 2.85Å; E45-H75 PolarHBondContact OE2-NE2 2.7Å; E45-K87 IonicContact OE1-NZ 3.93Å; E45-K87 PolarHBondContact OE1-NZ 3.02Å; E45-K87 IonicContact OE2-NZ 3.46Å; E45-K87 PolarHBondContact OE2-NZ 3.22Å; E45-L90 HydrophobicContact CB-CB 4.37Å; E45-L90 HydrophobicContact CG-CB 4.18Å; E45-W94 HydrophobicContact CG-CB 4.13Å
46S92.9Very high92.3Very high0 Ų056 Ų560%026%0.262CS..Iπ-helixtrans-73.2-41.3-179.471.90000113.6I42 L43 W44 V50 M72I42-S46 WeakPolarHBondContact O-CB 3.4Å; I42-S46 PolarHBondContact O-N 2.85Å; I42-S46 PolarHBondContact O-OG 2.83Å; L43-S46 PolarHBondContact O-N 2.89Å; L43-S46 PolarHBondContact O-OG 3.41Å; L43-S46 VanDerWaalsContact O-OG 3.09Å; W44-S46 VanDerWaalsContact C-N 3.3Å; W44-S46 PolarHBondContact O-N 2.96Å; S46-V50 WeakPolarHBondContact O-CB 2.97Å; S46-M72 VanDerWaalsContact O-CG 3.29Å; S46-M72 WeakPolarHBondContact O-CG 3.48Å
47T93Very high91.3Very high59 Ų5955.7 Ų55.736%0.36226%0.259SS..Iπ-helixtrans-88.7-42.9-172.358.40000113.2L43 T51 M72L43-T47 VanDerWaalsContact O-CB 3.31Å; L43-T47 WeakPolarHBondContact O-CB 3.5Å; L43-T47 WeakPolarHBondContact O-CG2 3.35Å; L43-T47 PolarHBondContact O-N 3.44Å; L43-T47 PolarHBondContact O-OG1 3.15Å; T47-T51 VanDerWaalsContact O-CB 3.26Å; T47-T51 WeakPolarHBondContact O-CB 3.47Å; T47-T51 PolarHBondContact O-OG1 3.39Å; T47-M72 HydrophobicContact CG2-CE 3.89Å
48I94.3Very high90.1Very high69 Ų6961.6 Ų61.635%0.35429%0.291SS..Iπ-helixtrans-101.4-46.3-174.4-68.6164.9000109.8W44 Y52 F93W44-I48 HydrophobicContact CD2-CB 4.29Å; W44-I48 HydrophobicContact CD2-CD1 3.82Å; W44-I48 HydrophobicContact CE3-CD1 3.31Å; W44-I48 HydrophobicContact CE3-CG1 4.49Å; W44-I48 HydrophobicContact CH2-CD1 3.52Å; W44-I48 HydrophobicContact CH2-CG2 4.3Å; W44-I48 HydrophobicContact CZ2-CB 4.4Å; W44-I48 HydrophobicContact CZ2-CD1 4.02Å; W44-I48 HydrophobicContact CZ2-CG2 3.83Å; W44-I48 HydrophobicContact CZ3-CD1 3.14Å; W44-I48 PolarHBondContact O-N 2.84Å; I48-Y52 VanDerWaalsContact O-CB 3.3Å; I48-Y52 WeakPolarHBondContact O-CB 3.32Å; I48-Y52 PolarHBondContact O-N 2.98Å; I48-F93 HydrophobicContact CG2-CE1 4.18Å; I48-F93 HydrophobicContact CG2-CZ 4.34Å
49G92.8Very high89.1Confident1 Ų162.4 Ų62.41%0.0130%0.3CS..Iπ-helixtrans-62.6-58.1-179.500000113W44 E45 T51 Y52 L53W44-G49 PolarHBondContact O-N 3.45Å; E45-G49 CarbonylContact O-C 3.56Å; E45-G49 VanDerWaalsContact O-CA 3.3Å; E45-G49 WeakPolarHBondContact O-CA 3.48Å; E45-G49 PolarHBondContact O-N 2.9Å; G49-T51 VanDerWaalsContact C-N 3.3Å; G49-T51 PolarHBondContact O-N 3.36Å; G49-Y52 PolarHBondContact O-N 2.88Å; G49-L53 PolarHBondContact O-N 3.02Å
50V91.7Very high88.1Confident0 Ų058.9 Ų58.90%028%0.281CS..Hα-helixtrans-59.1-42.8-179.7171.50000110.7E45 S46 Y52 L53 Y54 Y60 L68 C71 M72 H75 L90E45-V50 WeakPolarHBondContact O-CG2 3.41Å; E45-V50 PolarHBondContact O-N 3.39Å; S46-V50 WeakPolarHBondContact O-CB 2.97Å; V50-Y52 PolarHBondContact O-N 3.48Å; V50-L53 PolarHBondContact O-N 3.18Å; V50-Y54 VanDerWaalsContact O-CB 3.23Å; V50-Y54 WeakPolarHBondContact O-CB 3.04Å; V50-Y54 PolarHBondContact O-N 3.5Å; V50-Y60 HydrophobicContact CG1-CE2 4.45Å; V50-L68 HydrophobicContact CG1-CD1 4.22Å; V50-C71 HydrophobicContact CG1-CB 3.57Å; V50-M72 HydrophobicContact CB-CG 4.47Å; V50-M72 HydrophobicContact CG1-CG 4.18Å; V50-H75 HydrophobicContact CG2-CB 4.07Å; V50-L90 HydrophobicContact CG2-CD1 4.01Å; V50-L90 HydrophobicContact CG2-CD2 4.47Å
51T91.3Very high86.9Confident41 Ų4157.6 Ų57.625%0.25228%0.282SS..Hα-helixtrans-58.6-47.8176.5-60.10000111.6T47 G49 Y54 F55 L68T47-T51 VanDerWaalsContact O-CB 3.26Å; T47-T51 WeakPolarHBondContact O-CB 3.47Å; T47-T51 PolarHBondContact O-OG1 3.39Å; G49-T51 VanDerWaalsContact C-N 3.3Å; G49-T51 PolarHBondContact O-N 3.36Å; T51-Y54 PolarHBondContact O-N 3.26Å; T51-F55 HydrophobicContact CG2-CD2 3.94Å; T51-F55 HydrophobicContact CG2-CE2 3.96Å; T51-F55 VanDerWaalsContact O-CD2 3.3Å; T51-F55 WeakPolarHBondContact O-CD2 3.18Å; T51-F55 PolarHBondContact O-N 3.38Å; T51-L68 HydrophobicContact CG2-CD2 4.29Å
52Y90.3Very high85.5Confident124 Ų12462.1 Ų62.149%0.48632%0.315SS..Hα-helixtrans-59.5-50176.4177.7-93000111.2I48 G49 V50 Y54 F55 R56 F93I48-Y52 VanDerWaalsContact O-CB 3.3Å; I48-Y52 WeakPolarHBondContact O-CB 3.32Å; I48-Y52 PolarHBondContact O-N 2.98Å; G49-Y52 PolarHBondContact O-N 2.88Å; V50-Y52 PolarHBondContact O-N 3.48Å; Y52-Y54 PolarHBondContact O-N 2.89Å; Y52-F55 PolarHBondContact O-N 3.36Å; Y52-R56 HydrophobicContact CD2-CB 4.47Å; Y52-R56 HydrophobicContact CD2-CG 4.01Å; Y52-R56 HydrophobicContact CE1-CB 4.36Å; Y52-R56 HydrophobicContact CE2-CB 4.22Å; Y52-R56 HydrophobicContact CE2-CG 3.88Å; Y52-R56 WeakPolarHBondContact O-CB 3.31Å; Y52-R56 PolarHBondContact O-N 3.03Å; Y52-F93 HydrophobicContact CD1-CE1 4.27Å; Y52-F93 HydrophobicContact CG-CE1 4.12Å
53L88.3Confident84.6Confident0 Ų065.6 Ų65.60%033%0.326CS..Hα-helixtrans-62.5-40.7179-94.363.3000112.3G49 V50 F55 T57 A59 Y60 A86 I89 L90G49-L53 PolarHBondContact O-N 3.02Å; V50-L53 PolarHBondContact O-N 3.18Å; L53-F55 VanDerWaalsContact C-N 3.34Å; L53-F55 PolarHBondContact O-N 3.24Å; L53-T57 WeakPolarHBondContact CA-OG1 3.34Å; L53-T57 HydrophobicContact CG-CG2 4.47Å; L53-T57 CarbonylContact O-C 3.59Å; L53-T57 WeakPolarHBondContact O-CA 3.31Å; L53-T57 WeakPolarHBondContact O-CB 3.12Å; L53-T57 PolarHBondContact O-N 3.03Å; L53-T57 PolarHBondContact O-OG1 3.33Å; L53-A59 HydrophobicContact CB-CB 4.49Å; L53-A59 HydrophobicContact CD2-CB 4.07Å; L53-A59 HydrophobicContact CG-CB 4.34Å; L53-Y60 HydrophobicContact CB-CD2 4.05Å; L53-Y60 HydrophobicContact CB-CE2 3.61Å; L53-Y60 HydrophobicContact CD2-CE2 3.93Å; L53-Y60 HydrophobicContact CG-CE2 4.44Å; L53-A86 HydrophobicContact CD2-CB 4.03Å; L53-I89 HydrophobicContact CD1-CG2 3.68Å; L53-I89 HydrophobicContact CD2-CB 4.27Å; L53-I89 HydrophobicContact CD2-CG2 4.29Å; L53-I89 HydrophobicContact CG-CG2 4.29Å; L53-L90 HydrophobicContact CD1-CD2 4Å; L53-L90 HydrophobicContact CD2-CD2 4.03Å; L53-L90 HydrophobicContact CD2-CG 4.03Å
54Y85.3Confident82.9Confident82 Ų8271.2 Ų71.232%0.32235%0.347SS..Hα-helixtrans-60.9-41.9-177.6-173.2-89.4000111.9V50 T51 Y52 Y60 I66 L68V50-Y54 VanDerWaalsContact O-CB 3.23Å; V50-Y54 WeakPolarHBondContact O-CB 3.04Å; V50-Y54 PolarHBondContact O-N 3.5Å; T51-Y54 PolarHBondContact O-N 3.26Å; Y52-Y54 PolarHBondContact O-N 2.89Å; Y54-Y60 HydrophobicContact CD2-CG 4.48Å; Y54-I66 PolarHBondContact OH-O 3.34Å; Y54-L68 HydrophobicContact CD1-CB 4.33Å; Y54-L68 HydrophobicContact CD1-CD1 4.28Å; Y54-L68 HydrophobicContact CD2-CD1 4.34Å; Y54-L68 HydrophobicContact CE1-CB 4.27Å; Y54-L68 HydrophobicContact CG-CB 4.5Å; Y54-L68 HydrophobicContact CG-CD1 3.92Å
55F85.6Confident81.6Confident139 Ų13975.3 Ų75.361%0.6138%0.375SS*.Hα-helixtrans-91.2-31.1-178.2-70.8-64000114.4T51 Y52 L53 L68T51-F55 HydrophobicContact CG2-CD2 3.94Å; T51-F55 HydrophobicContact CG2-CE2 3.96Å; T51-F55 VanDerWaalsContact O-CD2 3.3Å; T51-F55 WeakPolarHBondContact O-CD2 3.18Å; T51-F55 PolarHBondContact O-N 3.38Å; Y52-F55 PolarHBondContact O-N 3.36Å; L53-F55 VanDerWaalsContact C-N 3.34Å; L53-F55 PolarHBondContact O-N 3.24Å; F55-L68 HydrophobicContact CE2-CD2 3.81Å; F55-L68 HydrophobicContact CZ-CD2 4.18Å
56R82.6Confident80.9Confident196 Ų19676.7 Ų76.774%0.7438%0.383SS*.Hα-helixtrans-104.1-11.7-170.9-62.6-64.3-168.4163.50.2114.1Y52Y52-R56 HydrophobicContact CD2-CB 4.47Å; Y52-R56 HydrophobicContact CD2-CG 4.01Å; Y52-R56 HydrophobicContact CE1-CB 4.36Å; Y52-R56 HydrophobicContact CE2-CB 4.22Å; Y52-R56 HydrophobicContact CE2-CG 3.88Å; Y52-R56 WeakPolarHBondContact O-CB 3.31Å; Y52-R56 PolarHBondContact O-N 3.03Å
57T75.8Confident80.7Confident47 Ų4781.1 Ų81.129%0.28841%0.41SS..SBendtrans-134158.4-177.476.90000111.3L53 A59L53-T57 WeakPolarHBondContact CA-OG1 3.34Å; L53-T57 HydrophobicContact CG-CG2 4.47Å; L53-T57 CarbonylContact O-C 3.59Å; L53-T57 WeakPolarHBondContact O-CA 3.31Å; L53-T57 WeakPolarHBondContact O-CB 3.12Å; L53-T57 PolarHBondContact O-N 3.03Å; L53-T57 PolarHBondContact O-OG1 3.33Å; T57-A59 PolarHBondContact O-N 2.64Å; T57-A59 WeakPolarHBondContact OG1-CB 3.33Å; T57-A59 PolarHBondContact OG1-N 3.04Å
58N70.6Confident80.5Confident145 Ų14580.2 Ų80.278%0.77540%0.402SS*.G310 helixtrans-81.513.6171.4-73.4-25.1000113Y60 A61N58-Y60 PolarHBondContact O-N 2.86Å; N58-Y60 VanDerWaalsContact O-N 3.16Å; N58-A61 HydrophobicContact CB-CB 3.87Å; N58-A61 WeakPolarHBondContact O-CB 3.27Å; N58-A61 PolarHBondContact O-N 3.19Å
59A73Confident80.3Confident36 Ų3683 Ų8330%0.29842%0.417SS..G310 helixtrans-59.3-29.2-176.300000113.1L53 T57 A86L53-A59 HydrophobicContact CB-CB 4.49Å; L53-A59 HydrophobicContact CD2-CB 4.07Å; L53-A59 HydrophobicContact CG-CB 4.34Å; T57-A59 PolarHBondContact O-N 2.64Å; T57-A59 WeakPolarHBondContact OG1-CB 3.33Å; T57-A59 PolarHBondContact OG1-N 3.04Å; A59-A86 HydrophobicContact CB-CB 4.3Å
60Y73.6Confident80.1Confident17 Ų1784 Ų847%0.06743%0.428CS..G310 helixtrans-107.92.5176.8-64.3-89.3000113.4V50 L53 Y54 N58 S62 R63 C71V50-Y60 HydrophobicContact CG1-CE2 4.45Å; L53-Y60 HydrophobicContact CB-CD2 4.05Å; L53-Y60 HydrophobicContact CB-CE2 3.61Å; L53-Y60 HydrophobicContact CD2-CE2 3.93Å; L53-Y60 HydrophobicContact CG-CE2 4.44Å; Y54-Y60 HydrophobicContact CD2-CG 4.48Å; N58-Y60 PolarHBondContact O-N 2.86Å; N58-Y60 VanDerWaalsContact O-N 3.16Å; Y60-S62 PolarHBondContact O-N 3.37Å; Y60-R63 PolarHBondContact O-N 3Å; Y60-C71 HydrophobicContact CD1-CB 4.39Å; Y60-C71 VanDerWaalsContact CD1-SG 3.57Å; Y60-C71 HydrophobicContact CE1-CB 4.17Å
61A69.3Low79.9Confident56 Ų5684.1 Ų84.146%0.46343%0.428SS..THydrogen-bonded Turntrans-65.3-23.3-172.900000114.1N58 R63N58-A61 HydrophobicContact CB-CB 3.87Å; N58-A61 WeakPolarHBondContact O-CB 3.27Å; N58-A61 PolarHBondContact O-N 3.19Å; A61-R63 VanDerWaalsContact C-N 3.25Å; A61-R63 PolarHBondContact O-N 3.44Å
62S66.1Low79.9Confident104 Ų10483.7 Ų83.773%0.72742%0.424SS*.THydrogen-bonded Turntrans-72.3-18.2174.859.60000113.1Y60 K64Y60-S62 PolarHBondContact O-N 3.37Å; S62-K64 PolarHBondContact O-N 3.24Å
63R74.1Confident79.9Confident105 Ų10585.8 Ų85.840%0.39643%0.431SS..  trans-95.172.9-176.3-60.7-153.8-107.7179-2.6111Y60 A61 N65 I66 E74Y60-R63 PolarHBondContact O-N 3Å; A61-R63 VanDerWaalsContact C-N 3.25Å; A61-R63 PolarHBondContact O-N 3.44Å; R63-N65 PolarHBondContact O-N 3.49Å; R63-I66 HydrophobicContact CB-CB 4.49Å; R63-I66 HydrophobicContact CB-CG2 3.58Å; R63-I66 PolarHBondContact O-N 2.87Å; R63-E74 IonicContact CZ-OE2 3.56Å; R63-E74 IonicContact NH1-OE1 3.93Å; R63-E74 IonicContact NH1-OE2 3.64Å; R63-E74 PolarHBondContact NH1-OE2 3.1Å; R63-E74 IonicContact NH2-OE2 2.79Å
64K59.5Low80Confident193 Ų19389.6 Ų89.684%0.83945%0.449SS*.THydrogen-bonded Turntrans-59.1-7-170.1-74.4-170.7173.4-172.90117.3S62S62-K64 PolarHBondContact O-N 3.24Å
65N69.8Low80.2Confident166 Ų16686.1 Ų86.189%0.88844%0.436SS*.THydrogen-bonded Turntrans-133.312.6-174.2-69.6-32000114.7R63R63-N65 PolarHBondContact O-N 3.49Å
66I78.9Confident80.3Confident31 Ų3183.1 Ų83.116%0.15942%0.424CS..  trans-100.6129.8179.2-160.9165.3000111.1Y54 R63 C71 E74Y54-I66 PolarHBondContact OH-O 3.34Å; R63-I66 HydrophobicContact CB-CB 4.49Å; R63-I66 HydrophobicContact CB-CG2 3.58Å; R63-I66 PolarHBondContact O-N 2.87Å; I66-C71 WeakPolarHBondContact CG2-SG 3.39Å; I66-E74 HydrophobicContact CD1-CG 4.31Å; I66-E74 WeakPolarHBondContact CD1-OE1 3.41Å; I66-E74 WeakPolarHBondContact CD1-OE2 2.99Å
67T89.8Confident80.6Confident93 Ų9378 Ų7857%0.57142%0.415SS*.  trans-74.4158.6174.2620000110L69 G70 C71T67-L69 VanDerWaalsContact C-N 3.28Å; T67-L69 PolarHBondContact O-N 3.35Å; T67-G70 WeakPolarHBondContact O-CA 3.32Å; T67-G70 PolarHBondContact O-N 2.89Å; T67-G70 PolarHBondContact OG1-N 3.36Å; T67-G70 VanDerWaalsContact OG1-N 3.09Å; T67-C71 PolarHBondContact O-N 3.39Å
68L88.1Confident80.9Confident39 Ų3977.4 Ų77.420%0.20442%0.418CS..Hα-helixtrans-52.3-48.9172.7172.261.2000111.2V50 T51 Y54 F55 G70 C71 M72V50-L68 HydrophobicContact CG1-CD1 4.22Å; T51-L68 HydrophobicContact CG2-CD2 4.29Å; Y54-L68 HydrophobicContact CD1-CB 4.33Å; Y54-L68 HydrophobicContact CD1-CD1 4.28Å; Y54-L68 HydrophobicContact CD2-CD1 4.34Å; Y54-L68 HydrophobicContact CE1-CB 4.27Å; Y54-L68 HydrophobicContact CG-CB 4.5Å; Y54-L68 HydrophobicContact CG-CD1 3.92Å; F55-L68 HydrophobicContact CE2-CD2 3.81Å; F55-L68 HydrophobicContact CZ-CD2 4.18Å; L68-G70 VanDerWaalsContact C-N 3.26Å; L68-G70 PolarHBondContact O-N 3.48Å; L68-C71 WeakPolarHBondContact O-CB 3.44Å; L68-C71 PolarHBondContact O-N 2.81Å; L68-C71 VanDerWaalsContact O-N 3.08Å; L68-M72 HydrophobicContact CD1-CG 4.21Å; L68-M72 HydrophobicContact CD1-SD 4.3Å; L68-M72 HydrophobicContact CG-CG 4.42Å; L68-M72 HydrophobicContact CG-SD 4.04Å; L68-M72 VanDerWaalsContact O-CG 3.28Å; L68-M72 WeakPolarHBondContact O-CG 3.37Å; L68-M72 PolarHBondContact O-N 3.21Å
69L89.2Confident81.3Confident128 Ų12871.5 Ų71.567%0.6739%0.391SS*.Hα-helixtrans-59.4-36.8177.1-69.2174.9000112.4T67 M72 W73T67-L69 VanDerWaalsContact C-N 3.28Å; T67-L69 PolarHBondContact O-N 3.35Å; L69-M72 HydrophobicContact CD2-SD 4.11Å; L69-M72 PolarHBondContact O-N 2.76Å; L69-W73 VanDerWaalsContact O-CB 3.31Å; L69-W73 WeakPolarHBondContact O-CB 3.46Å; L69-W73 PolarHBondContact O-N 3.26Å
70G88.8Confident81.6Confident22 Ų2272.2 Ų72.223%0.22739%0.388CS..Hα-helixtrans-60.9-46.7172.600000112.3T67 L68 M72 W73 E74T67-G70 WeakPolarHBondContact O-CA 3.32Å; T67-G70 PolarHBondContact O-N 2.89Å; T67-G70 PolarHBondContact OG1-N 3.36Å; T67-G70 VanDerWaalsContact OG1-N 3.09Å; L68-G70 VanDerWaalsContact C-N 3.26Å; L68-G70 PolarHBondContact O-N 3.48Å; G70-M72 PolarHBondContact O-N 3.21Å; G70-W73 PolarHBondContact O-N 3.27Å; G70-E74 WeakPolarHBondContact O-CB 3.15Å; G70-E74 WeakPolarHBondContact O-CG 3.45Å; G70-E74 PolarHBondContact O-N 2.98Å
71C88.3Confident81.7Confident2 Ų274 Ų741%0.01441%0.406CS..Hα-helixtrans-62.1-41.2175.4-69.70000112.6V50 Y60 I66 T67 L68 H75V50-C71 HydrophobicContact CG1-CB 3.57Å; Y60-C71 HydrophobicContact CD1-CB 4.39Å; Y60-C71 VanDerWaalsContact CD1-SG 3.57Å; Y60-C71 HydrophobicContact CE1-CB 4.17Å; I66-C71 WeakPolarHBondContact CG2-SG 3.39Å; T67-C71 PolarHBondContact O-N 3.39Å; L68-C71 WeakPolarHBondContact O-CB 3.44Å; L68-C71 PolarHBondContact O-N 2.81Å; L68-C71 VanDerWaalsContact O-N 3.08Å; C71-H75 PolarHBondContact O-N 2.76Å
72M91.8Very high82.2Confident33 Ų3373.4 Ų73.416%0.16340%0.399CS..Hα-helixtrans-62.7-46.1177.4-63.9176.35600110.8S46 T47 V50 L68 L69 G70 H75 M76S46-M72 VanDerWaalsContact O-CG 3.29Å; S46-M72 WeakPolarHBondContact O-CG 3.48Å; T47-M72 HydrophobicContact CG2-CE 3.89Å; V50-M72 HydrophobicContact CB-CG 4.47Å; V50-M72 HydrophobicContact CG1-CG 4.18Å; L68-M72 HydrophobicContact CD1-CG 4.21Å; L68-M72 HydrophobicContact CD1-SD 4.3Å; L68-M72 HydrophobicContact CG-CG 4.42Å; L68-M72 HydrophobicContact CG-SD 4.04Å; L68-M72 VanDerWaalsContact O-CG 3.28Å; L68-M72 WeakPolarHBondContact O-CG 3.37Å; L68-M72 PolarHBondContact O-N 3.21Å; L69-M72 HydrophobicContact CD2-SD 4.11Å; L69-M72 PolarHBondContact O-N 2.76Å; G70-M72 PolarHBondContact O-N 3.21Å; M72-H75 PolarHBondContact O-N 2.83Å; M72-M76 WeakPolarHBondContact O-CG 3.21Å; M72-M76 PolarHBondContact O-N 2.98Å; M72-M76 VanDerWaalsContact O-N 3.08Å
73W90.4Very high82.7Confident168 Ų16872.8 Ų72.864%0.63639%0.39SS*.Hα-helixtrans-62.5-49178.4-175.8-102.4000111.7L69 G70 H75 M76 T77L69-W73 VanDerWaalsContact O-CB 3.31Å; L69-W73 WeakPolarHBondContact O-CB 3.46Å; L69-W73 PolarHBondContact O-N 3.26Å; G70-W73 PolarHBondContact O-N 3.27Å; W73-H75 VanDerWaalsContact C-N 3.27Å; W73-H75 PolarHBondContact O-N 2.81Å; W73-M76 WeakPolarHBondContact O-CB 3.35Å; W73-M76 PolarHBondContact O-N 3.29Å; W73-M76 VanDerWaalsContact O-N 3.08Å; W73-T77 HydrophobicContact CD2-CG2 4.05Å; W73-T77 HydrophobicContact CG-CG2 4.43Å; W73-T77 HydrophobicContact CH2-CG2 4.44Å; W73-T77 HydrophobicContact CZ2-CG2 3.8Å; W73-T77 PolarHBondContact O-N 3.08Å; W73-T77 PolarHBondContact O-OG1 3.48Å; W73-T77 VanDerWaalsContact O-OG1 3.11Å
74E89.1Confident83.1Confident80 Ų8069.6 Ų69.637%0.37438%0.384SS..Hα-helixtrans-56.6-41.5176-77.6-177.6174.200112.3R63 I66 G70 M76 T77 G79R63-E74 IonicContact CZ-OE2 3.56Å; R63-E74 IonicContact NH1-OE1 3.93Å; R63-E74 IonicContact NH1-OE2 3.64Å; R63-E74 PolarHBondContact NH1-OE2 3.1Å; R63-E74 IonicContact NH2-OE2 2.79Å; I66-E74 HydrophobicContact CD1-CG 4.31Å; I66-E74 WeakPolarHBondContact CD1-OE1 3.41Å; I66-E74 WeakPolarHBondContact CD1-OE2 2.99Å; G70-E74 WeakPolarHBondContact O-CB 3.15Å; G70-E74 WeakPolarHBondContact O-CG 3.45Å; G70-E74 PolarHBondContact O-N 2.98Å; E74-M76 VanDerWaalsContact C-N 3.35Å; E74-T77 PolarHBondContact O-N 2.77Å; E74-G79 WeakPolarHBondContact O-CA 3.48Å; E74-G79 PolarHBondContact O-N 2.96Å
75H89.1Confident84.1Confident9 Ų966.2 Ų66.24%0.04237%0.366CS..Hα-helixtrans-61.4-45.3176.7-16682.9000111.2E45 V50 C71 M72 W73 G79 F80 L90E45-H75 VanDerWaalsContact CB-NE2 3.3Å; E45-H75 WeakPolarHBondContact CB-NE2 3.43Å; E45-H75 IonicContact OE2-CE1 3.38Å; E45-H75 PolarHBondContact OE2-CE1 2.88Å; E45-H75 IonicContact OE2-NE2 2.85Å; E45-H75 PolarHBondContact OE2-NE2 2.7Å; V50-H75 HydrophobicContact CG2-CB 4.07Å; C71-H75 PolarHBondContact O-N 2.76Å; M72-H75 PolarHBondContact O-N 2.83Å; W73-H75 VanDerWaalsContact C-N 3.27Å; W73-H75 PolarHBondContact O-N 2.81Å; H75-G79 PolarHBondContact O-N 3.38Å; H75-F80 VanDerWaalsContact O-CD1 3.29Å; H75-F80 WeakPolarHBondContact O-CD1 3.5Å; H75-F80 PolarHBondContact O-N 2.88Å; H75-L90 VanDerWaalsContact CE1-CD1 3.5Å; H75-L90 WeakPolarHBondContact CE1-CD1 3.21Å
76M89.6Confident84.8Confident76 Ų7658.9 Ų58.937%0.37433%0.328SS..Hα-helixtrans-64.9-36.7178-70.7178.860.300112.9L43 M72 W73 E74 G78L43-M76 HydrophobicContact CD2-CE 4.17Å; M72-M76 WeakPolarHBondContact O-CG 3.21Å; M72-M76 PolarHBondContact O-N 2.98Å; M72-M76 VanDerWaalsContact O-N 3.08Å; W73-M76 WeakPolarHBondContact O-CB 3.35Å; W73-M76 PolarHBondContact O-N 3.29Å; W73-M76 VanDerWaalsContact O-N 3.08Å; E74-M76 VanDerWaalsContact C-N 3.35Å; M76-G78 VanDerWaalsContact C-N 3.33Å; M76-G78 PolarHBondContact O-N 3.46Å
77T88.1Confident85.2Confident88 Ų8857.6 Ų57.654%0.5432%0.321SS..THydrogen-bonded Turntrans-95.132.6-175.464.80000113.6W73 E74W73-T77 HydrophobicContact CD2-CG2 4.05Å; W73-T77 HydrophobicContact CG-CG2 4.43Å; W73-T77 HydrophobicContact CH2-CG2 4.44Å; W73-T77 HydrophobicContact CZ2-CG2 3.8Å; W73-T77 PolarHBondContact O-N 3.08Å; W73-T77 PolarHBondContact O-OG1 3.48Å; W73-T77 VanDerWaalsContact O-OG1 3.11Å; E74-T77 PolarHBondContact O-N 2.77Å
78G81.4Confident85Confident34 Ų3454 Ų5435%0.35130%0.298SS..THydrogen-bonded Turntrans120.5-10.2171.800000115.5M76 F80 A81M76-G78 VanDerWaalsContact C-N 3.33Å; M76-G78 PolarHBondContact O-N 3.46Å; G78-F80 PolarHBondContact O-N 3.42Å; G78-A81 PolarHBondContact O-N 2.97Å
79G79.9Confident85Confident21 Ų2152.8 Ų52.822%0.21629%0.292CS..G310 helixtrans-63.2-23.2173.100000113.3E74 H75 A81 S82E74-G79 WeakPolarHBondContact O-CA 3.48Å; E74-G79 PolarHBondContact O-N 2.96Å; H75-G79 PolarHBondContact O-N 3.38Å; G79-A81 PolarHBondContact O-N 3.44Å; G79-A81 VanDerWaalsContact O-N 3.17Å; G79-S82 VanDerWaalsContact O-CB 3.3Å; G79-S82 WeakPolarHBondContact O-CB 3.47Å; G79-S82 PolarHBondContact O-N 2.88Å; G79-S82 PolarHBondContact O-OG 2.81Å
80F77.9Confident85.1Confident52 Ų5246.8 Ų46.823%0.22826%0.26CS..G310 helixtrans-61.6-15.1170.870.7-102.2000114.2I42 H75 G78 K87 F155I42-F80 HydrophobicContact CD1-CD1 4.4Å; I42-F80 HydrophobicContact CD1-CD2 4.49Å; I42-F80 HydrophobicContact CD1-CG 4.4Å; I42-F80 HydrophobicContact CG1-CB 4.48Å; I42-F80 HydrophobicContact CG1-CG 4.37Å; I42-F80 HydrophobicContact CG2-CD1 4.35Å; H75-F80 VanDerWaalsContact O-CD1 3.29Å; H75-F80 WeakPolarHBondContact O-CD1 3.5Å; H75-F80 PolarHBondContact O-N 2.88Å; G78-F80 PolarHBondContact O-N 3.42Å; F80-K87 WeakPolarHBondContact O-CE 3.24Å; F80-F155 HydrophobicContact CD2-CD2 4.36Å; F80-F155 HydrophobicContact CD2-CE2 4.49Å
81A77.1Confident85.2Confident54 Ų5445.9 Ų45.945%0.44625%0.25SS..G310 helixtrans-102.75.5175.300000113G78 G79G78-A81 PolarHBondContact O-N 2.97Å; G79-A81 PolarHBondContact O-N 3.44Å; G79-A81 VanDerWaalsContact O-N 3.17Å
82S80Confident85.4Confident44 Ų4445.9 Ų45.931%0.30825%0.25SC..  trans-72.4152.9-179.872.50000112.6G79 S84 K87G79-S82 VanDerWaalsContact O-CB 3.3Å; G79-S82 WeakPolarHBondContact O-CB 3.47Å; G79-S82 PolarHBondContact O-N 2.88Å; G79-S82 PolarHBondContact O-OG 2.81Å; S82-S84 VanDerWaalsContact C-N 3.29Å; S82-S84 PolarHBondContact O-N 2.85Å; S82-S84 PolarHBondContact OG-OG 3.28Å; S82-K87 VanDerWaalsContact O-CG 3.27Å; S82-K87 WeakPolarHBondContact O-CG 3.21Å
83V76.1Confident85.5Confident91 Ų9146 Ų4655%0.55225%0.249SC*.  trans-89.913.6176.8-68.40000113.8V157V83-V157 HydrophobicContact CB-CG2 4.15Å; V83-V157 HydrophobicContact CG1-CG1 4.34Å; V83-V157 HydrophobicContact CG1-CG2 3.81Å
84S81.9Confident85.7Confident38 Ų3838.6 Ų38.627%0.26622%0.222SC..  trans-71.6154.1-169.368.60000113.8S82 A86 K87 K88S82-S84 VanDerWaalsContact C-N 3.29Å; S82-S84 PolarHBondContact O-N 2.85Å; S82-S84 PolarHBondContact OG-OG 3.28Å; S84-A86 PolarHBondContact O-N 3.48Å; S84-K87 WeakPolarHBondContact O-CB 3.44Å; S84-K87 PolarHBondContact O-N 3.14Å; S84-K87 WeakPolarHBondContact OG-CB 3.4Å; S84-K87 PolarHBondContact OG-N 3.47Å; S84-K87 VanDerWaalsContact OG-N 3.11Å; S84-K88 PolarHBondContact O-N 3.07Å
85R81.9Confident86Confident122 Ų12236.7 Ų36.746%0.4621%0.211SC..Hα-helixtrans-52.2-41.1168-179.6175.3172.5174.7-0.8112.9K87 K88 I89 Y210R85-K87 VanDerWaalsContact C-N 3.32Å; R85-K87 PolarHBondContact O-N 3.47Å; R85-K88 PolarHBondContact O-N 3.26Å; R85-I89 HydrophobicContact CG-CD1 4.24Å; R85-I89 WeakPolarHBondContact O-CG1 3.41Å; R85-I89 PolarHBondContact O-N 2.67Å; R85-I89 VanDerWaalsContact O-N 3.09Å; R85-Y210 HydrophobicContact CG-CE1 4.23Å; R85-Y210 PolarHBondContact NH2-O 3.44Å
86A84.3Confident86.3Confident11 Ų1139.3 Ų39.39%0.09122%0.222CC..Hα-helixtrans-59.2-45177.100000111.1L53 A59 S84 I89 L90L53-A86 HydrophobicContact CD2-CB 4.03Å; A59-A86 HydrophobicContact CB-CB 4.3Å; S84-A86 PolarHBondContact O-N 3.48Å; A86-I89 WeakPolarHBondContact O-CB 3.41Å; A86-I89 PolarHBondContact O-N 3Å; A86-L90 VanDerWaalsContact O-CG 3.32Å; A86-L90 WeakPolarHBondContact O-CG 3.32Å; A86-L90 PolarHBondContact O-N 2.89Å
87K86.6Confident86.7Confident4 Ų437 Ų372%0.01721%0.213CC..Hα-helixtrans-61.3-46.5175.5175.654.6-177.61660112E45 F80 S82 S84 R85 I89 L90 E91E45-K87 IonicContact OE1-NZ 3.93Å; E45-K87 PolarHBondContact OE1-NZ 3.02Å; E45-K87 IonicContact OE2-NZ 3.46Å; E45-K87 PolarHBondContact OE2-NZ 3.22Å; F80-K87 WeakPolarHBondContact O-CE 3.24Å; S82-K87 VanDerWaalsContact O-CG 3.27Å; S82-K87 WeakPolarHBondContact O-CG 3.21Å; S84-K87 WeakPolarHBondContact O-CB 3.44Å; S84-K87 PolarHBondContact O-N 3.14Å; S84-K87 WeakPolarHBondContact OG-CB 3.4Å; S84-K87 PolarHBondContact OG-N 3.47Å; S84-K87 VanDerWaalsContact OG-N 3.11Å; R85-K87 VanDerWaalsContact C-N 3.32Å; R85-K87 PolarHBondContact O-N 3.47Å; K87-I89 PolarHBondContact O-N 3.44Å; K87-L90 WeakPolarHBondContact O-CB 3.46Å; K87-L90 PolarHBondContact O-N 3.45Å; K87-E91 HydrophobicContact CD-CG 3.96Å; K87-E91 VanDerWaalsContact CE-CG 3.43Å; K87-E91 WeakPolarHBondContact CE-OE1 3.41Å; K87-E91 HydrophobicContact CG-CG 4.33Å; K87-E91 IonicContact NZ-OE1 2.73Å; K87-E91 WeakPolarHBondContact O-CG 3.32Å; K87-E91 PolarHBondContact O-N 2.99Å
88K86.4Confident87.1Confident18 Ų1833.5 Ų33.58%0.07819%0.19CC..Hα-helixtrans-54.8-38.8175.8-63.8178.9-172.7177.90112S84 R85 C92 D312 S313S84-K88 PolarHBondContact O-N 3.07Å; R85-K88 PolarHBondContact O-N 3.26Å; K88-C92 PolarHBondContact O-N 3.26Å; K88-C92 VanDerWaalsContact O-N 3.16Å; K88-C92 PolarHBondContact O-SG 3.03Å; K88-D312 PolarHBondContact NZ-O 3.21Å; K88-S313 PolarHBondContact NZ-OG 3.26Å
89I87.9Confident87.9Confident14 Ų1432.4 Ų32.47%0.07218%0.176CC..Hα-helixtrans-67.2-46.2175.2-61.4166.7000110.9L53 R85 A86 K87 E91 C92 F93 L207 Y210L53-I89 HydrophobicContact CD1-CG2 3.68Å; L53-I89 HydrophobicContact CD2-CB 4.27Å; L53-I89 HydrophobicContact CD2-CG2 4.29Å; L53-I89 HydrophobicContact CG-CG2 4.29Å; R85-I89 HydrophobicContact CG-CD1 4.24Å; R85-I89 WeakPolarHBondContact O-CG1 3.41Å; R85-I89 PolarHBondContact O-N 2.67Å; R85-I89 VanDerWaalsContact O-N 3.09Å; A86-I89 WeakPolarHBondContact O-CB 3.41Å; A86-I89 PolarHBondContact O-N 3Å; K87-I89 PolarHBondContact O-N 3.44Å; I89-E91 VanDerWaalsContact C-N 3.33Å; I89-E91 PolarHBondContact O-N 3.05Å; I89-C92 PolarHBondContact O-N 3.16Å; I89-F93 WeakPolarHBondContact O-CB 3.25Å; I89-F93 PolarHBondContact O-N 3.38Å; I89-L207 HydrophobicContact CG2-CD2 4.04Å; I89-Y210 HydrophobicContact CB-CE2 4.43Å; I89-Y210 HydrophobicContact CD1-CD1 4.02Å; I89-Y210 HydrophobicContact CD1-CD2 4.31Å; I89-Y210 HydrophobicContact CD1-CE1 4.4Å; I89-Y210 HydrophobicContact CD1-CG 3.96Å; I89-Y210 HydrophobicContact CG1-CD1 3.89Å; I89-Y210 HydrophobicContact CG1-CD2 3.58Å; I89-Y210 HydrophobicContact CG1-CE1 3.9Å; I89-Y210 HydrophobicContact CG1-CE2 3.6Å; I89-Y210 HydrophobicContact CG1-CG 3.71Å
90L91.6Very high88.7Confident1 Ų133.3 Ų33.31%0.00518%0.177CC..Hα-helixtrans-60.2-41.2178.1-65.8172.2000112E45 V50 L53 H75 A86 K87 F93 W94E45-L90 HydrophobicContact CB-CB 4.37Å; E45-L90 HydrophobicContact CG-CB 4.18Å; V50-L90 HydrophobicContact CG2-CD1 4.01Å; V50-L90 HydrophobicContact CG2-CD2 4.47Å; L53-L90 HydrophobicContact CD1-CD2 4Å; L53-L90 HydrophobicContact CD2-CD2 4.03Å; L53-L90 HydrophobicContact CD2-CG 4.03Å; H75-L90 VanDerWaalsContact CE1-CD1 3.5Å; H75-L90 WeakPolarHBondContact CE1-CD1 3.21Å; A86-L90 VanDerWaalsContact O-CG 3.32Å; A86-L90 WeakPolarHBondContact O-CG 3.32Å; A86-L90 PolarHBondContact O-N 2.89Å; K87-L90 WeakPolarHBondContact O-CB 3.46Å; K87-L90 PolarHBondContact O-N 3.45Å; L90-F93 PolarHBondContact O-N 3.43Å; L90-W94 PolarHBondContact O-N 3.24Å
91E90.1Very high89.7Confident4 Ų436.5 Ų36.52%0.01919%0.191CC..Hα-helixtrans-59.4-48.8174.1-67.5177.4175.200111.8K87 I89 F93 W94 R95 R159K87-E91 HydrophobicContact CD-CG 3.96Å; K87-E91 VanDerWaalsContact CE-CG 3.43Å; K87-E91 WeakPolarHBondContact CE-OE1 3.41Å; K87-E91 HydrophobicContact CG-CG 4.33Å; K87-E91 IonicContact NZ-OE1 2.73Å; K87-E91 WeakPolarHBondContact O-CG 3.32Å; K87-E91 PolarHBondContact O-N 2.99Å; I89-E91 VanDerWaalsContact C-N 3.33Å; I89-E91 PolarHBondContact O-N 3.05Å; E91-F93 VanDerWaalsContact C-N 3.26Å; E91-F93 PolarHBondContact O-N 3.18Å; E91-W94 PolarHBondContact O-N 2.89Å; E91-R95 WeakPolarHBondContact O-CG 3.06Å; E91-R95 PolarHBondContact O-N 3.46Å; E91-R159 IonicContact OE2-NH2 2.98Å; E91-R159 PolarHBondContact OE2-NH2 3.25Å
92C91.8Very high90.6Very high1 Ų134 Ų341%0.00717%0.17CC..Hα-helixtrans-62.8-37.8177.7-63.20000110.5K88 I89 R95 F96 K206 L207K88-C92 PolarHBondContact O-N 3.26Å; K88-C92 VanDerWaalsContact O-N 3.16Å; K88-C92 PolarHBondContact O-SG 3.03Å; I89-C92 PolarHBondContact O-N 3.16Å; C92-R95 PolarHBondContact O-N 3.23Å; C92-F96 VanDerWaalsContact O-CB 3.25Å; C92-F96 WeakPolarHBondContact O-CB 3.38Å; C92-F96 PolarHBondContact O-N 3.43Å; C92-K206 HydrophobicContact CB-CB 4.45Å; C92-L207 HydrophobicContact CB-CD2 3.87Å; C92-L207 HydrophobicContact CB-CG 4.22Å
93F93.9Very high91.5Very high35 Ų3534 Ų3415%0.15417%0.165CC..Hα-helixtrans-69.9-42.3-179-170.4-161000112.4I48 Y52 I89 L90 E91 F96 S97 L207I48-F93 HydrophobicContact CG2-CE1 4.18Å; I48-F93 HydrophobicContact CG2-CZ 4.34Å; Y52-F93 HydrophobicContact CD1-CE1 4.27Å; Y52-F93 HydrophobicContact CG-CE1 4.12Å; I89-F93 WeakPolarHBondContact O-CB 3.25Å; I89-F93 PolarHBondContact O-N 3.38Å; L90-F93 PolarHBondContact O-N 3.43Å; E91-F93 VanDerWaalsContact C-N 3.26Å; E91-F93 PolarHBondContact O-N 3.18Å; F93-F96 HydrophobicContact CD2-CD1 4.5Å; F93-S97 WeakPolarHBondContact O-CB 3.48Å; F93-S97 PolarHBondContact O-N 3.47Å; F93-S97 PolarHBondContact O-OG 3.29Å; F93-L207 HydrophobicContact CB-CD1 4.39Å; F93-L207 HydrophobicContact CB-CD2 3.94Å; F93-L207 HydrophobicContact CD2-CD1 4.12Å
94W95Very high92.5Very high14 Ų1434.7 Ų34.75%0.05317%0.165CC..Hα-helixtrans-57.4-52.4170.8167.6-109.3000111.6I40 R41 W44 E45 L90 E91 F96 S97 Y98 F145I40-W94 HydrophobicContact CB-CH2 4.28Å; I40-W94 HydrophobicContact CG2-CH2 3.59Å; I40-W94 HydrophobicContact CG2-CZ3 3.97Å; R41-W94 HydrophobicContact CB-CD2 3.88Å; R41-W94 VanDerWaalsContact CB-CE2 3.47Å; R41-W94 HydrophobicContact CB-CE3 4.47Å; R41-W94 HydrophobicContact CB-CG 4.27Å; R41-W94 HydrophobicContact CB-CH2 4.34Å; R41-W94 HydrophobicContact CB-CZ2 3.73Å; R41-W94 HydrophobicContact CG-CD2 3.87Å; R41-W94 HydrophobicContact CG-CG 3.72Å; W44-W94 HydrophobicContact CB-CE3 3.52Å; W44-W94 HydrophobicContact CB-CZ3 3.57Å; W44-W94 AromaticContact CD1-CE3 3.5Å; W44-W94 VanDerWaalsContact CD1-CE3 3.5Å; W44-W94 HydrophobicContact CD2-CE3 4.24Å; W44-W94 HydrophobicContact CD2-CZ3 4.25Å; W44-W94 AromaticContact CG-CE3 3.45Å; W44-W94 HydrophobicContact CG-CE3 3.45Å; W44-W94 VanDerWaalsContact CG-CE3 3.45Å; W44-W94 AromaticContact CG-CZ3 3.73Å; W44-W94 HydrophobicContact CG-CZ3 3.73Å; E45-W94 HydrophobicContact CG-CB 4.13Å; L90-W94 PolarHBondContact O-N 3.24Å; E91-W94 PolarHBondContact O-N 2.89Å; W94-F96 PolarHBondContact O-N 2.88Å; W94-S97 PolarHBondContact O-N 3.2Å; W94-S97 VanDerWaalsContact O-N 3.14Å; W94-Y98 HydrophobicContact CZ2-CD2 4.39Å; W94-Y98 PolarHBondContact O-N 3.46Å; W94-F145 AromaticContact NE1-CE2 3.86Å
95R94.8Very high93.3Very high39 Ų3935.3 Ų35.315%0.14716%0.162CC..Hα-helixtrans-61.5-43.4-179.1-69.5178.4-174.4-142.41.4111.7E91 C92 S97 Y98 Y99 D156 E203E91-R95 WeakPolarHBondContact O-CG 3.06Å; E91-R95 PolarHBondContact O-N 3.46Å; C92-R95 PolarHBondContact O-N 3.23Å; R95-S97 VanDerWaalsContact C-N 3.32Å; R95-S97 PolarHBondContact O-N 2.98Å; R95-Y98 PolarHBondContact O-N 2.67Å; R95-Y99 HydrophobicContact CB-CD2 4.13Å; R95-Y99 HydrophobicContact CB-CE2 3.88Å; R95-Y99 HydrophobicContact CG-CE2 4.49Å; R95-Y99 WeakPolarHBondContact O-CB 3.31Å; R95-Y99 WeakPolarHBondContact O-CD2 3.49Å; R95-Y99 PolarHBondContact O-N 3.28Å; R95-D156 IonicContact NH2-OD2 3.34Å; R95-D156 PolarHBondContact NH2-OD2 3.12Å; R95-E203 HydrophobicContact CB-CG 3.76Å
96F96.4Very high94.1Very high65 Ų6529.5 Ų29.529%0.28514%0.14SC..Hα-helixtrans-56.9-45.7173.7176.3-104.9000112.2C92 F93 W94 T100 V200 E203 L207C92-F96 VanDerWaalsContact O-CB 3.25Å; C92-F96 WeakPolarHBondContact O-CB 3.38Å; C92-F96 PolarHBondContact O-N 3.43Å; F93-F96 HydrophobicContact CD2-CD1 4.5Å; W94-F96 PolarHBondContact O-N 2.88Å; F96-T100 VanDerWaalsContact O-CB 3.29Å; F96-T100 WeakPolarHBondContact O-CB 3.39Å; F96-T100 PolarHBondContact O-N 3.45Å; F96-T100 PolarHBondContact O-OG1 3.03Å; F96-V200 HydrophobicContact CD2-CG1 4.4Å; F96-V200 WeakPolarHBondContact CD2-O 3.38Å; F96-V200 HydrophobicContact CE2-CG1 3.89Å; F96-E203 HydrophobicContact CB-CB 3.8Å; F96-E203 HydrophobicContact CD2-CB 4.48Å; F96-L207 HydrophobicContact CB-CD1 3.82Å; F96-L207 HydrophobicContact CD1-CD1 4.04Å; F96-L207 HydrophobicContact CG-CD1 3.91Å
97S96.9Very high94.7Very high26 Ų2632.6 Ų32.618%0.18216%0.155CC..Hα-helixtrans-65.8-44.3-178.7-53.80000111F93 W94 R95 F101F93-S97 WeakPolarHBondContact O-CB 3.48Å; F93-S97 PolarHBondContact O-N 3.47Å; F93-S97 PolarHBondContact O-OG 3.29Å; W94-S97 PolarHBondContact O-N 3.2Å; W94-S97 VanDerWaalsContact O-N 3.14Å; R95-S97 VanDerWaalsContact C-N 3.32Å; R95-S97 PolarHBondContact O-N 2.98Å; S97-F101 WeakPolarHBondContact O-CB 3.08Å; S97-F101 PolarHBondContact O-N 3.16Å; S97-F101 VanDerWaalsContact O-N 3.1Å
98Y97.4Very high95.2Very high15 Ų1539 Ų396%0.05918%0.179CC..Hα-helixtrans-63.3-55.1176.5-177.6-84.6000111.8L37 W94 R95 T100 F101 A102 I141 F145L37-Y98 HydrophobicContact CD2-CE2 4.45Å; W94-Y98 HydrophobicContact CZ2-CD2 4.39Å; W94-Y98 PolarHBondContact O-N 3.46Å; R95-Y98 PolarHBondContact O-N 2.67Å; Y98-T100 PolarHBondContact O-N 3.11Å; Y98-F101 WeakPolarHBondContact O-CB 3.31Å; Y98-F101 PolarHBondContact O-N 3.43Å; Y98-A102 HydrophobicContact CD1-CB 4.29Å; Y98-A102 HydrophobicContact CE1-CB 3.92Å; Y98-A102 VanDerWaalsContact O-CB 3.32Å; Y98-A102 WeakPolarHBondContact O-CB 3.39Å; Y98-A102 PolarHBondContact O-N 2.96Å; Y98-I141 PolarHBondContact OH-O 3.4Å; Y98-F145 AromaticContact CD1-CD1 3.61Å; Y98-F145 HydrophobicContact CD1-CD1 3.61Å; Y98-F145 AromaticContact CD1-CD2 3.78Å; Y98-F145 HydrophobicContact CD1-CD2 3.78Å; Y98-F145 AromaticContact CD1-CE1 3.37Å; Y98-F145 HydrophobicContact CD1-CE1 3.37Å; Y98-F145 AromaticContact CD1-CE2 3.55Å; Y98-F145 HydrophobicContact CD1-CE2 3.55Å; Y98-F145 AromaticContact CD1-CG 3.79Å; Y98-F145 HydrophobicContact CD1-CG 3.79Å; Y98-F145 AromaticContact CD1-CZ 3.34Å; Y98-F145 HydrophobicContact CD1-CZ 3.34Å; Y98-F145 AromaticContact CD2-CD2 3.62Å; Y98-F145 HydrophobicContact CD2-CD2 3.62Å; Y98-F145 AromaticContact CD2-CE2 3.67Å; Y98-F145 HydrophobicContact CD2-CE2 3.67Å; Y98-F145 HydrophobicContact CD2-CG 4.23Å; Y98-F145 HydrophobicContact CD2-CZ 4.32Å; Y98-F145 HydrophobicContact CE1-CB 3.8Å; Y98-F145 AromaticContact CE1-CD1 3.18Å; Y98-F145 HydrophobicContact CE1-CD1 3.18Å; Y98-F145 AromaticContact CE1-CD2 3.65Å; Y98-F145 HydrophobicContact CE1-CD2 3.65Å; Y98-F145 AromaticContact CE1-CE1 3.5Å; Y98-F145 HydrophobicContact CE1-CE1 3.5Å; Y98-F145 AromaticContact CE1-CE2 3.93Å; Y98-F145 HydrophobicContact CE1-CE2 3.93Å; Y98-F145 AromaticContact CE1-CG 3.26Å; Y98-F145 HydrophobicContact CE1-CG 3.26Å; Y98-F145 AromaticContact CE1-CZ 3.86Å; Y98-F145 HydrophobicContact CE1-CZ 3.86Å; Y98-F145 HydrophobicContact CE2-CB 3.93Å; Y98-F145 HydrophobicContact CE2-CD1 4.48Å; Y98-F145 AromaticContact CE2-CD2 3.46Å; Y98-F145 HydrophobicContact CE2-CD2 3.46Å; Y98-F145 VanDerWaalsContact CE2-CD2 3.46Å; Y98-F145 HydrophobicContact CE2-CE2 4.01Å; Y98-F145 AromaticContact CE2-CG 3.73Å; Y98-F145 HydrophobicContact CE2-CG 3.73Å; Y98-F145 HydrophobicContact CG-CD1 4.44Å; Y98-F145 AromaticContact CG-CD2 3.79Å; Y98-F145 HydrophobicContact CG-CD2 3.79Å; Y98-F145 HydrophobicContact CG-CE1 4.14Å; Y98-F145 AromaticContact CG-CE2 3.43Å; Y98-F145 HydrophobicContact CG-CE2 3.43Å; Y98-F145 VanDerWaalsContact CG-CE2 3.43Å; Y98-F145 HydrophobicContact CG-CG 4.27Å; Y98-F145 AromaticContact CG-CZ 3.63Å; Y98-F145 HydrophobicContact CG-CZ 3.63Å; Y98-F145 AromaticContact CZ-CD1 3.69Å; Y98-F145 AromaticContact CZ-CD2 3.5Å; Y98-F145 VanDerWaalsContact CZ-CD2 3.5Å; Y98-F145 AromaticContact CZ-CG 3.22Å; Y98-F145 WeakPolarHBondContact OH-CB 3.25Å
99Y97.7Very high95.7Very high12 Ų1238.8 Ų38.85%0.04718%0.18CC..Hα-helixtrans-60.9-34.6-178.1-67.9-49.8000112.2R95 F103 F145 D199 V200 E203R95-Y99 HydrophobicContact CB-CD2 4.13Å; R95-Y99 HydrophobicContact CB-CE2 3.88Å; R95-Y99 HydrophobicContact CG-CE2 4.49Å; R95-Y99 WeakPolarHBondContact O-CB 3.31Å; R95-Y99 WeakPolarHBondContact O-CD2 3.49Å; R95-Y99 PolarHBondContact O-N 3.28Å; Y99-F103 WeakPolarHBondContact O-CB 3.38Å; Y99-F103 PolarHBondContact O-N 2.9Å; Y99-F145 HydrophobicContact CD1-CE1 4.34Å; Y99-F145 HydrophobicContact CE1-CD1 4.42Å; Y99-F145 AromaticContact CE1-CE1 3.58Å; Y99-F145 HydrophobicContact CE1-CE1 3.58Å; Y99-F145 HydrophobicContact CE1-CZ 4.36Å; Y99-F145 AromaticContact CZ-CE1 3.89Å; Y99-D199 HydrophobicContact CD1-CB 4.22Å; Y99-D199 HydrophobicContact CD2-CB 3.76Å; Y99-D199 HydrophobicContact CE1-CB 4.33Å; Y99-D199 HydrophobicContact CE2-CB 3.86Å; Y99-D199 HydrophobicContact CG-CB 3.96Å; Y99-V200 VanDerWaalsContact C-CG2 3.49Å; Y99-V200 WeakPolarHBondContact O-CG2 3.38Å; Y99-E203 HydrophobicContact CD2-CG 3.97Å; Y99-E203 HydrophobicContact CE2-CG 4.04Å
100T97.9Very high96.1Very high40 Ų4038.1 Ų38.125%0.24518%0.176CC..Hα-helixtrans-65.3-46.2175.2-57.90000110.8F96 Y98 L104F96-T100 VanDerWaalsContact O-CB 3.29Å; F96-T100 WeakPolarHBondContact O-CB 3.39Å; F96-T100 PolarHBondContact O-N 3.45Å; F96-T100 PolarHBondContact O-OG1 3.03Å; Y98-T100 PolarHBondContact O-N 3.11Å; T100-L104 HydrophobicContact CG2-CD1 4.1Å; T100-L104 WeakPolarHBondContact O-CB 3.39Å; T100-L104 VanDerWaalsContact O-CG 3.23Å; T100-L104 WeakPolarHBondContact O-CG 3.46Å; T100-L104 PolarHBondContact O-N 2.81Å; T100-L104 VanDerWaalsContact O-N 3.08Å
101F97.6Very high96.2Very high118 Ų11843 Ų4352%0.51820%0.197SC..Hα-helixtrans-61.5-50.5176.1168.5-96.1000111.9S97 Y98 F103 L104 Y105S97-F101 WeakPolarHBondContact O-CB 3.08Å; S97-F101 PolarHBondContact O-N 3.16Å; S97-F101 VanDerWaalsContact O-N 3.1Å; Y98-F101 WeakPolarHBondContact O-CB 3.31Å; Y98-F101 PolarHBondContact O-N 3.43Å; F101-F103 PolarHBondContact O-N 2.79Å; F101-L104 PolarHBondContact O-N 2.9Å; F101-Y105 WeakPolarHBondContact O-CB 3.46Å; F101-Y105 PolarHBondContact O-N 2.98Å
102A97.1Very high96.4Very high2 Ų249.5 Ų49.52%0.01723%0.233CC..Hα-helixtrans-53.2-51.9177.200000112Y98 L104 Y105 G106 E142Y98-A102 HydrophobicContact CD1-CB 4.29Å; Y98-A102 HydrophobicContact CE1-CB 3.92Å; Y98-A102 VanDerWaalsContact O-CB 3.32Å; Y98-A102 WeakPolarHBondContact O-CB 3.39Å; Y98-A102 PolarHBondContact O-N 2.96Å; A102-L104 PolarHBondContact O-N 2.87Å; A102-Y105 PolarHBondContact O-N 3.19Å; A102-G106 PolarHBondContact O-N 2.87Å; A102-E142 WeakPolarHBondContact CB-OE1 3.34Å
103F97.9Very high96.6Very high45 Ų4549.9 Ų49.920%0.19724%0.235CC..Hα-helixtrans-61.9-45.5179.5-179.5-113000112.4Y99 F101 Y105 G106 L107 L193 D196 V197 V200Y99-F103 WeakPolarHBondContact O-CB 3.38Å; Y99-F103 PolarHBondContact O-N 2.9Å; F101-F103 PolarHBondContact O-N 2.79Å; F103-Y105 VanDerWaalsContact C-N 3.34Å; F103-Y105 PolarHBondContact O-N 3.42Å; F103-G106 PolarHBondContact O-N 3.32Å; F103-L107 HydrophobicContact CD1-CD1 4.18Å; F103-L107 HydrophobicContact CE1-CD1 3.65Å; F103-L107 HydrophobicContact CE1-CG 4.29Å; F103-L107 HydrophobicContact CE2-CD2 4.41Å; F103-L107 HydrophobicContact CE2-CG 4.33Å; F103-L107 HydrophobicContact CZ-CD1 3.85Å; F103-L107 HydrophobicContact CZ-CD2 4.21Å; F103-L107 HydrophobicContact CZ-CG 4.1Å; F103-L107 WeakPolarHBondContact O-CG 3.37Å; F103-L107 PolarHBondContact O-N 2.98Å; F103-L193 HydrophobicContact CD2-CD1 3.81Å; F103-L193 HydrophobicContact CE2-CD1 3.81Å; F103-L193 HydrophobicContact CE2-CG 4.43Å; F103-D196 HydrophobicContact CB-CB 4.06Å; F103-D196 HydrophobicContact CD2-CB 4.24Å; F103-V197 HydrophobicContact CD2-CB 3.95Å; F103-V197 HydrophobicContact CE1-CG2 4.14Å; F103-V197 HydrophobicContact CE2-CB 3.56Å; F103-V197 HydrophobicContact CE2-CG2 3.98Å; F103-V197 HydrophobicContact CZ-CB 3.86Å; F103-V197 HydrophobicContact CZ-CG2 3.71Å; F103-V200 HydrophobicContact CB-CG2 4.29Å
104L98.3Very high96.8Very high104 Ų10450.9 Ų50.955%0.54525%0.246SC..Hα-helixtrans-64.9-38.9177.6-69.3175.7000112T100 F101 A102 L107 Y108T100-L104 HydrophobicContact CG2-CD1 4.1Å; T100-L104 WeakPolarHBondContact O-CB 3.39Å; T100-L104 VanDerWaalsContact O-CG 3.23Å; T100-L104 WeakPolarHBondContact O-CG 3.46Å; T100-L104 PolarHBondContact O-N 2.81Å; T100-L104 VanDerWaalsContact O-N 3.08Å; F101-L104 PolarHBondContact O-N 2.9Å; A102-L104 PolarHBondContact O-N 2.87Å; L104-L107 PolarHBondContact O-N 2.86Å; L104-Y108 PolarHBondContact O-N 3.03Å; L104-Y108 VanDerWaalsContact O-N 3.07Å
105Y98.1Very high96.8Very high51 Ų5151.2 Ų51.220%0.225%0.248CC..Hα-helixtrans-66.1-43.6175.1-177-133.1000111.3F101 A102 F103 L107 Y108 V109 T134 Y138F101-Y105 WeakPolarHBondContact O-CB 3.46Å; F101-Y105 PolarHBondContact O-N 2.98Å; A102-Y105 PolarHBondContact O-N 3.19Å; F103-Y105 VanDerWaalsContact C-N 3.34Å; F103-Y105 PolarHBondContact O-N 3.42Å; Y105-L107 PolarHBondContact O-N 2.98Å; Y105-Y108 HydrophobicContact CD2-CD1 4.27Å; Y105-Y108 HydrophobicContact CE2-CD1 4.29Å; Y105-Y108 WeakPolarHBondContact O-CB 3.21Å; Y105-Y108 PolarHBondContact O-N 3.06Å; Y105-Y108 VanDerWaalsContact O-N 3.13Å; Y105-V109 HydrophobicContact CD2-CG2 3.85Å; Y105-V109 HydrophobicContact CE1-CG2 4.27Å; Y105-V109 HydrophobicContact CE2-CG2 3.48Å; Y105-V109 VanDerWaalsContact CE2-CG2 3.48Å; Y105-V109 HydrophobicContact CG-CG2 4.37Å; Y105-V109 VanDerWaalsContact O-CG2 3.32Å; Y105-V109 WeakPolarHBondContact O-CG2 3.45Å; Y105-V109 PolarHBondContact O-N 3.28Å; Y105-T134 PolarHBondContact OH-O 3.01Å; Y105-Y138 AromaticContact CD1-CD2 3.75Å; Y105-Y138 HydrophobicContact CD1-CD2 3.75Å; Y105-Y138 HydrophobicContact CD1-CG 4.38Å; Y105-Y138 HydrophobicContact CE1-CD2 4.15Å; Y105-Y138 HydrophobicContact CE1-CG 4.39Å
106G97.8Very high96.9Very high0 Ų051.8 Ų51.80%025%0.254CS..Hα-helixtrans-56.8-45.8173.700000112.4A102 F103 Y108 V109 M110A102-G106 PolarHBondContact O-N 2.87Å; F103-G106 PolarHBondContact O-N 3.32Å; G106-Y108 VanDerWaalsContact C-N 3.35Å; G106-Y108 PolarHBondContact O-N 3.26Å; G106-V109 PolarHBondContact O-N 3.49Å; G106-M110 WeakPolarHBondContact O-CB 3.4Å; G106-M110 WeakPolarHBondContact O-CG 3.25Å; G106-M110 PolarHBondContact O-N 3.37Å
107L97.6Very high96.7Very high77 Ų7757.2 Ų57.240%0.40327%0.273SS..Hα-helixtrans-59-44.6174.1-71.9177.2000112.1F103 L104 Y105 K111 L193F103-L107 HydrophobicContact CD1-CD1 4.18Å; F103-L107 HydrophobicContact CE1-CD1 3.65Å; F103-L107 HydrophobicContact CE1-CG 4.29Å; F103-L107 HydrophobicContact CE2-CD2 4.41Å; F103-L107 HydrophobicContact CE2-CG 4.33Å; F103-L107 HydrophobicContact CZ-CD1 3.85Å; F103-L107 HydrophobicContact CZ-CD2 4.21Å; F103-L107 HydrophobicContact CZ-CG 4.1Å; F103-L107 WeakPolarHBondContact O-CG 3.37Å; F103-L107 PolarHBondContact O-N 2.98Å; L104-L107 PolarHBondContact O-N 2.86Å; Y105-L107 PolarHBondContact O-N 2.98Å; L107-K111 WeakPolarHBondContact O-CB 3.49Å; L107-K111 PolarHBondContact O-N 3.28Å; L107-K111 VanDerWaalsContact O-N 3.13Å; L107-L193 HydrophobicContact CD2-CD1 4.08Å; L107-L193 HydrophobicContact CD2-CD2 4.41Å; L107-L193 HydrophobicContact CG-CD1 4.16Å
108Y97.4Very high96.6Very high137 Ų13759 Ų5954%0.53728%0.281SS..Hα-helixtrans-62-44.4178.4169.7-98.9000112.4L104 Y105 G106 K111L104-Y108 PolarHBondContact O-N 3.03Å; L104-Y108 VanDerWaalsContact O-N 3.07Å; Y105-Y108 HydrophobicContact CD2-CD1 4.27Å; Y105-Y108 HydrophobicContact CE2-CD1 4.29Å; Y105-Y108 WeakPolarHBondContact O-CB 3.21Å; Y105-Y108 PolarHBondContact O-N 3.06Å; Y105-Y108 VanDerWaalsContact O-N 3.13Å; G106-Y108 VanDerWaalsContact C-N 3.35Å; G106-Y108 PolarHBondContact O-N 3.26Å; Y108-K111 WeakPolarHBondContact O-CD 3.32Å; Y108-K111 WeakPolarHBondContact O-CG 3.49Å
109V96.3Very high96.6Very high14 Ų1459.2 Ų59.29%0.08528%0.284CS..Hα-helixtrans-71-38.3-178.5172.80000111.4Y105 G106 I135Y105-V109 HydrophobicContact CD2-CG2 3.85Å; Y105-V109 HydrophobicContact CE1-CG2 4.27Å; Y105-V109 HydrophobicContact CE2-CG2 3.48Å; Y105-V109 VanDerWaalsContact CE2-CG2 3.48Å; Y105-V109 HydrophobicContact CG-CG2 4.37Å; Y105-V109 VanDerWaalsContact O-CG2 3.32Å; Y105-V109 WeakPolarHBondContact O-CG2 3.45Å; Y105-V109 PolarHBondContact O-N 3.28Å; G106-V109 PolarHBondContact O-N 3.49Å; V109-I135 HydrophobicContact CG1-CB 4.33Å; V109-I135 HydrophobicContact CG1-CG1 3.46Å; V109-I135 VanDerWaalsContact CG1-CG1 3.46Å
110M96.4Very high96.4Very high0 Ų063.2 Ų63.20%030%0.301CS..Hα-helixtrans-90.4-11.4-171.1-66.2-73.5-71.400114.6G106 N112 S113 W115 L116 T189 L190 L193G106-M110 WeakPolarHBondContact O-CB 3.4Å; G106-M110 WeakPolarHBondContact O-CG 3.25Å; G106-M110 PolarHBondContact O-N 3.37Å; M110-N112 PolarHBondContact O-N 2.91Å; M110-S113 VanDerWaalsContact O-CB 3.27Å; M110-S113 WeakPolarHBondContact O-CB 3.46Å; M110-S113 PolarHBondContact O-N 2.95Å; M110-S113 PolarHBondContact O-OG 3.05Å; M110-W115 HydrophobicContact SD-CZ2 4.26Å; M110-L116 HydrophobicContact CB-CD2 4.35Å; M110-L116 HydrophobicContact CE-CD1 4.48Å; M110-L116 WeakPolarHBondContact O-CD2 3.3Å; M110-T189 WeakPolarHBondContact CE-OG1 3.42Å; M110-T189 VanDerWaalsContact SD-CB 3.58Å; M110-T189 HydrophobicContact SD-CG2 4.24Å; M110-T189 PolarHBondContact SD-OG1 3.32Å; M110-L190 HydrophobicContact CE-CD2 3.73Å; M110-L190 HydrophobicContact CE-CG 4.45Å; M110-L193 HydrophobicContact CB-CD2 4.23Å; M110-L193 HydrophobicContact CG-CD2 4.35Å
111K94.6Very high96.3Very high103 Ų10363.8 Ų63.845%0.44830%0.301SS..THydrogen-bonded Turntrans-52.4-33.1-172.568.8-173.5-179.4-178.30115.3L107 Y108 Y117L107-K111 WeakPolarHBondContact O-CB 3.49Å; L107-K111 PolarHBondContact O-N 3.28Å; L107-K111 VanDerWaalsContact O-N 3.13Å; Y108-K111 WeakPolarHBondContact O-CD 3.32Å; Y108-K111 WeakPolarHBondContact O-CG 3.49Å; K111-Y117 PolarHBondContact O-OH 2.97Å
112N94.5Very high96.3Very high142 Ų14258.2 Ų58.276%0.75928%0.277SS*.THydrogen-bonded Turntrans-1044.6-177.4-66.5-23.9000113M110M110-N112 PolarHBondContact O-N 2.91Å
113S95.6Very high96.2Very high8 Ų858.3 Ų58.36%0.05628%0.277CS..  trans-81120.9-177.6-62.40000110.2M110 W115 L116M110-S113 VanDerWaalsContact O-CB 3.27Å; M110-S113 WeakPolarHBondContact O-CB 3.46Å; M110-S113 PolarHBondContact O-N 2.95Å; M110-S113 PolarHBondContact O-OG 3.05Å; S113-W115 VanDerWaalsContact CB-CE2 3.48Å; S113-W115 VanDerWaalsContact CB-CZ2 3.49Å; S113-W115 PolarHBondContact O-N 2.97Å; S113-W115 WeakPolarHBondContact OG-CH2 3.44Å; S113-W115 VanDerWaalsContact OG-CZ2 3.26Å; S113-W115 WeakPolarHBondContact OG-CZ2 3.39Å; S113-L116 VanDerWaalsContact O-CB 3.25Å; S113-L116 WeakPolarHBondContact O-CB 3.3Å; S113-L116 PolarHBondContact O-N 3Å
114S96.9Very high96Very high56 Ų5660 Ų6039%0.39229%0.287SS..G310 helixtrans-58.9-33.9-179.1580000113L116 Y117 D118S114-L116 PolarHBondContact O-N 3.12Å; S114-Y117 PolarHBondContact O-N 3.46Å; S114-Y117 VanDerWaalsContact O-N 3.12Å; S114-D118 PolarHBondContact O-N 3.02Å; S114-D118 VanDerWaalsContact O-N 3.1Å
115W96.3Very high95.8Very high21 Ų2157.2 Ų57.28%0.0828%0.284CS..G310 helixtrans-70.6-11.1179.162.493000114.6M110 S113 Y117 D118 Q121 I135 R186 T189 L190M110-W115 HydrophobicContact SD-CZ2 4.26Å; S113-W115 VanDerWaalsContact CB-CE2 3.48Å; S113-W115 VanDerWaalsContact CB-CZ2 3.49Å; S113-W115 PolarHBondContact O-N 2.97Å; S113-W115 WeakPolarHBondContact OG-CH2 3.44Å; S113-W115 VanDerWaalsContact OG-CZ2 3.26Å; S113-W115 WeakPolarHBondContact OG-CZ2 3.39Å; W115-Y117 PolarHBondContact O-N 2.85Å; W115-D118 WeakPolarHBondContact CA-O 3.23Å; W115-Q121 HydrophobicContact CB-CB 3.84Å; W115-I135 HydrophobicContact CH2-CD1 3.66Å; W115-I135 HydrophobicContact CZ2-CD1 3.56Å; W115-R186 HydrophobicContact CB-CB 4.5Å; W115-R186 VanDerWaalsContact CD1-O 3.29Å; W115-R186 HydrophobicContact CD2-CB 3.94Å; W115-R186 HydrophobicContact CD2-CG 3.68Å; W115-R186 HydrophobicContact CE3-CG 3.89Å; W115-R186 HydrophobicContact CG-CB 3.89Å; W115-R186 HydrophobicContact CG-CG 4.16Å; W115-R186 HydrophobicContact CH2-CG 4.28Å; W115-R186 HydrophobicContact CZ2-CG 4.07Å; W115-R186 HydrophobicContact CZ3-CG 4.19Å; W115-R186 PolarHBondContact NE1-O 3.34Å; W115-T189 PolarHBondContact NE1-OG1 3.15Å; W115-L190 WeakPolarHBondContact O-CD1 3.47Å
116L95.5Very high95.6Very high52 Ų5255.4 Ų55.427%0.27228%0.277SS..G310 helixtrans-66.2-30.9169.6-173.262.6000111.6M110 S113 S114 L190 L193M110-L116 HydrophobicContact CB-CD2 4.35Å; M110-L116 HydrophobicContact CE-CD1 4.48Å; M110-L116 WeakPolarHBondContact O-CD2 3.3Å; S113-L116 VanDerWaalsContact O-CB 3.25Å; S113-L116 WeakPolarHBondContact O-CB 3.3Å; S113-L116 PolarHBondContact O-N 3Å; S114-L116 PolarHBondContact O-N 3.12Å; L116-L190 HydrophobicContact CD1-CD2 4.06Å; L116-L193 HydrophobicContact CD1-CD2 3.87Å
117Y93.6Very high95.4Very high178 Ų17855.5 Ų55.570%0.69828%0.277SS*.THydrogen-bonded Turntrans-105.1-29.5-175.1-53-77.8000112.9K111 S114 W115K111-Y117 PolarHBondContact O-OH 2.97Å; S114-Y117 PolarHBondContact O-N 3.46Å; S114-Y117 VanDerWaalsContact O-N 3.12Å; W115-Y117 PolarHBondContact O-N 2.85Å
118D95.1Very high95.4Very high64 Ų6456.7 Ų56.734%0.34228%0.279SS..  trans-132.3106.6176175.416.6000111.1S114 W115 K120 Q121S114-D118 PolarHBondContact O-N 3.02Å; S114-D118 VanDerWaalsContact O-N 3.1Å; W115-D118 WeakPolarHBondContact CA-O 3.23Å; D118-K120 PolarHBondContact O-N 3.09Å; D118-K120 VanDerWaalsContact O-N 3.1Å; D118-K120 WeakPolarHBondContact OD1-CB 3.44Å; D118-K120 PolarHBondContact OD1-N 3.21Å; D118-Q121 HydrophobicContact CB-CG 3.98Å; D118-Q121 VanDerWaalsContact O-CB 3.27Å; D118-Q121 WeakPolarHBondContact O-CB 3.26Å; D118-Q121 WeakPolarHBondContact O-CG 3.49Å; D118-Q121 PolarHBondContact O-N 3.44Å; D118-Q121 PolarHBondContact OD2-NE2 3.46Å
119V95.6Very high95.3Very high19 Ų1950.5 Ų50.512%0.11526%0.256CS..G310 helixtrans-59.8-23.7-177.8700000113.1Q121 C122 L190 I240V119-Q121 PolarHBondContact O-N 3.24Å; V119-C122 WeakPolarHBondContact O-CB 3.32Å; V119-C122 PolarHBondContact O-N 2.86Å; V119-C122 PolarHBondContact O-SG 3.21Å; V119-L190 HydrophobicContact CG2-CD1 4.31Å; V119-I240 HydrophobicContact CB-CG2 4.13Å; V119-I240 HydrophobicContact CG1-CG2 4.1Å; V119-I240 HydrophobicContact CG2-CG2 4.34Å
120K94.1Very high95.3Very high96 Ų9654.2 Ų54.242%0.41728%0.28SS..G310 helixtrans-62.6-28.2176.6-69.2175.7179-178.60112.5D118 C122 W123 I124 E248D118-K120 PolarHBondContact O-N 3.09Å; D118-K120 VanDerWaalsContact O-N 3.1Å; D118-K120 WeakPolarHBondContact OD1-CB 3.44Å; D118-K120 PolarHBondContact OD1-N 3.21Å; K120-C122 PolarHBondContact O-N 3.16Å; K120-C122 VanDerWaalsContact O-N 3.13Å; K120-W123 PolarHBondContact O-N 3.23Å; K120-I124 HydrophobicContact CB-CD1 4.21Å; K120-I124 WeakPolarHBondContact O-CG1 3.5Å; K120-I124 PolarHBondContact O-N 3.25Å; K120-I124 VanDerWaalsContact O-N 3.13Å; K120-E248 WeakPolarHBondContact CE-OE1 3.39Å; K120-E248 VanDerWaalsContact CG-OE2 3.25Å; K120-E248 WeakPolarHBondContact CG-OE2 3.21Å
121Q96.4Very high95.3Very high53 Ų5355.7 Ų55.725%0.24829%0.289CS..G310 helixtrans-64-14.6175.4-57.1-63.8-41.400112.3W115 D118 V119 W123 R186W115-Q121 HydrophobicContact CB-CB 3.84Å; D118-Q121 HydrophobicContact CB-CG 3.98Å; D118-Q121 VanDerWaalsContact O-CB 3.27Å; D118-Q121 WeakPolarHBondContact O-CB 3.26Å; D118-Q121 WeakPolarHBondContact O-CG 3.49Å; D118-Q121 PolarHBondContact O-N 3.44Å; D118-Q121 PolarHBondContact OD2-NE2 3.46Å; V119-Q121 PolarHBondContact O-N 3.24Å; Q121-W123 PolarHBondContact O-N 2.71Å; Q121-R186 VanDerWaalsContact O-CD 3.29Å; Q121-R186 WeakPolarHBondContact O-CD 3.27Å; Q121-R186 PolarHBondContact O-NH1 2.86Å
122C96.7Very high95.4Very high1 Ų153.7 Ų53.71%0.00729%0.287CS..G310 helixtrans-66.2-20.9169.2-65.80000113.3V119 K120 H129 R186 V187 L190V119-C122 WeakPolarHBondContact O-CB 3.32Å; V119-C122 PolarHBondContact O-N 2.86Å; V119-C122 PolarHBondContact O-SG 3.21Å; K120-C122 PolarHBondContact O-N 3.16Å; K120-C122 VanDerWaalsContact O-N 3.13Å; C122-H129 PolarHBondContact O-CE1 3.11Å; C122-H129 VanDerWaalsContact O-CE1 3.23Å; C122-R186 HydrophobicContact CB-CB 4.17Å; C122-V187 HydrophobicContact CB-CB 4.15Å; C122-L190 VanDerWaalsContact SG-CD1 3.54Å
123W95.4Very high95.5Very high3 Ų353.1 Ų53.11%0.01128%0.284CS..THydrogen-bonded Turntrans-119-30.8-171.4-41.4114.6000113.1K120 Q121 G125 Y126 F184 V187 S244 A245 A249 L252K120-W123 PolarHBondContact O-N 3.23Å; Q121-W123 PolarHBondContact O-N 2.71Å; W123-G125 PolarHBondContact O-N 2.94Å; W123-G125 VanDerWaalsContact O-N 3.15Å; W123-Y126 WeakPolarHBondContact O-CB 3.4Å; W123-Y126 PolarHBondContact O-N 2.92Å; W123-F184 HydrophobicContact CE3-CE1 4.24Å; W123-F184 AromaticContact CZ3-CD1 3.98Å; W123-F184 HydrophobicContact CZ3-CD1 3.98Å; W123-F184 HydrophobicContact CZ3-CD2 4.24Å; W123-F184 AromaticContact CZ3-CE1 3.82Å; W123-F184 HydrophobicContact CZ3-CE1 3.82Å; W123-F184 HydrophobicContact CZ3-CE2 4.09Å; W123-F184 HydrophobicContact CZ3-CG 4.22Å; W123-F184 AromaticContact CZ3-CZ 3.91Å; W123-F184 HydrophobicContact CZ3-CZ 3.91Å; W123-V187 HydrophobicContact CH2-CB 4.04Å; W123-V187 HydrophobicContact CH2-CG1 3.79Å; W123-V187 HydrophobicContact CH2-CG2 4.15Å; W123-V187 HydrophobicContact CZ2-CB 4.33Å; W123-V187 HydrophobicContact CZ2-CG2 4.22Å; W123-V187 HydrophobicContact CZ3-CG1 4.16Å; W123-S244 PolarHBondContact NE1-OG 3.13Å; W123-A245 HydrophobicContact CH2-CB 4.06Å; W123-A245 HydrophobicContact CZ2-CB 3.94Å; W123-A249 HydrophobicContact CD2-CB 3.58Å; W123-A249 HydrophobicContact CE3-CB 3.63Å; W123-A249 HydrophobicContact CG-CB 4.16Å; W123-A249 HydrophobicContact CH2-CB 4Å; W123-A249 HydrophobicContact CZ2-CB 3.97Å; W123-A249 HydrophobicContact CZ3-CB 3.84Å; W123-L252 HydrophobicContact CB-CB 3.66Å; W123-L252 HydrophobicContact CB-CD1 3.66Å; W123-L252 HydrophobicContact CB-CG 4.3Å; W123-L252 HydrophobicContact CG-CD1 4.32Å
124I94.7Very high95.6Very high80 Ų8055.8 Ų55.841%0.4130%0.299SS..THydrogen-bonded Turntrans-62.4118.2-179.7-65.1166.5000110.2K120 Y126 H129 L252K120-I124 HydrophobicContact CB-CD1 4.21Å; K120-I124 WeakPolarHBondContact O-CG1 3.5Å; K120-I124 PolarHBondContact O-N 3.25Å; K120-I124 VanDerWaalsContact O-N 3.13Å; I124-Y126 VanDerWaalsContact C-N 3.32Å; I124-H129 PolarHBondContact O-NE2 3.18Å; I124-L252 HydrophobicContact CG1-CD1 4.25Å; I124-L252 HydrophobicContact CG1-CD2 4.33Å
125G92.4Very high95.6Very high47 Ų4753.5 Ų53.549%0.48528%0.283SS..THydrogen-bonded Turntrans80.710.2-178.200000114.5W123 F128W123-G125 PolarHBondContact O-N 2.94Å; W123-G125 VanDerWaalsContact O-N 3.15Å; G125-F128 PolarHBondContact O-N 3.47Å
126Y94.6Very high95.7Very high12 Ų1254.8 Ų54.85%0.04729%0.287CS..THydrogen-bonded Turntrans-59.7142.2167.4175.2-94000110.2P12 W123 I124 H129 I182 F184 I253P12-Y126 HydrophobicContact CG-CD1 4.25Å; P12-Y126 HydrophobicContact CG-CE1 3.74Å; W123-Y126 WeakPolarHBondContact O-CB 3.4Å; W123-Y126 PolarHBondContact O-N 2.92Å; I124-Y126 VanDerWaalsContact C-N 3.32Å; Y126-H129 PolarHBondContact N-NE2 3.36Å; Y126-I182 WeakPolarHBondContact CE2-O 3.13Å; Y126-I182 VanDerWaalsContact CZ-O 3.24Å; Y126-I182 WeakPolarHBondContact OH-CB 3.33Å; Y126-I182 PolarHBondContact OH-O 3.38Å; Y126-F184 HydrophobicContact CD1-CE1 4.35Å; Y126-F184 AromaticContact CD2-CD1 3.71Å; Y126-F184 HydrophobicContact CD2-CD1 3.71Å; Y126-F184 AromaticContact CD2-CE1 3.7Å; Y126-F184 HydrophobicContact CD2-CE1 3.7Å; Y126-F184 AromaticContact CE1-CE1 3.87Å; Y126-F184 HydrophobicContact CE1-CE1 3.87Å; Y126-F184 AromaticContact CE2-CD1 3.19Å; Y126-F184 HydrophobicContact CE2-CD1 3.19Å; Y126-F184 AromaticContact CE2-CE1 3.19Å; Y126-F184 HydrophobicContact CE2-CE1 3.19Å; Y126-F184 HydrophobicContact CE2-CG 4.46Å; Y126-F184 HydrophobicContact CE2-CZ 4.46Å; Y126-F184 HydrophobicContact CG-CE1 4.26Å; Y126-F184 AromaticContact CZ-CD1 3.75Å; Y126-F184 AromaticContact CZ-CE1 3.28Å; Y126-I253 HydrophobicContact CD1-CB 4.26Å; Y126-I253 HydrophobicContact CD1-CG1 3.72Å; Y126-I253 HydrophobicContact CD1-CG2 4.23Å; Y126-I253 HydrophobicContact CE1-CB 4.49Å; Y126-I253 HydrophobicContact CE1-CG1 3.95Å; Y126-I253 HydrophobicContact CE1-CG2 4.05Å; Y126-I253 HydrophobicContact CG-CG1 4.49Å
127P94.8Very high95.9Very high2 Ų258 Ų581%0.01330%0.296CS..THydrogen-bonded Turncis-9415.23.335-32.9000115.5P12 V15 P21 H129 N183P12-P127 HydrophobicContact CG-CG 4.31Å; V15-P127 HydrophobicContact CB-CG 4.43Å; V15-P127 HydrophobicContact CG1-CG 3.73Å; V15-P127 HydrophobicContact CG2-CG 4.04Å; P21-P127 WeakPolarHBondContact CD-O 3.21Å; P127-H129 VanDerWaalsContact C-N 3.31Å; P127-H129 PolarHBondContact O-N 2.79Å; P127-N183 PolarHBondContact O-ND2 3.3Å
128F96.4Very high96.1Very high102 Ų10249.6 Ų49.645%0.44726%0.263SS..  trans-91.219.9-168.7-49.4-70.4000114.4V15 E19 G125 P130V15-F128 HydrophobicContact CG1-CE1 4.26Å; V15-F128 HydrophobicContact CG1-CZ 4.47Å; V15-F128 HydrophobicContact CG2-CZ 3.96Å; E19-F128 HydrophobicContact CB-CE1 4.05Å; G125-F128 PolarHBondContact O-N 3.47Å; F128-P130 WeakPolarHBondContact O-CD 3.37Å
129H96.3Very high96.2Very high8 Ų846.5 Ų46.54%0.03725%0.247CC..  trans-64.3123.8-179.3-62.4151.9000110.8P21 C122 I124 Y126 P127 N183 R186P21-H129 WeakPolarHBondContact CB-O 3.35Å; P21-H129 WeakPolarHBondContact CG-O 3.21Å; C122-H129 PolarHBondContact O-CE1 3.11Å; C122-H129 VanDerWaalsContact O-CE1 3.23Å; I124-H129 PolarHBondContact O-NE2 3.18Å; Y126-H129 PolarHBondContact N-NE2 3.36Å; P127-H129 VanDerWaalsContact C-N 3.31Å; P127-H129 PolarHBondContact O-N 2.79Å; H129-N183 PolarHBondContact N-ND2 3.39Å; H129-N183 PolarHBondContact O-ND2 3.03Å; H129-R186 VanDerWaalsContact CD2-CZ 3.49Å; H129-R186 WeakPolarHBondContact ND1-CD 3.35Å; H129-R186 PolarHBondContact NE2-NH1 2.89Å
130P95.6Very high96.4Very high92 Ų9245.6 Ų45.660%0.59724%0.241SC*.  trans-64.5145.2173.427.8-34000109.7F128 P132F128-P130 WeakPolarHBondContact O-CD 3.37Å; P130-P132 WeakPolarHBondContact O-CD 3.43Å
131V96.8Very high96.5Very high30 Ų3043 Ų4318%0.18223%0.232CC..  trans-113.597176.8-1740000108.3I135 W136 W180 N183 V185V131-I135 HydrophobicContact CG1-CB 4.4Å; V131-I135 HydrophobicContact CG1-CG2 4.02Å; V131-W136 HydrophobicContact CG1-CB 4.18Å; V131-W180 HydrophobicContact CG1-CH2 3.8Å; V131-W180 HydrophobicContact CG1-CZ3 4.17Å; V131-N183 WeakPolarHBondContact CG2-OD1 3.1Å; V131-V185 HydrophobicContact CG1-CG1 4.38Å; V131-V185 HydrophobicContact CG2-CG2 4.2Å
132P96.4Very high96.6Very high62 Ų6240.6 Ų40.640%0.40322%0.22SC..  trans-58.8148.8173.8-22.732.4000111.9P130 T134 I135 W136P130-P132 WeakPolarHBondContact O-CD 3.43Å; P132-T134 PolarHBondContact O-N 3.23Å; P132-T134 VanDerWaalsContact O-N 3.08Å; P132-I135 HydrophobicContact CG-CD1 4.14Å; P132-I135 PolarHBondContact O-N 3.42Å; P132-W136 PolarHBondContact O-N 3.07Å
133D97Very high96.7Very high130 Ų13040.6 Ų40.670%0.69522%0.22SC*.Hα-helixtrans-53.5-34.1-179.5-63.2-6.4000113.4W136 W137D133-W136 WeakPolarHBondContact O-CB 3.48Å; D133-W136 PolarHBondContact O-N 3.22Å; D133-W137 VanDerWaalsContact O-CD1 3.26Å; D133-W137 PolarHBondContact O-N 2.97Å
134T97Very high96.8Very high63 Ų6340.4 Ų40.439%0.38722%0.219SC..Hα-helixtrans-66.7-39.5177.2510000112.7Y105 P132 Y138Y105-T134 PolarHBondContact OH-O 3.01Å; P132-T134 PolarHBondContact O-N 3.23Å; P132-T134 VanDerWaalsContact O-N 3.08Å; T134-Y138 WeakPolarHBondContact O-CB 3.21Å; T134-Y138 PolarHBondContact O-N 3.33Å; T134-Y138 VanDerWaalsContact O-N 3.12Å
135I97.9Very high96.9Very high8 Ų836.6 Ų36.64%0.04120%0.2CC..Hα-helixtrans-71.5-39.7174.5-72.6169000109.8V109 W115 V131 P132 Y138 Y139 V185 T189V109-I135 HydrophobicContact CG1-CB 4.33Å; V109-I135 HydrophobicContact CG1-CG1 3.46Å; V109-I135 VanDerWaalsContact CG1-CG1 3.46Å; W115-I135 HydrophobicContact CH2-CD1 3.66Å; W115-I135 HydrophobicContact CZ2-CD1 3.56Å; V131-I135 HydrophobicContact CG1-CB 4.4Å; V131-I135 HydrophobicContact CG1-CG2 4.02Å; P132-I135 HydrophobicContact CG-CD1 4.14Å; P132-I135 PolarHBondContact O-N 3.42Å; I135-Y138 PolarHBondContact O-N 3.27Å; I135-Y139 WeakPolarHBondContact O-CB 3.27Å; I135-Y139 PolarHBondContact O-N 2.94Å; I135-V185 HydrophobicContact CG2-CG1 3.5Å; I135-V185 VanDerWaalsContact CG2-CG1 3.5Å; I135-T189 HydrophobicContact CG2-CG2 4.03Å
136W98.2Very high97.1Very high48 Ų4834.9 Ų34.918%0.18218%0.179CC..Hα-helixtrans-56.6-53.1175.4-171.7105.3000110.8D26 V29 V131 P132 D133 Y138 Y139 M140 W180D26-W136 HydrophobicContact CB-CZ2 4.19Å; D26-W136 PolarHBondContact OD2-NE1 3.49Å; V29-W136 HydrophobicContact CB-CH2 4.11Å; V29-W136 HydrophobicContact CB-CZ2 4.39Å; V29-W136 HydrophobicContact CG1-CH2 3.75Å; V29-W136 HydrophobicContact CG1-CZ2 4.49Å; V29-W136 HydrophobicContact CG1-CZ3 4.41Å; V29-W136 HydrophobicContact CG2-CH2 3.77Å; V29-W136 HydrophobicContact CG2-CZ2 3.89Å; V131-W136 HydrophobicContact CG1-CB 4.18Å; P132-W136 PolarHBondContact O-N 3.07Å; D133-W136 WeakPolarHBondContact O-CB 3.48Å; D133-W136 PolarHBondContact O-N 3.22Å; W136-Y138 PolarHBondContact O-N 3.24Å; W136-Y139 PolarHBondContact O-N 3.22Å; W136-M140 HydrophobicContact CD2-CG 3.71Å; W136-M140 HydrophobicContact CE3-CB 4.34Å; W136-M140 HydrophobicContact CE3-CG 3.73Å; W136-M140 HydrophobicContact CH2-CB 4.46Å; W136-M140 HydrophobicContact CH2-CG 3.77Å; W136-M140 HydrophobicContact CZ2-CG 3.73Å; W136-M140 HydrophobicContact CZ2-SD 4.42Å; W136-M140 HydrophobicContact CZ3-CB 4.18Å; W136-M140 HydrophobicContact CZ3-CG 3.75Å; W136-M140 VanDerWaalsContact O-CG 3.28Å; W136-M140 WeakPolarHBondContact O-CG 3.3Å; W136-M140 PolarHBondContact O-N 3.05Å; W136-W180 HydrophobicContact CB-CH2 4.25Å; W136-W180 AromaticContact CD1-CH2 3.25Å; W136-W180 AromaticContact CD1-CZ2 3.41Å; W136-W180 VanDerWaalsContact CD1-CZ2 3.41Å; W136-W180 AromaticContact CG-CH2 3.85Å; W136-W180 HydrophobicContact CG-CH2 3.85Å; W136-W180 HydrophobicContact CG-CZ2 4.35Å; W136-W180 AromaticContact NE1-CH2 3.82Å; W136-W180 AromaticContact NE1-CZ2 3.54Å
137W98.1Very high97.2Very high120 Ų12036.8 Ų36.846%0.45519%0.186SC..Hα-helixtrans-62.5-42.8179.6-84.2114000112.6D133 Y139 M140 I141D133-W137 VanDerWaalsContact O-CD1 3.26Å; D133-W137 PolarHBondContact O-N 2.97Å; W137-Y139 VanDerWaalsContact C-N 3.32Å; W137-Y139 PolarHBondContact O-N 3.33Å; W137-M140 PolarHBondContact O-N 2.9Å; W137-I141 HydrophobicContact CB-CD1 4.47Å; W137-I141 HydrophobicContact CE3-CD1 4.17Å; W137-I141 HydrophobicContact CE3-CG1 4.25Å; W137-I141 VanDerWaalsContact O-CB 3.3Å; W137-I141 WeakPolarHBondContact O-CB 3.27Å; W137-I141 WeakPolarHBondContact O-CD1 3.19Å; W137-I141 VanDerWaalsContact O-CG1 3.22Å; W137-I141 WeakPolarHBondContact O-CG1 3.24Å; W137-I141 PolarHBondContact O-N 3.44Å
138Y98.2Very high97.2Very high1 Ų137 Ų370%0.00419%0.188CC..Hα-helixtrans-55.5-50174.1178.6-129.3000111Y105 T134 I135 W136 M140 E142 T189 L192 L193 D196Y105-Y138 AromaticContact CD1-CD2 3.75Å; Y105-Y138 HydrophobicContact CD1-CD2 3.75Å; Y105-Y138 HydrophobicContact CD1-CG 4.38Å; Y105-Y138 HydrophobicContact CE1-CD2 4.15Å; Y105-Y138 HydrophobicContact CE1-CG 4.39Å; T134-Y138 WeakPolarHBondContact O-CB 3.21Å; T134-Y138 PolarHBondContact O-N 3.33Å; T134-Y138 VanDerWaalsContact O-N 3.12Å; I135-Y138 PolarHBondContact O-N 3.27Å; W136-Y138 PolarHBondContact O-N 3.24Å; Y138-M140 PolarHBondContact O-N 3.41Å; Y138-E142 HydrophobicContact CD2-CG 3.93Å; Y138-E142 HydrophobicContact CE2-CG 3.63Å; Y138-E142 WeakPolarHBondContact CE2-OE1 3.34Å; Y138-E142 WeakPolarHBondContact O-CB 3.49Å; Y138-E142 WeakPolarHBondContact O-CG 3.05Å; Y138-E142 PolarHBondContact O-N 3.32Å; Y138-E142 VanDerWaalsContact O-N 3.09Å; Y138-T189 HydrophobicContact CD1-CG2 4.03Å; Y138-T189 HydrophobicContact CE1-CG2 4.21Å; Y138-L192 HydrophobicContact CE1-CB 4.26Å; Y138-L192 HydrophobicContact CE1-CD1 4.36Å; Y138-L192 WeakPolarHBondContact OH-CB 3.42Å; Y138-L193 PolarHBondContact OH-N 3.39Å; Y138-D196 PolarHBondContact OH-OD2 3.03Å
139Y98.4Very high97.1Very high0 Ų032.3 Ų32.30%017%0.167CC..Hα-helixtrans-64.4-42.6-178.9-146.5-79.8000113.3I135 W136 W137 T143 L176 S179 W180 V185 T189 L192I135-Y139 WeakPolarHBondContact O-CB 3.27Å; I135-Y139 PolarHBondContact O-N 2.94Å; W136-Y139 PolarHBondContact O-N 3.22Å; W137-Y139 VanDerWaalsContact C-N 3.32Å; W137-Y139 PolarHBondContact O-N 3.33Å; Y139-T143 WeakPolarHBondContact O-CB 3.05Å; Y139-T143 PolarHBondContact O-N 3.08Å; Y139-T143 PolarHBondContact O-OG1 2.87Å; Y139-L176 HydrophobicContact CE1-CB 4.25Å; Y139-L176 HydrophobicContact CE1-CD2 3.89Å; Y139-L176 WeakPolarHBondContact CE1-O 3.31Å; Y139-S179 PolarHBondContact OH-OG 3.36Å; Y139-W180 HydrophobicContact CD1-CD2 4.43Å; Y139-W180 AromaticContact CD1-CE3 3.52Å; Y139-W180 HydrophobicContact CD1-CE3 3.52Å; Y139-W180 HydrophobicContact CD1-CZ3 4.06Å; Y139-W180 HydrophobicContact CD2-CE3 4.37Å; Y139-W180 HydrophobicContact CD2-CZ3 4.46Å; Y139-W180 HydrophobicContact CE1-CB 4.21Å; Y139-W180 AromaticContact CE1-CE3 3.98Å; Y139-W180 HydrophobicContact CE1-CE3 3.98Å; Y139-W180 AromaticContact CG-CE3 3.74Å; Y139-W180 HydrophobicContact CG-CE3 3.74Å; Y139-W180 AromaticContact CG-CZ3 3.83Å; Y139-W180 HydrophobicContact CG-CZ3 3.83Å; Y139-V185 HydrophobicContact CD2-CG1 3.83Å; Y139-V185 HydrophobicContact CE2-CG1 4.15Å; Y139-T189 HydrophobicContact CD2-CG2 3.91Å; Y139-T189 HydrophobicContact CE2-CG2 4.35Å; Y139-L192 HydrophobicContact CD2-CD1 4.11Å; Y139-L192 HydrophobicContact CE2-CD1 4.15Å
140M98.2Very high97Very high0 Ų034.3 Ų34.30%018%0.178CC..Hα-helixtrans-70.4-40.5-178.8-66.2-53.9138.100112.5D26 V29 P30 L33 W136 W137 Y138 G144 W180D26-M140 HydrophobicContact CB-CE 4.03Å; D26-M140 HydrophobicContact CB-SD 4.45Å; V29-M140 HydrophobicContact CB-SD 4.39Å; V29-M140 HydrophobicContact CG1-CB 4.23Å; V29-M140 HydrophobicContact CG1-CG 4.38Å; P30-M140 HydrophobicContact CG-SD 4.15Å; L33-M140 HydrophobicContact CD1-CB 4.44Å; W136-M140 HydrophobicContact CD2-CG 3.71Å; W136-M140 HydrophobicContact CE3-CB 4.34Å; W136-M140 HydrophobicContact CE3-CG 3.73Å; W136-M140 HydrophobicContact CH2-CB 4.46Å; W136-M140 HydrophobicContact CH2-CG 3.77Å; W136-M140 HydrophobicContact CZ2-CG 3.73Å; W136-M140 HydrophobicContact CZ2-SD 4.42Å; W136-M140 HydrophobicContact CZ3-CB 4.18Å; W136-M140 HydrophobicContact CZ3-CG 3.75Å; W136-M140 VanDerWaalsContact O-CG 3.28Å; W136-M140 WeakPolarHBondContact O-CG 3.3Å; W136-M140 PolarHBondContact O-N 3.05Å; W137-M140 PolarHBondContact O-N 2.9Å; Y138-M140 PolarHBondContact O-N 3.41Å; M140-G144 PolarHBondContact O-N 3.29Å; M140-W180 HydrophobicContact CE-CD2 3.38Å; M140-W180 HydrophobicContact CE-CE3 3.49Å; M140-W180 VanDerWaalsContact CE-CE3 3.49Å; M140-W180 HydrophobicContact CE-CG 4.17Å; M140-W180 HydrophobicContact CE-CH2 3.35Å; M140-W180 HydrophobicContact CE-CZ2 3.25Å; M140-W180 HydrophobicContact CE-CZ3 3.48Å; M140-W180 VanDerWaalsContact CE-CZ3 3.48Å
141I97.6Very high96.8Very high42 Ų4233.2 Ų33.222%0.21517%0.166CC..Hα-helixtrans-66.1-45.5178.3-70.7167.5000110.5L33 Y98 W137 G144 F145L33-I141 HydrophobicContact CD1-CG1 4.48Å; Y98-I141 PolarHBondContact OH-O 3.4Å; W137-I141 HydrophobicContact CB-CD1 4.47Å; W137-I141 HydrophobicContact CE3-CD1 4.17Å; W137-I141 HydrophobicContact CE3-CG1 4.25Å; W137-I141 VanDerWaalsContact O-CB 3.3Å; W137-I141 WeakPolarHBondContact O-CB 3.27Å; W137-I141 WeakPolarHBondContact O-CD1 3.19Å; W137-I141 VanDerWaalsContact O-CG1 3.22Å; W137-I141 WeakPolarHBondContact O-CG1 3.24Å; W137-I141 PolarHBondContact O-N 3.44Å; I141-G144 PolarHBondContact O-N 3.32Å; I141-F145 PolarHBondContact O-N 2.85Å
142E97.8Very high96.3Very high2 Ų231.8 Ų31.81%0.00916%0.158CC..Hα-helixtrans-59.8-51.2175.9-73.9-67.916600111.2A102 Y138 G144 F145 Y146 L192A102-E142 WeakPolarHBondContact CB-OE1 3.34Å; Y138-E142 HydrophobicContact CD2-CG 3.93Å; Y138-E142 HydrophobicContact CE2-CG 3.63Å; Y138-E142 WeakPolarHBondContact CE2-OE1 3.34Å; Y138-E142 WeakPolarHBondContact O-CB 3.49Å; Y138-E142 WeakPolarHBondContact O-CG 3.05Å; Y138-E142 PolarHBondContact O-N 3.32Å; Y138-E142 VanDerWaalsContact O-N 3.09Å; E142-G144 VanDerWaalsContact C-N 3.31Å; E142-G144 PolarHBondContact O-N 3.11Å; E142-F145 WeakPolarHBondContact O-CB 3.35Å; E142-F145 PolarHBondContact O-N 3.46Å; E142-Y146 VanDerWaalsContact O-CD2 3.28Å; E142-Y146 WeakPolarHBondContact O-CD2 3.43Å; E142-Y146 PolarHBondContact O-N 2.98Å; E142-Y146 VanDerWaalsContact O-N 3.08Å; E142-L192 HydrophobicContact CB-CD1 3.98Å; E142-L192 HydrophobicContact CB-CD2 3.84Å; E142-L192 HydrophobicContact CG-CD1 4.07Å; E142-L192 HydrophobicContact CG-CD2 4.11Å
143T98.1Very high95.9Very high0 Ų029.6 Ų29.60%014%0.144CC..Hα-helixtrans-60.3-42.3178.9-53.60000111.3P30 Y139 F145 Y146 Y147 L176P30-T143 HydrophobicContact CB-CG2 3.74Å; P30-T143 HydrophobicContact CG-CG2 3.88Å; Y139-T143 WeakPolarHBondContact O-CB 3.05Å; Y139-T143 PolarHBondContact O-N 3.08Å; Y139-T143 PolarHBondContact O-OG1 2.87Å; T143-F145 VanDerWaalsContact C-N 3.28Å; T143-F145 PolarHBondContact O-N 3.19Å; T143-Y146 PolarHBondContact O-N 2.93Å; T143-Y147 HydrophobicContact CG2-CD2 4.24Å; T143-Y147 HydrophobicContact CG2-CE2 4.05Å; T143-Y147 WeakPolarHBondContact O-CD2 3.45Å; T143-Y147 PolarHBondContact O-N 3.47Å; T143-Y147 VanDerWaalsContact O-N 3.15Å; T143-L176 HydrophobicContact CG2-CB 4.08Å; T143-L176 HydrophobicContact CG2-CD1 4.32Å
144G97.8Very high95.2Very high0 Ų028.7 Ų28.70%014%0.143CC..Hα-helixtrans-63.3-33.8176.200000112.8P30 L37 M140 I141 E142 Y147 S148P30-G144 VanDerWaalsContact CB-N 3.33Å; P30-G144 WeakPolarHBondContact O-CA 3.48Å; L37-G144 VanDerWaalsContact CD1-C 3.48Å; M140-G144 PolarHBondContact O-N 3.29Å; I141-G144 PolarHBondContact O-N 3.32Å; E142-G144 VanDerWaalsContact C-N 3.31Å; E142-G144 PolarHBondContact O-N 3.11Å; G144-Y147 PolarHBondContact O-N 2.86Å; G144-S148 PolarHBondContact O-N 3.03Å
145F97.3Very high94.5Very high0 Ų028.1 Ų28.10%014%0.136CC..Hα-helixtrans-68.2-40.4174.6-178.6-108.2000112.8L37 W94 Y98 Y99 I141 E142 T143 Y147 S148 L149L37-F145 HydrophobicContact CD1-CB 4.26Å; W94-F145 AromaticContact NE1-CE2 3.86Å; Y98-F145 AromaticContact CD1-CD1 3.61Å; Y98-F145 HydrophobicContact CD1-CD1 3.61Å; Y98-F145 AromaticContact CD1-CD2 3.78Å; Y98-F145 HydrophobicContact CD1-CD2 3.78Å; Y98-F145 AromaticContact CD1-CE1 3.37Å; Y98-F145 HydrophobicContact CD1-CE1 3.37Å; Y98-F145 AromaticContact CD1-CE2 3.55Å; Y98-F145 HydrophobicContact CD1-CE2 3.55Å; Y98-F145 AromaticContact CD1-CG 3.79Å; Y98-F145 HydrophobicContact CD1-CG 3.79Å; Y98-F145 AromaticContact CD1-CZ 3.34Å; Y98-F145 HydrophobicContact CD1-CZ 3.34Å; Y98-F145 AromaticContact CD2-CD2 3.62Å; Y98-F145 HydrophobicContact CD2-CD2 3.62Å; Y98-F145 AromaticContact CD2-CE2 3.67Å; Y98-F145 HydrophobicContact CD2-CE2 3.67Å; Y98-F145 HydrophobicContact CD2-CG 4.23Å; Y98-F145 HydrophobicContact CD2-CZ 4.32Å; Y98-F145 HydrophobicContact CE1-CB 3.8Å; Y98-F145 AromaticContact CE1-CD1 3.18Å; Y98-F145 HydrophobicContact CE1-CD1 3.18Å; Y98-F145 AromaticContact CE1-CD2 3.65Å; Y98-F145 HydrophobicContact CE1-CD2 3.65Å; Y98-F145 AromaticContact CE1-CE1 3.5Å; Y98-F145 HydrophobicContact CE1-CE1 3.5Å; Y98-F145 AromaticContact CE1-CE2 3.93Å; Y98-F145 HydrophobicContact CE1-CE2 3.93Å; Y98-F145 AromaticContact CE1-CG 3.26Å; Y98-F145 HydrophobicContact CE1-CG 3.26Å; Y98-F145 AromaticContact CE1-CZ 3.86Å; Y98-F145 HydrophobicContact CE1-CZ 3.86Å; Y98-F145 HydrophobicContact CE2-CB 3.93Å; Y98-F145 HydrophobicContact CE2-CD1 4.48Å; Y98-F145 AromaticContact CE2-CD2 3.46Å; Y98-F145 HydrophobicContact CE2-CD2 3.46Å; Y98-F145 VanDerWaalsContact CE2-CD2 3.46Å; Y98-F145 HydrophobicContact CE2-CE2 4.01Å; Y98-F145 AromaticContact CE2-CG 3.73Å; Y98-F145 HydrophobicContact CE2-CG 3.73Å; Y98-F145 HydrophobicContact CG-CD1 4.44Å; Y98-F145 AromaticContact CG-CD2 3.79Å; Y98-F145 HydrophobicContact CG-CD2 3.79Å; Y98-F145 HydrophobicContact CG-CE1 4.14Å; Y98-F145 AromaticContact CG-CE2 3.43Å; Y98-F145 HydrophobicContact CG-CE2 3.43Å; Y98-F145 VanDerWaalsContact CG-CE2 3.43Å; Y98-F145 HydrophobicContact CG-CG 4.27Å; Y98-F145 AromaticContact CG-CZ 3.63Å; Y98-F145 HydrophobicContact CG-CZ 3.63Å; Y98-F145 AromaticContact CZ-CD1 3.69Å; Y98-F145 AromaticContact CZ-CD2 3.5Å; Y98-F145 VanDerWaalsContact CZ-CD2 3.5Å; Y98-F145 AromaticContact CZ-CG 3.22Å; Y98-F145 WeakPolarHBondContact OH-CB 3.25Å; Y99-F145 HydrophobicContact CD1-CE1 4.34Å; Y99-F145 HydrophobicContact CE1-CD1 4.42Å; Y99-F145 AromaticContact CE1-CE1 3.58Å; Y99-F145 HydrophobicContact CE1-CE1 3.58Å; Y99-F145 HydrophobicContact CE1-CZ 4.36Å; Y99-F145 AromaticContact CZ-CE1 3.89Å; I141-F145 PolarHBondContact O-N 2.85Å; E142-F145 WeakPolarHBondContact O-CB 3.35Å; E142-F145 PolarHBondContact O-N 3.46Å; T143-F145 VanDerWaalsContact C-N 3.28Å; T143-F145 PolarHBondContact O-N 3.19Å; F145-Y147 VanDerWaalsContact C-N 3.31Å; F145-Y147 PolarHBondContact O-N 3.4Å; F145-S148 WeakPolarHBondContact CA-OG 3.3Å; F145-S148 WeakPolarHBondContact CD2-OG 3.2Å; F145-S148 CarbonylContact O-C 3.57Å; F145-S148 WeakPolarHBondContact O-CA 3.29Å; F145-S148 WeakPolarHBondContact O-CB 3.41Å; F145-S148 PolarHBondContact O-N 3.22Å; F145-S148 PolarHBondContact O-OG 3.46Å; F145-L149 HydrophobicContact CD1-CD1 3.95Å; F145-L149 HydrophobicContact CD1-CG 4.21Å; F145-L149 HydrophobicContact CE1-CD1 3.56Å; F145-L149 HydrophobicContact CE1-CD2 4.19Å; F145-L149 HydrophobicContact CE1-CG 3.9Å; F145-L149 HydrophobicContact CE2-CD2 4.34Å; F145-L149 HydrophobicContact CE2-CG 4.47Å; F145-L149 HydrophobicContact CZ-CD1 4.13Å; F145-L149 HydrophobicContact CZ-CD2 3.88Å; F145-L149 HydrophobicContact CZ-CG 4.05Å; F145-L149 WeakPolarHBondContact O-CG 3.3Å; F145-L149 PolarHBondContact O-N 3.45Å
146Y96.2Very high93.6Very high10 Ų1028.7 Ų28.74%0.03914%0.138CC..Hα-helixtrans-60-40.3172-80.7-82.4000112.4E142 T143 L149 L150 H169 T172 L176 L192E142-Y146 VanDerWaalsContact O-CD2 3.28Å; E142-Y146 WeakPolarHBondContact O-CD2 3.43Å; E142-Y146 PolarHBondContact O-N 2.98Å; E142-Y146 VanDerWaalsContact O-N 3.08Å; T143-Y146 PolarHBondContact O-N 2.93Å; Y146-L149 PolarHBondContact O-N 3.47Å; Y146-L150 PolarHBondContact O-N 2.96Å; Y146-H169 AromaticContact CD1-ND1 3.86Å; Y146-T172 WeakPolarHBondContact CD1-OG1 3.33Å; Y146-T172 HydrophobicContact CE1-CG2 4.32Å; Y146-L176 HydrophobicContact CD2-CD1 3.62Å; Y146-L176 HydrophobicContact CE2-CD1 4.09Å; Y146-L176 HydrophobicContact CG-CD1 4.23Å; Y146-L192 HydrophobicContact CE2-CD2 4.17Å
147Y97Very high92.4Very high53 Ų5327.9 Ų27.921%0.20814%0.139CC..Hα-helixtrans-62.5-41.1170.4-83-74.8000112.2P30 I31 T143 G144 F145 L149 L150 I151 I173P30-Y147 HydrophobicContact CB-CD2 4.29Å; I31-Y147 HydrophobicContact CG1-CE1 4.32Å; I31-Y147 HydrophobicContact CG1-CE2 4.09Å; T143-Y147 HydrophobicContact CG2-CD2 4.24Å; T143-Y147 HydrophobicContact CG2-CE2 4.05Å; T143-Y147 WeakPolarHBondContact O-CD2 3.45Å; T143-Y147 PolarHBondContact O-N 3.47Å; T143-Y147 VanDerWaalsContact O-N 3.15Å; G144-Y147 PolarHBondContact O-N 2.86Å; F145-Y147 VanDerWaalsContact C-N 3.31Å; F145-Y147 PolarHBondContact O-N 3.4Å; Y147-L149 VanDerWaalsContact C-N 3.3Å; Y147-L149 PolarHBondContact O-N 3.15Å; Y147-L150 WeakPolarHBondContact O-CB 3.42Å; Y147-L150 PolarHBondContact O-N 2.97Å; Y147-I151 WeakPolarHBondContact O-CG1 3.32Å; Y147-I151 PolarHBondContact O-N 2.97Å; Y147-I173 HydrophobicContact CD1-CD1 4.09Å; Y147-I173 HydrophobicContact CE1-CD1 4.28Å; Y147-I173 HydrophobicContact CE1-CG2 3.86Å; Y147-I173 HydrophobicContact CE2-CG2 3.83Å; Y147-I173 HydrophobicContact CG-CD1 4.32Å; Y147-I173 VanDerWaalsContact CZ-CG2 3.41Å; Y147-I173 WeakPolarHBondContact OH-CG2 3.39Å
148S95.8Very high91.5Very high6 Ų630.3 Ų30.34%0.04215%0.148CC..Hα-helixtrans-63.4-35.517785.90000112.4G144 F145 G152G144-S148 PolarHBondContact O-N 3.03Å; F145-S148 WeakPolarHBondContact CA-OG 3.3Å; F145-S148 WeakPolarHBondContact CD2-OG 3.2Å; F145-S148 CarbonylContact O-C 3.57Å; F145-S148 WeakPolarHBondContact O-CA 3.29Å; F145-S148 WeakPolarHBondContact O-CB 3.41Å; F145-S148 PolarHBondContact O-N 3.22Å; F145-S148 PolarHBondContact O-OG 3.46Å; S148-G152 PolarHBondContact O-N 3.39Å
149L93.6Very high90.5Very high4 Ų433.7 Ų33.72%0.02116%0.161CC..Hα-helixtrans-68.8-39.7174-70.3178.9000111.4F145 Y146 Y147 G152 S153F145-L149 HydrophobicContact CD1-CD1 3.95Å; F145-L149 HydrophobicContact CD1-CG 4.21Å; F145-L149 HydrophobicContact CE1-CD1 3.56Å; F145-L149 HydrophobicContact CE1-CD2 4.19Å; F145-L149 HydrophobicContact CE1-CG 3.9Å; F145-L149 HydrophobicContact CE2-CD2 4.34Å; F145-L149 HydrophobicContact CE2-CG 4.47Å; F145-L149 HydrophobicContact CZ-CD1 4.13Å; F145-L149 HydrophobicContact CZ-CD2 3.88Å; F145-L149 HydrophobicContact CZ-CG 4.05Å; F145-L149 WeakPolarHBondContact O-CG 3.3Å; F145-L149 PolarHBondContact O-N 3.45Å; Y146-L149 PolarHBondContact O-N 3.47Å; Y147-L149 VanDerWaalsContact C-N 3.3Å; Y147-L149 PolarHBondContact O-N 3.15Å; L149-G152 PolarHBondContact O-N 3.06Å; L149-S153 PolarHBondContact O-N 3.24Å
150L93.2Very high89.7Confident49 Ų4937 Ų3726%0.25718%0.184SC..Hα-helixtrans-61.6-47.1175-175.765.6000111Y146 Y147 G152 S153 M166 H169 I173Y146-L150 PolarHBondContact O-N 2.96Å; Y147-L150 WeakPolarHBondContact O-CB 3.42Å; Y147-L150 PolarHBondContact O-N 2.97Å; L150-G152 VanDerWaalsContact C-N 3.34Å; L150-S153 PolarHBondContact O-N 3.48Å; L150-S153 PolarHBondContact O-OG 3.03Å; L150-M166 HydrophobicContact CD1-CE 4.05Å; L150-M166 HydrophobicContact CD1-SD 3.36Å; L150-M166 WeakPolarHBondContact CD1-SD 3.47Å; L150-H169 HydrophobicContact CD1-CB 4.24Å; L150-I173 HydrophobicContact CB-CD1 4.21Å; L150-I173 HydrophobicContact CD2-CD1 3.83Å
151I91.9Very high89.1Confident69 Ų6937.7 Ų37.735%0.35419%0.188SC..Hα-helixtrans-61.6-45.6173.6-64.3167.7000110A34 V38 Y147 S153 T154 F155A34-I151 HydrophobicContact CB-CD1 3.89Å; V38-I151 HydrophobicContact CG2-CB 4.44Å; V38-I151 HydrophobicContact CG2-CG2 4.23Å; Y147-I151 WeakPolarHBondContact O-CG1 3.32Å; Y147-I151 PolarHBondContact O-N 2.97Å; I151-S153 VanDerWaalsContact C-N 3.25Å; I151-S153 PolarHBondContact O-N 3.03Å; I151-T154 WeakPolarHBondContact O-CB 3.4Å; I151-T154 WeakPolarHBondContact O-CG2 3.3Å; I151-T154 PolarHBondContact O-N 3.47Å; I151-T154 VanDerWaalsContact O-N 3.12Å; I151-T154 PolarHBondContact O-OG1 2.8Å; I151-F155 HydrophobicContact CG2-CE1 4.43Å
152G87.6Confident88.6Confident0 Ų037 Ų370%018%0.183CC..Hα-helixtrans-54.4-38.8177.900000113.8S148 L149 L150 T154 F155 D156S148-G152 PolarHBondContact O-N 3.39Å; L149-G152 PolarHBondContact O-N 3.06Å; L150-G152 VanDerWaalsContact C-N 3.34Å; G152-T154 PolarHBondContact O-N 3.42Å; G152-F155 PolarHBondContact O-N 2.86Å; G152-D156 WeakPolarHBondContact O-CB 3.5Å; G152-D156 VanDerWaalsContact O-CG 3.3Å; G152-D156 PolarHBondContact O-N 2.87Å
153S86.9Confident88.3Confident16 Ų1645.7 Ų45.711%0.11222%0.216CC..THydrogen-bonded Turntrans-60.7-15.8-179.978.40000114.5L149 L150 I151 M166L149-S153 PolarHBondContact O-N 3.24Å; L150-S153 PolarHBondContact O-N 3.48Å; L150-S153 PolarHBondContact O-OG 3.03Å; I151-S153 VanDerWaalsContact C-N 3.25Å; I151-S153 PolarHBondContact O-N 3.03Å; S153-M166 VanDerWaalsContact OG-CE 3.31Å; S153-M166 WeakPolarHBondContact OG-CE 3.23Å
154T83.1Confident88.1Confident111 Ų11148.6 Ų48.668%0.68123%0.23SC*.THydrogen-bonded Turntrans-75.1-23.7176.864.60000113.4I151 G152I151-T154 WeakPolarHBondContact O-CB 3.4Å; I151-T154 WeakPolarHBondContact O-CG2 3.3Å; I151-T154 PolarHBondContact O-N 3.47Å; I151-T154 VanDerWaalsContact O-N 3.12Å; I151-T154 PolarHBondContact O-OG1 2.8Å; G152-T154 PolarHBondContact O-N 3.42Å
155F81.2Confident87.8Confident52 Ų5251.2 Ų51.223%0.22824%0.243CC..THydrogen-bonded Turntrans-124.4-11.1179.456.1-99.6000113.7V38 F80 I151 G152V38-F155 HydrophobicContact CG1-CZ 4.07Å; F80-F155 HydrophobicContact CD2-CD2 4.36Å; F80-F155 HydrophobicContact CD2-CE2 4.49Å; I151-F155 HydrophobicContact CG2-CE1 4.43Å; G152-F155 PolarHBondContact O-N 2.86Å
156D79.4Confident87.6Confident19 Ų1953.1 Ų53.110%0.10225%0.253CS..SBendtrans-66.7152168.3-74.2-3.4000110.5R41 R95 G152 R158R41-D156 IonicContact CZ-OD1 2.69Å; R41-D156 IonicContact NH1-OD1 2.88Å; R41-D156 PolarHBondContact NH1-OD1 2.62Å; R41-D156 IonicContact NH1-OD2 3.02Å; R41-D156 PolarHBondContact NH1-OD2 3.49Å; R41-D156 IonicContact NH2-OD1 2.9Å; R41-D156 PolarHBondContact NH2-OD1 3.1Å; R41-D156 IonicContact NH2-OD2 3.63Å; R95-D156 IonicContact NH2-OD2 3.34Å; R95-D156 PolarHBondContact NH2-OD2 3.12Å; G152-D156 WeakPolarHBondContact O-CB 3.5Å; G152-D156 VanDerWaalsContact O-CG 3.3Å; G152-D156 PolarHBondContact O-N 2.87Å; D156-R158 PolarHBondContact O-N 3.47Å
157V72.6Confident87.6Confident32 Ų3256.1 Ų56.119%0.19427%0.272CS..PPolyproline II helixtrans-64.6123.9178-171.90000110.2V83 R159V83-V157 HydrophobicContact CB-CG2 4.15Å; V83-V157 HydrophobicContact CG1-CG1 4.34Å; V83-V157 HydrophobicContact CG1-CG2 3.81Å; V157-R159 PolarHBondContact O-N 2.9Å
158R79.8Confident87.5Confident171 Ų17154.3 Ų54.365%0.64527%0.265SS*.PPolyproline II helixtrans-65.3131.3175.5-66.8-171.8178.1159.21.2110.1D156 F162D156-R158 PolarHBondContact O-N 3.47Å; R158-F162 HydrophobicContact CB-CD2 4.19Å; R158-F162 HydrophobicContact CB-CG 4.34Å; R158-F162 HydrophobicContact CG-CD2 3.8Å; R158-F162 HydrophobicContact CG-CE2 3.91Å; R158-F162 HydrophobicContact CG-CG 4.16Å; R158-F162 HydrophobicContact CG-CZ 4.37Å
159R77.4Confident87.5Confident71 Ų7154.4 Ų54.427%0.26827%0.265SS..  trans-111.6166.7177.8-57.3-176.3-169.6-1662.7111.4E91 V157 D161 F162 D312E91-R159 IonicContact OE2-NH2 2.98Å; E91-R159 PolarHBondContact OE2-NH2 3.25Å; V157-R159 PolarHBondContact O-N 2.9Å; R159-D161 PolarHBondContact O-N 3.01Å; R159-F162 WeakPolarHBondContact O-CB 3.48Å; R159-F162 PolarHBondContact O-N 3.37Å; R159-D312 WeakPolarHBondContact CA-OD2 3.4Å
160S80.9Confident87.7Confident69 Ų6958.2 Ų58.248%0.48329%0.288SS..THydrogen-bonded Turntrans-53.2-25.317849.70000115.7R308 S311 D312S160-R308 PolarHBondContact OG-O 3.29Å; S160-S311 WeakPolarHBondContact CB-OG 3.43Å; S160-D312 PolarHBondContact N-OD2 3.27Å
161D85.3Confident87.9Confident15 Ų1556.9 Ų56.98%0.0828%0.281CS..THydrogen-bonded Turntrans-102.919.3176.164.6-22.4000114R159 W163 Q164 L165 W287 R308R159-D161 PolarHBondContact O-N 3.01Å; D161-W163 PolarHBondContact O-N 2.85Å; D161-Q164 VanDerWaalsContact C-OE1 3.31Å; D161-Q164 VanDerWaalsContact CA-OE1 3.31Å; D161-Q164 PolarHBondContact O-N 2.81Å; D161-Q164 PolarHBondContact O-OE1 3.43Å; D161-L165 WeakPolarHBondContact O-CB 3.4Å; D161-L165 PolarHBondContact O-N 3.06Å; D161-W287 PolarHBondContact OD2-NE1 3.08Å; D161-R308 WeakPolarHBondContact OD2-CD 3.44Å; D161-R308 IonicContact OD2-CZ 3.81Å; D161-R308 IonicContact OD2-NE 2.64Å; D161-R308 IonicContact OD2-NH1 3.16Å; D161-R308 PolarHBondContact OD2-NH1 3Å
162F88.3Confident88.2Confident29 Ų2954 Ų5413%0.12727%0.267CS..Hα-helixtrans-53.7-47.7-176.1175.3-96.7000113.1R158 R159 L165 M166R158-F162 HydrophobicContact CB-CD2 4.19Å; R158-F162 HydrophobicContact CB-CG 4.34Å; R158-F162 HydrophobicContact CG-CD2 3.8Å; R158-F162 HydrophobicContact CG-CE2 3.91Å; R158-F162 HydrophobicContact CG-CG 4.16Å; R158-F162 HydrophobicContact CG-CZ 4.37Å; R159-F162 WeakPolarHBondContact O-CB 3.48Å; R159-F162 PolarHBondContact O-N 3.37Å; F162-L165 PolarHBondContact O-N 2.9Å; F162-M166 HydrophobicContact CE1-CE 4.46Å; F162-M166 HydrophobicContact CE2-CE 4.48Å; F162-M166 HydrophobicContact CZ-CE 3.89Å; F162-M166 WeakPolarHBondContact O-CB 3.09Å; F162-M166 PolarHBondContact O-N 2.9Å
163W90.3Very high88.7Confident183 Ų18354.7 Ų54.769%0.69327%0.27SS*.Hα-helixtrans-69.6-36.2-177.5-73.9112.9000112.5D161 L165 M166 V167D161-W163 PolarHBondContact O-N 2.85Å; W163-L165 VanDerWaalsContact C-N 3.34Å; W163-M166 PolarHBondContact O-N 3.41Å; W163-V167 VanDerWaalsContact O-CG2 3.31Å; W163-V167 WeakPolarHBondContact O-CG2 3.38Å; W163-V167 PolarHBondContact O-N 3.14Å
164Q94.1Very high89.2Confident62 Ų6258 Ų5829%0.2928%0.283SS..Hα-helixtrans-66.3-39.9175.2-64.483.3-9.200110.8D161 H168 L283 F286 W287D161-Q164 VanDerWaalsContact C-OE1 3.31Å; D161-Q164 VanDerWaalsContact CA-OE1 3.31Å; D161-Q164 PolarHBondContact O-N 2.81Å; D161-Q164 PolarHBondContact O-OE1 3.43Å; Q164-H168 WeakPolarHBondContact O-CB 3.44Å; Q164-H168 PolarHBondContact O-N 2.99Å; Q164-L283 HydrophobicContact CB-CD2 4.32Å; Q164-F286 HydrophobicContact CB-CD1 4.47Å; Q164-F286 HydrophobicContact CB-CE1 4.01Å; Q164-F286 HydrophobicContact CG-CD1 4.25Å; Q164-F286 HydrophobicContact CG-CE1 3.69Å; Q164-F286 HydrophobicContact CG-CZ 3.85Å; Q164-W287 HydrophobicContact CB-CZ2 4.4Å
165L91.8Very high89.9Confident54 Ų5453.4 Ų53.428%0.28325%0.254SS..Hα-helixtrans-68.1-36.8174.5-17067.1000112.1D161 F162 W163 H168 H169 W287D161-L165 WeakPolarHBondContact O-CB 3.4Å; D161-L165 PolarHBondContact O-N 3.06Å; F162-L165 PolarHBondContact O-N 2.9Å; W163-L165 VanDerWaalsContact C-N 3.34Å; L165-H168 WeakPolarHBondContact O-CB 3.34Å; L165-H168 PolarHBondContact O-N 3.05Å; L165-H169 PolarHBondContact O-CD2 3.43Å; L165-H169 PolarHBondContact O-N 2.72Å; L165-W287 HydrophobicContact CD1-CZ2 4.42Å
166M93.2Very high90.7Very high41 Ų4151.5 Ų51.520%0.20225%0.246CC..Hα-helixtrans-63.6-49.8173.9-179.360.367.200111.6L150 S153 F162 W163 H168 H169 V170L150-M166 HydrophobicContact CD1-CE 4.05Å; L150-M166 HydrophobicContact CD1-SD 3.36Å; L150-M166 WeakPolarHBondContact CD1-SD 3.47Å; S153-M166 VanDerWaalsContact OG-CE 3.31Å; S153-M166 WeakPolarHBondContact OG-CE 3.23Å; F162-M166 HydrophobicContact CE1-CE 4.46Å; F162-M166 HydrophobicContact CE2-CE 4.48Å; F162-M166 HydrophobicContact CZ-CE 3.89Å; F162-M166 WeakPolarHBondContact O-CB 3.09Å; F162-M166 PolarHBondContact O-N 2.9Å; W163-M166 PolarHBondContact O-N 3.41Å; M166-H168 VanDerWaalsContact C-N 3.25Å; M166-H168 PolarHBondContact O-N 3.15Å; M166-H169 PolarHBondContact O-N 3.13Å; M166-H169 VanDerWaalsContact O-N 3.16Å; M166-V170 WeakPolarHBondContact O-CG2 3.42Å; M166-V170 PolarHBondContact O-N 3.47Å
167V95.6Very high91.6Very high72 Ų7251.6 Ų51.644%0.43625%0.248SC..Hα-helixtrans-58.7-41175.9170.10000110.6W163 V170 I171 L283W163-V167 VanDerWaalsContact O-CG2 3.31Å; W163-V167 WeakPolarHBondContact O-CG2 3.38Å; W163-V167 PolarHBondContact O-N 3.14Å; V167-V170 PolarHBondContact O-N 3.35Å; V167-I171 HydrophobicContact CG1-CD1 3.66Å; V167-I171 HydrophobicContact CG1-CG1 4.38Å; V167-I171 WeakPolarHBondContact O-CB 3.45Å; V167-I171 VanDerWaalsContact O-CG1 3.29Å; V167-I171 WeakPolarHBondContact O-CG1 3.5Å; V167-I171 PolarHBondContact O-N 2.82Å; V167-L283 HydrophobicContact CG1-CD1 4.33Å
168H96.4Very high92.7Very high15 Ų1550.4 Ų50.47%0.06924%0.242CC..Hα-helixtrans-57.7-50.8173.1170.881.8000112.8Q164 L165 M166 V170 I171 T172 L280 L283 W287Q164-H168 WeakPolarHBondContact O-CB 3.44Å; Q164-H168 PolarHBondContact O-N 2.99Å; L165-H168 WeakPolarHBondContact O-CB 3.34Å; L165-H168 PolarHBondContact O-N 3.05Å; M166-H168 VanDerWaalsContact C-N 3.25Å; M166-H168 PolarHBondContact O-N 3.15Å; H168-V170 VanDerWaalsContact C-N 3.3Å; H168-V170 PolarHBondContact O-N 2.95Å; H168-I171 PolarHBondContact O-N 3.49Å; H168-I171 VanDerWaalsContact O-N 3.16Å; H168-T172 VanDerWaalsContact CE1-CG2 3.4Å; H168-T172 WeakPolarHBondContact CE1-CG2 3.39Å; H168-T172 WeakPolarHBondContact O-CG2 3.49Å; H168-T172 PolarHBondContact O-N 3.47Å; H168-T172 PolarHBondContact O-OG1 3.44Å; H168-T172 VanDerWaalsContact O-OG1 3.13Å; H168-L280 WeakPolarHBondContact ND1-CD1 3.1Å; H168-L283 HydrophobicContact CB-CD1 3.99Å; H168-W287 HydrophobicContact CB-CH2 3.59Å; H168-W287 HydrophobicContact CB-CZ2 4.37Å; H168-W287 AromaticContact CG-CH2 3.65Å; H168-W287 AromaticContact ND1-CH2 3.72Å; H168-W287 AromaticContact ND1-CZ3 3.89Å
169H95.8Very high93.6Very high8 Ų842.7 Ų42.74%0.03721%0.213CC..Hα-helixtrans-59.9-40.3178.9-72.4-48.8000112.3Y146 L150 L165 M166 T172 I173Y146-H169 AromaticContact CD1-ND1 3.86Å; L150-H169 HydrophobicContact CD1-CB 4.24Å; L165-H169 PolarHBondContact O-CD2 3.43Å; L165-H169 PolarHBondContact O-N 2.72Å; M166-H169 PolarHBondContact O-N 3.13Å; M166-H169 VanDerWaalsContact O-N 3.16Å; H169-T172 WeakPolarHBondContact CA-OG1 3.29Å; H169-T172 PolarHBondContact O-N 3.32Å; H169-T172 PolarHBondContact O-OG1 3.07Å; H169-I173 VanDerWaalsContact O-CB 3.29Å; H169-I173 WeakPolarHBondContact O-CB 3.28Å; H169-I173 WeakPolarHBondContact O-CD1 3.31Å; H169-I173 WeakPolarHBondContact O-CG1 3.42Å; H169-I173 PolarHBondContact O-N 3.13Å
170V96.5Very high94.6Very high85 Ų8539.3 Ų39.352%0.51520%0.201SC..Hα-helixtrans-63-45.7175.41740000111M166 V167 H168 F174M166-V170 WeakPolarHBondContact O-CG2 3.42Å; M166-V170 PolarHBondContact O-N 3.47Å; V167-V170 PolarHBondContact O-N 3.35Å; H168-V170 VanDerWaalsContact C-N 3.3Å; H168-V170 PolarHBondContact O-N 2.95Å; V170-F174 VanDerWaalsContact O-CB 3.28Å; V170-F174 WeakPolarHBondContact O-CB 3.46Å; V170-F174 PolarHBondContact O-N 3.33Å
171I98Very high95.3Very high21 Ų2136.2 Ų36.211%0.10818%0.179CC..Hα-helixtrans-65-44178.2-69.8169000111.2V167 H168 F174 L175 A276 L279 L280 L283V167-I171 HydrophobicContact CG1-CD1 3.66Å; V167-I171 HydrophobicContact CG1-CG1 4.38Å; V167-I171 WeakPolarHBondContact O-CB 3.45Å; V167-I171 VanDerWaalsContact O-CG1 3.29Å; V167-I171 WeakPolarHBondContact O-CG1 3.5Å; V167-I171 PolarHBondContact O-N 2.82Å; H168-I171 PolarHBondContact O-N 3.49Å; H168-I171 VanDerWaalsContact O-N 3.16Å; I171-F174 PolarHBondContact O-N 3.27Å; I171-L175 HydrophobicContact CG2-CD1 3.82Å; I171-L175 HydrophobicContact CG2-CG 4.35Å; I171-L175 WeakPolarHBondContact O-CB 3.44Å; I171-L175 VanDerWaalsContact O-CG 3.3Å; I171-L175 WeakPolarHBondContact O-CG 3.33Å; I171-L175 PolarHBondContact O-N 2.86Å; I171-A276 HydrophobicContact CG2-CB 4.34Å; I171-L279 HydrophobicContact CD1-CB 3.97Å; I171-L279 HydrophobicContact CD1-CD1 4.38Å; I171-L280 HydrophobicContact CG2-CB 4.1Å; I171-L283 HydrophobicContact CD1-CD1 4.05Å
172T97.7Very high95.8Very high8 Ų835.5 Ų35.55%0.04918%0.175CC..Hα-helixtrans-69.7-40.9-178.755.70000112Y146 H168 H169 F174 L175 L176 L280Y146-T172 WeakPolarHBondContact CD1-OG1 3.33Å; Y146-T172 HydrophobicContact CE1-CG2 4.32Å; H168-T172 VanDerWaalsContact CE1-CG2 3.4Å; H168-T172 WeakPolarHBondContact CE1-CG2 3.39Å; H168-T172 WeakPolarHBondContact O-CG2 3.49Å; H168-T172 PolarHBondContact O-N 3.47Å; H168-T172 PolarHBondContact O-OG1 3.44Å; H168-T172 VanDerWaalsContact O-OG1 3.13Å; H169-T172 WeakPolarHBondContact CA-OG1 3.29Å; H169-T172 PolarHBondContact O-N 3.32Å; H169-T172 PolarHBondContact O-OG1 3.07Å; T172-F174 VanDerWaalsContact C-N 3.33Å; T172-F174 PolarHBondContact O-N 3.1Å; T172-L175 PolarHBondContact O-N 2.99Å; T172-L176 WeakPolarHBondContact O-CB 3.25Å; T172-L176 VanDerWaalsContact O-CG 3.29Å; T172-L176 WeakPolarHBondContact O-CG 3.43Å; T172-L176 PolarHBondContact O-N 3.08Å; T172-L280 HydrophobicContact CG2-CD1 4.06Å; T172-L280 HydrophobicContact CG2-CD2 4.11Å
173I97.9Very high96.2Very high14 Ų1434.2 Ų34.27%0.07217%0.17CC..Hα-helixtrans-62.1-43.8173.5-70.6167000110.2Y147 L150 H169 L176 S177Y147-I173 HydrophobicContact CD1-CD1 4.09Å; Y147-I173 HydrophobicContact CE1-CD1 4.28Å; Y147-I173 HydrophobicContact CE1-CG2 3.86Å; Y147-I173 HydrophobicContact CE2-CG2 3.83Å; Y147-I173 HydrophobicContact CG-CD1 4.32Å; Y147-I173 VanDerWaalsContact CZ-CG2 3.41Å; Y147-I173 WeakPolarHBondContact OH-CG2 3.39Å; L150-I173 HydrophobicContact CB-CD1 4.21Å; L150-I173 HydrophobicContact CD2-CD1 3.83Å; H169-I173 VanDerWaalsContact O-CB 3.29Å; H169-I173 WeakPolarHBondContact O-CB 3.28Å; H169-I173 WeakPolarHBondContact O-CD1 3.31Å; H169-I173 WeakPolarHBondContact O-CG1 3.42Å; H169-I173 PolarHBondContact O-N 3.13Å; I173-L176 PolarHBondContact O-N 3.41Å; I173-S177 VanDerWaalsContact O-CB 3.24Å; I173-S177 WeakPolarHBondContact O-CB 3.5Å; I173-S177 PolarHBondContact O-N 2.85Å; I173-S177 PolarHBondContact O-OG 3.08Å
174F97.8Very high96.6Very high85 Ų8525.8 Ų25.837%0.37314%0.138SC..Hα-helixtrans-58.4-48.6173.9171.3-98.4000111.8V170 I171 T172 S177 S178 L272 A276V170-F174 VanDerWaalsContact O-CB 3.28Å; V170-F174 WeakPolarHBondContact O-CB 3.46Å; V170-F174 PolarHBondContact O-N 3.33Å; I171-F174 PolarHBondContact O-N 3.27Å; T172-F174 VanDerWaalsContact C-N 3.33Å; T172-F174 PolarHBondContact O-N 3.1Å; F174-S177 PolarHBondContact O-N 3.38Å; F174-S178 VanDerWaalsContact O-CB 3.27Å; F174-S178 WeakPolarHBondContact O-CB 3.33Å; F174-S178 PolarHBondContact O-N 3Å; F174-S178 PolarHBondContact O-OG 3.32Å; F174-L272 HydrophobicContact CZ-CB 4.16Å; F174-A276 HydrophobicContact CD1-CB 3.83Å; F174-A276 HydrophobicContact CE1-CB 3.82Å
175L98.3Very high96.8Very high15 Ų1523.1 Ų23.18%0.07913%0.126CC..Hα-helixtrans-59-50.5178.2-79.1168000111.4I171 T172 S177 S178 S179 I273 A276 L277 L280I171-L175 HydrophobicContact CG2-CD1 3.82Å; I171-L175 HydrophobicContact CG2-CG 4.35Å; I171-L175 WeakPolarHBondContact O-CB 3.44Å; I171-L175 VanDerWaalsContact O-CG 3.3Å; I171-L175 WeakPolarHBondContact O-CG 3.33Å; I171-L175 PolarHBondContact O-N 2.86Å; T172-L175 PolarHBondContact O-N 2.99Å; L175-S177 VanDerWaalsContact C-N 3.35Å; L175-S177 PolarHBondContact O-N 2.95Å; L175-S178 PolarHBondContact O-OG 3.35Å; L175-S179 WeakPolarHBondContact O-CB 3.15Å; L175-S179 PolarHBondContact O-N 3.09Å; L175-S179 PolarHBondContact O-OG 2.65Å; L175-I273 HydrophobicContact CD2-CG2 3.94Å; L175-A276 HydrophobicContact CD1-CB 4.42Å; L175-A276 HydrophobicContact CD2-CB 3.63Å; L175-A276 HydrophobicContact CG-CB 3.9Å; L175-L277 HydrophobicContact CD1-CD2 4.01Å; L175-L277 HydrophobicContact CD2-CD2 3.82Å; L175-L277 HydrophobicContact CD2-CG 3.87Å; L175-L280 HydrophobicContact CD1-CB 4.38Å; L175-L280 HydrophobicContact CD1-CD2 3.79Å
176L98.3Very high97.1Very high13 Ų1322.2 Ų22.27%0.06812%0.119CC..Hα-helixtrans-61.7-41.7-179.8-70.5170.6000112.2Y139 T143 Y146 T172 I173 S179 W180 L192Y139-L176 HydrophobicContact CE1-CB 4.25Å; Y139-L176 HydrophobicContact CE1-CD2 3.89Å; Y139-L176 WeakPolarHBondContact CE1-O 3.31Å; T143-L176 HydrophobicContact CG2-CB 4.08Å; T143-L176 HydrophobicContact CG2-CD1 4.32Å; Y146-L176 HydrophobicContact CD2-CD1 3.62Å; Y146-L176 HydrophobicContact CE2-CD1 4.09Å; Y146-L176 HydrophobicContact CG-CD1 4.23Å; T172-L176 WeakPolarHBondContact O-CB 3.25Å; T172-L176 VanDerWaalsContact O-CG 3.29Å; T172-L176 WeakPolarHBondContact O-CG 3.43Å; T172-L176 PolarHBondContact O-N 3.08Å; I173-L176 PolarHBondContact O-N 3.41Å; L176-S179 PolarHBondContact O-OG 3.15Å; L176-W180 WeakPolarHBondContact O-CB 3.4Å; L176-W180 PolarHBondContact O-N 2.96Å; L176-W180 VanDerWaalsContact O-N 3.08Å; L176-L192 HydrophobicContact CD1-CD2 4.5Å; L176-L192 HydrophobicContact CD2-CD1 4.06Å; L176-L192 HydrophobicContact CD2-CD2 3.89Å; L176-L192 HydrophobicContact CD2-CG 4.09Å
177S97.6Very high97.3Very high21 Ų2120.7 Ų20.715%0.14711%0.112CC..Hα-helixtrans-71.5-46.9-178.5-56.30000111.8L27 I173 F174 L175 W180 T181L27-S177 WeakPolarHBondContact CD1-O 3.17Å; I173-S177 VanDerWaalsContact O-CB 3.24Å; I173-S177 WeakPolarHBondContact O-CB 3.5Å; I173-S177 PolarHBondContact O-N 2.85Å; I173-S177 PolarHBondContact O-OG 3.08Å; F174-S177 PolarHBondContact O-N 3.38Å; L175-S177 VanDerWaalsContact C-N 3.35Å; L175-S177 PolarHBondContact O-N 2.95Å; S177-W180 PolarHBondContact O-N 2.94Å; S177-T181 WeakPolarHBondContact O-CB 3.25Å; S177-T181 PolarHBondContact O-N 3.47Å; S177-T181 PolarHBondContact O-OG1 3.44Å
178S96.5Very high97.4Very high7 Ų717.5 Ų17.55%0.0499%0.093CC..Hα-helixtrans-69.8-39.8-179.657.70000111.9F174 L175 T181 I182 I273F174-S178 VanDerWaalsContact O-CB 3.27Å; F174-S178 WeakPolarHBondContact O-CB 3.33Å; F174-S178 PolarHBondContact O-N 3Å; F174-S178 PolarHBondContact O-OG 3.32Å; L175-S178 PolarHBondContact O-OG 3.35Å; S178-T181 WeakPolarHBondContact O-CB 3.43Å; S178-T181 PolarHBondContact O-N 2.9Å; S178-I182 PolarHBondContact O-N 2.93Å; S178-I273 WeakPolarHBondContact OG-CG1 3.47Å
179S97.6Very high97.5Very high8 Ų816.8 Ų16.86%0.0569%0.09CC..Hα-helixtrans-68.1-35.517666.30000112.1Y139 L175 L176 N183 F184Y139-S179 PolarHBondContact OH-OG 3.36Å; L175-S179 WeakPolarHBondContact O-CB 3.15Å; L175-S179 PolarHBondContact O-N 3.09Å; L175-S179 PolarHBondContact O-OG 2.65Å; L176-S179 PolarHBondContact O-OG 3.15Å; S179-N183 CarbonylContact O-C 3.56Å; S179-N183 PolarHBondContact O-N 3.03Å; S179-N183 VanDerWaalsContact O-N 3.16Å; S179-F184 WeakPolarHBondContact O-CA 3.44Å; S179-F184 PolarHBondContact O-N 2.96Å
180W98.2Very high97.6Very high0 Ų016.5 Ų16.50%09%0.089CC..Hα-helixtrans-61.8-49.4170.2-176.1-94.1000111.2A22 K23 D26 L27 V131 W136 Y139 M140 L176 S177 I182 N183 V185A22-W180 HydrophobicContact CB-CD2 4.18Å; A22-W180 HydrophobicContact CB-CG 4.46Å; A22-W180 HydrophobicContact CB-CZ2 4.16Å; A22-W180 WeakPolarHBondContact CB-O 3.36Å; K23-W180 PolarHBondContact O-NE1 3.44Å; D26-W180 HydrophobicContact CB-CZ2 4.06Å; D26-W180 WeakPolarHBondContact OD2-CZ2 3Å; L27-W180 HydrophobicContact CD2-CB 3.91Å; L27-W180 HydrophobicContact CD2-CG 3.94Å; L27-W180 HydrophobicContact CG-CG 4.37Å; V131-W180 HydrophobicContact CG1-CH2 3.8Å; V131-W180 HydrophobicContact CG1-CZ3 4.17Å; W136-W180 HydrophobicContact CB-CH2 4.25Å; W136-W180 AromaticContact CD1-CH2 3.25Å; W136-W180 AromaticContact CD1-CZ2 3.41Å; W136-W180 VanDerWaalsContact CD1-CZ2 3.41Å; W136-W180 AromaticContact CG-CH2 3.85Å; W136-W180 HydrophobicContact CG-CH2 3.85Å; W136-W180 HydrophobicContact CG-CZ2 4.35Å; W136-W180 AromaticContact NE1-CH2 3.82Å; W136-W180 AromaticContact NE1-CZ2 3.54Å; Y139-W180 HydrophobicContact CD1-CD2 4.43Å; Y139-W180 AromaticContact CD1-CE3 3.52Å; Y139-W180 HydrophobicContact CD1-CE3 3.52Å; Y139-W180 HydrophobicContact CD1-CZ3 4.06Å; Y139-W180 HydrophobicContact CD2-CE3 4.37Å; Y139-W180 HydrophobicContact CD2-CZ3 4.46Å; Y139-W180 HydrophobicContact CE1-CB 4.21Å; Y139-W180 AromaticContact CE1-CE3 3.98Å; Y139-W180 HydrophobicContact CE1-CE3 3.98Å; Y139-W180 AromaticContact CG-CE3 3.74Å; Y139-W180 HydrophobicContact CG-CE3 3.74Å; Y139-W180 AromaticContact CG-CZ3 3.83Å; Y139-W180 HydrophobicContact CG-CZ3 3.83Å; M140-W180 HydrophobicContact CE-CD2 3.38Å; M140-W180 HydrophobicContact CE-CE3 3.49Å; M140-W180 VanDerWaalsContact CE-CE3 3.49Å; M140-W180 HydrophobicContact CE-CG 4.17Å; M140-W180 HydrophobicContact CE-CH2 3.35Å; M140-W180 HydrophobicContact CE-CZ2 3.25Å; M140-W180 HydrophobicContact CE-CZ3 3.48Å; M140-W180 VanDerWaalsContact CE-CZ3 3.48Å; L176-W180 WeakPolarHBondContact O-CB 3.4Å; L176-W180 PolarHBondContact O-N 2.96Å; L176-W180 VanDerWaalsContact O-N 3.08Å; S177-W180 PolarHBondContact O-N 2.94Å; W180-I182 PolarHBondContact O-N 3.34Å; W180-N183 PolarHBondContact O-N 3.37Å; W180-V185 HydrophobicContact CD2-CG2 4.32Å; W180-V185 HydrophobicContact CE3-CG2 3.58Å; W180-V185 HydrophobicContact CZ3-CG1 4.14Å; W180-V185 HydrophobicContact CZ3-CG2 3.77Å
181T96.6Very high97.7Very high5 Ų513.8 Ų13.83%0.0317%0.071CC..Hα-helixtrans-54.3-40.3-176.1-60.30000112.4W5 W10 W17 F24 S177 S178W5-T181 HydrophobicContact CH2-CG2 4.38Å; W5-T181 HydrophobicContact CZ3-CG2 3.9Å; W10-T181 HydrophobicContact CE3-CG2 3.99Å; W10-T181 HydrophobicContact CZ3-CG2 4.17Å; W17-T181 HydrophobicContact CH2-CG2 3.85Å; W17-T181 HydrophobicContact CZ3-CG2 3.9Å; F24-T181 HydrophobicContact CD2-CG2 4.16Å; S177-T181 WeakPolarHBondContact O-CB 3.25Å; S177-T181 PolarHBondContact O-N 3.47Å; S177-T181 PolarHBondContact O-OG1 3.44Å; S178-T181 WeakPolarHBondContact O-CB 3.43Å; S178-T181 PolarHBondContact O-N 2.9Å
182I95.6Very high97.7Very high0 Ų013 Ų130%07%0.067CC..THydrogen-bonded Turntrans-99.79.8-179.772.3173.3000113.6W10 Y126 S178 W180 F184 A269 P270 I273W10-I182 HydrophobicContact CB-CG2 4.15Å; W10-I182 HydrophobicContact CE3-CG2 3.7Å; Y126-I182 WeakPolarHBondContact CE2-O 3.13Å; Y126-I182 VanDerWaalsContact CZ-O 3.24Å; Y126-I182 WeakPolarHBondContact OH-CB 3.33Å; Y126-I182 PolarHBondContact OH-O 3.38Å; S178-I182 PolarHBondContact O-N 2.93Å; W180-I182 PolarHBondContact O-N 3.34Å; I182-F184 HydrophobicContact CD1-CD1 4.17Å; I182-F184 HydrophobicContact CD1-CD2 3.7Å; I182-F184 HydrophobicContact CD1-CE1 4.05Å; I182-F184 HydrophobicContact CD1-CE2 3.57Å; I182-F184 HydrophobicContact CD1-CG 3.99Å; I182-F184 HydrophobicContact CD1-CZ 3.72Å; I182-F184 HydrophobicContact CG1-CB 4.39Å; I182-F184 HydrophobicContact CG1-CD1 4.14Å; I182-F184 HydrophobicContact CG1-CD2 4.12Å; I182-F184 HydrophobicContact CG1-CE1 4.45Å; I182-F184 HydrophobicContact CG1-CE2 4.43Å; I182-F184 HydrophobicContact CG1-CG 3.95Å; I182-A269 HydrophobicContact CD1-CB 4.36Å; I182-A269 HydrophobicContact CG2-CB 4.09Å; I182-P270 HydrophobicContact CD1-CG 4.23Å; I182-I273 HydrophobicContact CD1-CD1 3.4Å; I182-I273 VanDerWaalsContact CD1-CD1 3.4Å; I182-I273 HydrophobicContact CG1-CD1 4.03Å
183N97.4Very high97.7Very high1 Ų113.3 Ų13.31%0.0057%0.068CC..THydrogen-bonded Turntrans6335.3-178.4-158.526.5000116.5V20 A22 P127 H129 V131 S179 W180 V185V20-N183 HydrophobicContact CG1-CB 3.74Å; A22-N183 HydrophobicContact CB-CB 4.06Å; P127-N183 PolarHBondContact O-ND2 3.3Å; H129-N183 PolarHBondContact N-ND2 3.39Å; H129-N183 PolarHBondContact O-ND2 3.03Å; V131-N183 WeakPolarHBondContact CG2-OD1 3.1Å; S179-N183 CarbonylContact O-C 3.56Å; S179-N183 PolarHBondContact O-N 3.03Å; S179-N183 VanDerWaalsContact O-N 3.16Å; W180-N183 PolarHBondContact O-N 3.37Å; N183-V185 PolarHBondContact O-N 3.19Å; N183-V185 WeakPolarHBondContact OD1-CG2 3.37Å
184F97.4Very high97.7Very high7 Ų713.2 Ų13.23%0.0317%0.069CC..  trans-78.830.2163.9-79.21.1000112.7W123 Y126 S179 I182 R186 V187 G188 I253 P270 I273W123-F184 HydrophobicContact CE3-CE1 4.24Å; W123-F184 AromaticContact CZ3-CD1 3.98Å; W123-F184 HydrophobicContact CZ3-CD1 3.98Å; W123-F184 HydrophobicContact CZ3-CD2 4.24Å; W123-F184 AromaticContact CZ3-CE1 3.82Å; W123-F184 HydrophobicContact CZ3-CE1 3.82Å; W123-F184 HydrophobicContact CZ3-CE2 4.09Å; W123-F184 HydrophobicContact CZ3-CG 4.22Å; W123-F184 AromaticContact CZ3-CZ 3.91Å; W123-F184 HydrophobicContact CZ3-CZ 3.91Å; Y126-F184 HydrophobicContact CD1-CE1 4.35Å; Y126-F184 AromaticContact CD2-CD1 3.71Å; Y126-F184 HydrophobicContact CD2-CD1 3.71Å; Y126-F184 AromaticContact CD2-CE1 3.7Å; Y126-F184 HydrophobicContact CD2-CE1 3.7Å; Y126-F184 AromaticContact CE1-CE1 3.87Å; Y126-F184 HydrophobicContact CE1-CE1 3.87Å; Y126-F184 AromaticContact CE2-CD1 3.19Å; Y126-F184 HydrophobicContact CE2-CD1 3.19Å; Y126-F184 AromaticContact CE2-CE1 3.19Å; Y126-F184 HydrophobicContact CE2-CE1 3.19Å; Y126-F184 HydrophobicContact CE2-CG 4.46Å; Y126-F184 HydrophobicContact CE2-CZ 4.46Å; Y126-F184 HydrophobicContact CG-CE1 4.26Å; Y126-F184 AromaticContact CZ-CD1 3.75Å; Y126-F184 AromaticContact CZ-CE1 3.28Å; S179-F184 WeakPolarHBondContact O-CA 3.44Å; S179-F184 PolarHBondContact O-N 2.96Å; I182-F184 HydrophobicContact CD1-CD1 4.17Å; I182-F184 HydrophobicContact CD1-CD2 3.7Å; I182-F184 HydrophobicContact CD1-CE1 4.05Å; I182-F184 HydrophobicContact CD1-CE2 3.57Å; I182-F184 HydrophobicContact CD1-CG 3.99Å; I182-F184 HydrophobicContact CD1-CZ 3.72Å; I182-F184 HydrophobicContact CG1-CB 4.39Å; I182-F184 HydrophobicContact CG1-CD1 4.14Å; I182-F184 HydrophobicContact CG1-CD2 4.12Å; I182-F184 HydrophobicContact CG1-CE1 4.45Å; I182-F184 HydrophobicContact CG1-CE2 4.43Å; I182-F184 HydrophobicContact CG1-CG 3.95Å; F184-R186 VanDerWaalsContact C-N 3.3Å; F184-R186 PolarHBondContact O-N 3.34Å; F184-V187 HydrophobicContact CB-CG1 3.82Å; F184-V187 HydrophobicContact CG-CG1 4.3Å; F184-V187 WeakPolarHBondContact O-CG1 3.38Å; F184-V187 PolarHBondContact O-N 3.43Å; F184-G188 PolarHBondContact O-N 3.33Å; F184-I253 HydrophobicContact CE1-CD1 4.18Å; F184-I253 HydrophobicContact CZ-CD1 3.74Å; F184-P270 HydrophobicContact CE2-CB 4.26Å; F184-P270 HydrophobicContact CZ-CB 4.14Å; F184-P270 HydrophobicContact CZ-CG 4.16Å; F184-I273 HydrophobicContact CD2-CD1 3.86Å; F184-I273 HydrophobicContact CD2-CG2 4.35Å; F184-I273 HydrophobicContact CE2-CD1 4.11Å
185V98Very high97.6Very high5 Ų59.4 Ų9.43%0.035%0.052CC..Hα-helixtrans-60.9-38.3-175.1-1800000111.7A22 V131 I135 Y139 W180 N183 V187 G188 T189A22-V185 HydrophobicContact CB-CG2 4.4Å; V131-V185 HydrophobicContact CG1-CG1 4.38Å; V131-V185 HydrophobicContact CG2-CG2 4.2Å; I135-V185 HydrophobicContact CG2-CG1 3.5Å; I135-V185 VanDerWaalsContact CG2-CG1 3.5Å; Y139-V185 HydrophobicContact CD2-CG1 3.83Å; Y139-V185 HydrophobicContact CE2-CG1 4.15Å; W180-V185 HydrophobicContact CD2-CG2 4.32Å; W180-V185 HydrophobicContact CE3-CG2 3.58Å; W180-V185 HydrophobicContact CZ3-CG1 4.14Å; W180-V185 HydrophobicContact CZ3-CG2 3.77Å; N183-V185 PolarHBondContact O-N 3.19Å; N183-V185 WeakPolarHBondContact OD1-CG2 3.37Å; V185-V187 PolarHBondContact O-N 3.22Å; V185-G188 PolarHBondContact O-N 3Å; V185-T189 HydrophobicContact CG1-CG2 4.29Å; V185-T189 WeakPolarHBondContact O-CG2 3.46Å; V185-T189 PolarHBondContact O-N 3.03Å; V185-T189 PolarHBondContact O-OG1 2.94Å
186R98.1Very high97.5Very high36 Ų368.7 Ų8.714%0.1365%0.048CC..Hα-helixtrans-59.5-49.6179.2-67.6-171.9174.8179.50.5112.4W115 Q121 C122 H129 F184 T189 L190W115-R186 HydrophobicContact CB-CB 4.5Å; W115-R186 VanDerWaalsContact CD1-O 3.29Å; W115-R186 HydrophobicContact CD2-CB 3.94Å; W115-R186 HydrophobicContact CD2-CG 3.68Å; W115-R186 HydrophobicContact CE3-CG 3.89Å; W115-R186 HydrophobicContact CG-CB 3.89Å; W115-R186 HydrophobicContact CG-CG 4.16Å; W115-R186 HydrophobicContact CH2-CG 4.28Å; W115-R186 HydrophobicContact CZ2-CG 4.07Å; W115-R186 HydrophobicContact CZ3-CG 4.19Å; W115-R186 PolarHBondContact NE1-O 3.34Å; Q121-R186 VanDerWaalsContact O-CD 3.29Å; Q121-R186 WeakPolarHBondContact O-CD 3.27Å; Q121-R186 PolarHBondContact O-NH1 2.86Å; C122-R186 HydrophobicContact CB-CB 4.17Å; H129-R186 VanDerWaalsContact CD2-CZ 3.49Å; H129-R186 WeakPolarHBondContact ND1-CD 3.35Å; H129-R186 PolarHBondContact NE2-NH1 2.89Å; F184-R186 VanDerWaalsContact C-N 3.3Å; F184-R186 PolarHBondContact O-N 3.34Å; R186-T189 PolarHBondContact O-OG1 2.92Å; R186-L190 PolarHBondContact O-N 2.86Å
187V97.9Very high97.4Very high9 Ų99.3 Ų9.36%0.0555%0.053CC..Hα-helixtrans-70.5-35.6177.263.70000111.5C122 W123 F184 V185 T189 L190 I191 V241C122-V187 HydrophobicContact CB-CB 4.15Å; W123-V187 HydrophobicContact CH2-CB 4.04Å; W123-V187 HydrophobicContact CH2-CG1 3.79Å; W123-V187 HydrophobicContact CH2-CG2 4.15Å; W123-V187 HydrophobicContact CZ2-CB 4.33Å; W123-V187 HydrophobicContact CZ2-CG2 4.22Å; W123-V187 HydrophobicContact CZ3-CG1 4.16Å; F184-V187 HydrophobicContact CB-CG1 3.82Å; F184-V187 HydrophobicContact CG-CG1 4.3Å; F184-V187 WeakPolarHBondContact O-CG1 3.38Å; F184-V187 PolarHBondContact O-N 3.43Å; V185-V187 PolarHBondContact O-N 3.22Å; V187-T189 PolarHBondContact O-N 2.94Å; V187-L190 WeakPolarHBondContact O-CB 3.18Å; V187-L190 PolarHBondContact O-N 3.49Å; V187-I191 HydrophobicContact CG2-CD1 4.31Å; V187-I191 WeakPolarHBondContact O-CG1 3.5Å; V187-I191 PolarHBondContact O-N 3.42Å; V187-I191 VanDerWaalsContact O-N 3.12Å; V187-V241 HydrophobicContact CG2-CG1 3.74Å
188G97.9Very high97.4Very high5 Ų58.3 Ų8.35%0.0525%0.046CC..Hα-helixtrans-59.6-43.417600000112.8F184 V185 L190 I191 L192F184-G188 PolarHBondContact O-N 3.33Å; V185-G188 PolarHBondContact O-N 3Å; G188-L190 VanDerWaalsContact C-N 3.34Å; G188-L190 PolarHBondContact O-N 2.89Å; G188-I191 PolarHBondContact O-N 3.05Å; G188-L192 WeakPolarHBondContact O-CG 3.44Å; G188-L192 PolarHBondContact O-N 3.36Å
189T98.3Very high97.3Very high0 Ų09 Ų90%05%0.049CC..Hα-helixtrans-65.5-31.8176.9520000113.7M110 W115 I135 Y138 Y139 V185 R186 V187 L193M110-T189 WeakPolarHBondContact CE-OG1 3.42Å; M110-T189 VanDerWaalsContact SD-CB 3.58Å; M110-T189 HydrophobicContact SD-CG2 4.24Å; M110-T189 PolarHBondContact SD-OG1 3.32Å; W115-T189 PolarHBondContact NE1-OG1 3.15Å; I135-T189 HydrophobicContact CG2-CG2 4.03Å; Y138-T189 HydrophobicContact CD1-CG2 4.03Å; Y138-T189 HydrophobicContact CE1-CG2 4.21Å; Y139-T189 HydrophobicContact CD2-CG2 3.91Å; Y139-T189 HydrophobicContact CE2-CG2 4.35Å; V185-T189 HydrophobicContact CG1-CG2 4.29Å; V185-T189 WeakPolarHBondContact O-CG2 3.46Å; V185-T189 PolarHBondContact O-N 3.03Å; V185-T189 PolarHBondContact O-OG1 2.94Å; R186-T189 PolarHBondContact O-OG1 2.92Å; V187-T189 PolarHBondContact O-N 2.94Å; T189-L193 WeakPolarHBondContact O-CB 3.43Å; T189-L193 PolarHBondContact O-N 3.09Å
190L98.3Very high97.3Very high2 Ų29.6 Ų9.61%0.015%0.052CC..Hα-helixtrans-67.1-40.4171.9-64.2178.5000112M110 W115 L116 V119 C122 R186 V187 G188 S194M110-L190 HydrophobicContact CE-CD2 3.73Å; M110-L190 HydrophobicContact CE-CG 4.45Å; W115-L190 WeakPolarHBondContact O-CD1 3.47Å; L116-L190 HydrophobicContact CD1-CD2 4.06Å; V119-L190 HydrophobicContact CG2-CD1 4.31Å; C122-L190 VanDerWaalsContact SG-CD1 3.54Å; R186-L190 PolarHBondContact O-N 2.86Å; V187-L190 WeakPolarHBondContact O-CB 3.18Å; V187-L190 PolarHBondContact O-N 3.49Å; G188-L190 VanDerWaalsContact C-N 3.34Å; G188-L190 PolarHBondContact O-N 2.89Å; L190-S194 VanDerWaalsContact O-CB 3.27Å; L190-S194 WeakPolarHBondContact O-CB 3.47Å; L190-S194 PolarHBondContact O-N 3.28Å; L190-S194 PolarHBondContact O-OG 3.17Å
191I98.2Very high97.2Very high27 Ų2712.5 Ų12.514%0.1387%0.065CC..Hα-helixtrans-64.2-51.3177-65.9169000109.4V187 G188 L193 S194 H195 Y237 V241 L277V187-I191 HydrophobicContact CG2-CD1 4.31Å; V187-I191 WeakPolarHBondContact O-CG1 3.5Å; V187-I191 PolarHBondContact O-N 3.42Å; V187-I191 VanDerWaalsContact O-N 3.12Å; G188-I191 PolarHBondContact O-N 3.05Å; I191-L193 PolarHBondContact O-N 2.95Å; I191-S194 PolarHBondContact O-N 2.61Å; I191-S194 PolarHBondContact O-OG 3.49Å; I191-H195 VanDerWaalsContact O-CB 3.24Å; I191-H195 WeakPolarHBondContact O-CB 3.37Å; I191-H195 PolarHBondContact O-N 2.73Å; I191-H195 PolarHBondContact O-ND1 2.87Å; I191-Y237 HydrophobicContact CD1-CE2 4.19Å; I191-Y237 HydrophobicContact CG1-CD2 4.45Å; I191-Y237 HydrophobicContact CG1-CE2 4.14Å; I191-Y237 HydrophobicContact CG2-CE2 4.26Å; I191-V241 HydrophobicContact CD1-CG1 3.88Å; I191-V241 HydrophobicContact CG1-CG1 3.81Å; I191-L277 HydrophobicContact CD1-CD2 3.64Å
192L97.9Very high97.1Very high5 Ų514.2 Ų14.23%0.0267%0.074CC..Hα-helixtrans-52.5-58.9177.1-71.7168.1000111.4Y138 Y139 E142 Y146 L176 G188 S194 H195 D196Y138-L192 HydrophobicContact CE1-CB 4.26Å; Y138-L192 HydrophobicContact CE1-CD1 4.36Å; Y138-L192 WeakPolarHBondContact OH-CB 3.42Å; Y139-L192 HydrophobicContact CD2-CD1 4.11Å; Y139-L192 HydrophobicContact CE2-CD1 4.15Å; E142-L192 HydrophobicContact CB-CD1 3.98Å; E142-L192 HydrophobicContact CB-CD2 3.84Å; E142-L192 HydrophobicContact CG-CD1 4.07Å; E142-L192 HydrophobicContact CG-CD2 4.11Å; Y146-L192 HydrophobicContact CE2-CD2 4.17Å; L176-L192 HydrophobicContact CD1-CD2 4.5Å; L176-L192 HydrophobicContact CD2-CD1 4.06Å; L176-L192 HydrophobicContact CD2-CD2 3.89Å; L176-L192 HydrophobicContact CD2-CG 4.09Å; G188-L192 WeakPolarHBondContact O-CG 3.44Å; G188-L192 PolarHBondContact O-N 3.36Å; L192-S194 VanDerWaalsContact C-N 3.33Å; L192-S194 PolarHBondContact O-N 2.79Å; L192-H195 PolarHBondContact O-N 3.02Å; L192-D196 VanDerWaalsContact O-CG 3.22Å; L192-D196 PolarHBondContact O-N 3.1Å
193L97.5Very high97Very high15 Ų1514.5 Ų14.58%0.0798%0.075CC..Hα-helixtrans-58-42.2-176.9-177.466000113.3F103 L107 M110 L116 Y138 T189 I191 H195F103-L193 HydrophobicContact CD2-CD1 3.81Å; F103-L193 HydrophobicContact CE2-CD1 3.81Å; F103-L193 HydrophobicContact CE2-CG 4.43Å; L107-L193 HydrophobicContact CD2-CD1 4.08Å; L107-L193 HydrophobicContact CD2-CD2 4.41Å; L107-L193 HydrophobicContact CG-CD1 4.16Å; M110-L193 HydrophobicContact CB-CD2 4.23Å; M110-L193 HydrophobicContact CG-CD2 4.35Å; L116-L193 HydrophobicContact CD1-CD2 3.87Å; Y138-L193 PolarHBondContact OH-N 3.39Å; T189-L193 WeakPolarHBondContact O-CB 3.43Å; T189-L193 PolarHBondContact O-N 3.09Å; I191-L193 PolarHBondContact O-N 2.95Å; L193-H195 VanDerWaalsContact C-N 3.32Å
194S97.3Very high96.8Very high12 Ų1214.7 Ų14.78%0.0848%0.078CC..Hα-helixtrans-71.8-26.5178.563.50000113L190 I191 L192 V197 T232L190-S194 VanDerWaalsContact O-CB 3.27Å; L190-S194 WeakPolarHBondContact O-CB 3.47Å; L190-S194 PolarHBondContact O-N 3.28Å; L190-S194 PolarHBondContact O-OG 3.17Å; I191-S194 PolarHBondContact O-N 2.61Å; I191-S194 PolarHBondContact O-OG 3.49Å; L192-S194 VanDerWaalsContact C-N 3.33Å; L192-S194 PolarHBondContact O-N 2.79Å; S194-V197 WeakPolarHBondContact O-CG1 3.36Å; S194-T232 WeakPolarHBondContact O-CB 3.2Å; S194-T232 WeakPolarHBondContact O-CG2 3.29Å; S194-T232 PolarHBondContact O-OG1 2.86Å
195H96.9Very high96.4Very high4 Ų415 Ų152%0.0198%0.083CC..Hα-helixtrans-81-35.9-179.1-77.744.3000111.8I191 L192 L193 V197 S198 R233 Y237 H284I191-H195 VanDerWaalsContact O-CB 3.24Å; I191-H195 WeakPolarHBondContact O-CB 3.37Å; I191-H195 PolarHBondContact O-N 2.73Å; I191-H195 PolarHBondContact O-ND1 2.87Å; L192-H195 PolarHBondContact O-N 3.02Å; L193-H195 VanDerWaalsContact C-N 3.32Å; H195-V197 PolarHBondContact O-N 3.43Å; H195-S198 PolarHBondContact O-OG 3.23Å; H195-R233 VanDerWaalsContact CB-NH2 3.26Å; H195-R233 PolarHBondContact CD2-NE 2.84Å; H195-R233 PolarHBondContact CD2-NH1 3.39Å; H195-R233 PolarHBondContact CD2-NH2 3.37Å; H195-R233 VanDerWaalsContact CG-NE 3.29Å; H195-R233 WeakPolarHBondContact NE2-CD 3.39Å; H195-R233 PolarHBondContact NE2-NE 3.04Å; H195-R233 PolarHBondContact NE2-NH1 3.06Å; H195-R233 PolarHBondContact O-NH2 3.16Å; H195-R233 VanDerWaalsContact O-NH2 3.15Å; H195-Y237 AromaticContact CE1-CD2 3.58Å; H195-Y237 AromaticContact CE1-CE2 3.96Å; H195-H284 AromaticContact NE2-CE1 3.32Å; H195-H284 PolarHBondContact NE2-CE1 3.46Å; H195-H284 VanDerWaalsContact NE2-CE1 3.32Å; H195-H284 AromaticContact NE2-NE2 3.69Å
196D96.7Very high95.9Very high0 Ų016.3 Ų16.30%09%0.088CC..Hα-helixtrans-68.2-35.9-175.3-61.9-27.4000113.3F103 Y138 L192 S198 D199 V200F103-D196 HydrophobicContact CB-CB 4.06Å; F103-D196 HydrophobicContact CD2-CB 4.24Å; Y138-D196 PolarHBondContact OH-OD2 3.03Å; L192-D196 VanDerWaalsContact O-CG 3.22Å; L192-D196 PolarHBondContact O-N 3.1Å; D196-S198 VanDerWaalsContact C-N 3.3Å; D196-S198 PolarHBondContact O-N 3.22Å; D196-D199 PolarHBondContact O-N 3.44Å; D196-V200 WeakPolarHBondContact O-CG2 3.18Å; D196-V200 PolarHBondContact O-N 3.44Å
197V96.3Very high95.5Very high27 Ų2716.5 Ų16.516%0.1649%0.092CC..Hα-helixtrans-59.7-38.7-176.469.20000112.8F103 S194 H195 D199 F201 T232F103-V197 HydrophobicContact CD2-CB 3.95Å; F103-V197 HydrophobicContact CE1-CG2 4.14Å; F103-V197 HydrophobicContact CE2-CB 3.56Å; F103-V197 HydrophobicContact CE2-CG2 3.98Å; F103-V197 HydrophobicContact CZ-CB 3.86Å; F103-V197 HydrophobicContact CZ-CG2 3.71Å; S194-V197 WeakPolarHBondContact O-CG1 3.36Å; H195-V197 PolarHBondContact O-N 3.43Å; V197-D199 VanDerWaalsContact C-N 3.29Å; V197-D199 PolarHBondContact O-N 2.97Å; V197-F201 HydrophobicContact CG2-CD2 4.5Å; V197-F201 HydrophobicContact CG2-CE2 3.92Å; V197-F201 WeakPolarHBondContact O-CD2 3.33Å; V197-T232 HydrophobicContact CG1-CG2 3.64Å
198S96.1Very high94.9Very high0 Ų017.7 Ų17.70%010%0.099CC..Hα-helixtrans-68.9-33.2177.157.90000111.6H195 D196 F201 L202 F225H195-S198 PolarHBondContact O-OG 3.23Å; D196-S198 VanDerWaalsContact C-N 3.3Å; D196-S198 PolarHBondContact O-N 3.22Å; S198-F201 PolarHBondContact O-N 3.5Å; S198-L202 WeakPolarHBondContact O-CB 3.49Å; S198-L202 PolarHBondContact O-N 3.3Å; S198-F225 WeakPolarHBondContact O-CD2 3.44Å
199D95.5Very high94.2Very high22 Ų2220.8 Ų20.812%0.11811%0.109CC..Hα-helixtrans-77.4-31.2-173.4-66.23.2000111Y99 D196 V197 L202 E203 R233Y99-D199 HydrophobicContact CD1-CB 4.22Å; Y99-D199 HydrophobicContact CD2-CB 3.76Å; Y99-D199 HydrophobicContact CE1-CB 4.33Å; Y99-D199 HydrophobicContact CE2-CB 3.86Å; Y99-D199 HydrophobicContact CG-CB 3.96Å; D196-D199 PolarHBondContact O-N 3.44Å; V197-D199 VanDerWaalsContact C-N 3.29Å; V197-D199 PolarHBondContact O-N 2.97Å; D199-L202 PolarHBondContact O-N 2.94Å; D199-E203 WeakPolarHBondContact O-CG 3.09Å; D199-E203 PolarHBondContact O-N 3.42Å; D199-R233 IonicContact OD1-NH2 2.86Å; D199-R233 IonicContact OD2-NH2 3.74Å
200V97.1Very high93.1Very high20 Ų2023.2 Ų23.212%0.12112%0.118CC..Hα-helixtrans-55.6-51.8166.7175.50000110.9F96 Y99 F103 D196 G204F96-V200 HydrophobicContact CD2-CG1 4.4Å; F96-V200 WeakPolarHBondContact CD2-O 3.38Å; F96-V200 HydrophobicContact CE2-CG1 3.89Å; Y99-V200 VanDerWaalsContact C-CG2 3.49Å; Y99-V200 WeakPolarHBondContact O-CG2 3.38Å; F103-V200 HydrophobicContact CB-CG2 4.29Å; D196-V200 WeakPolarHBondContact O-CG2 3.18Å; D196-V200 PolarHBondContact O-N 3.44Å; V200-G204 PolarHBondContact O-N 3.12Å
201F96.3Very high91.8Very high60 Ų6026.7 Ų26.726%0.26314%0.137SC..Hα-helixtrans-69.5-34.5-179.7-64.4-56000112.6V197 S198 G205 L224 F225 S228V197-F201 HydrophobicContact CG2-CD2 4.5Å; V197-F201 HydrophobicContact CG2-CE2 3.92Å; V197-F201 WeakPolarHBondContact O-CD2 3.33Å; S198-F201 PolarHBondContact O-N 3.5Å; F201-G205 PolarHBondContact O-N 3.06Å; F201-L224 HydrophobicContact CD1-CB 3.85Å; F201-L224 HydrophobicContact CD1-CD1 4.04Å; F201-L224 HydrophobicContact CD2-CB 4.44Å; F201-L224 HydrophobicContact CE1-CB 4.14Å; F201-L224 HydrophobicContact CE1-CD1 3.82Å; F201-L224 HydrophobicContact CG-CB 4.02Å; F201-F225 HydrophobicContact CB-CB 3.85Å; F201-S228 WeakPolarHBondContact CD2-OG 3.3Å
202L93.8Very high90.3Very high41 Ų4129 Ų2922%0.21516%0.16CC..Hα-helixtrans-61.9-52.1176.5-179.6144.7000111.4S198 D199 G205 K206 F225S198-L202 WeakPolarHBondContact O-CB 3.49Å; S198-L202 PolarHBondContact O-N 3.3Å; D199-L202 PolarHBondContact O-N 2.94Å; L202-G205 PolarHBondContact O-N 2.69Å; L202-K206 HydrophobicContact CD2-CD 4.38Å; L202-K206 WeakPolarHBondContact O-CG 3.32Å; L202-K206 PolarHBondContact O-N 2.85Å; L202-K206 VanDerWaalsContact O-N 3.14Å; L202-F225 HydrophobicContact CB-CD2 3.58Å; L202-F225 HydrophobicContact CB-CE2 3.68Å; L202-F225 HydrophobicContact CB-CG 4.33Å; L202-F225 HydrophobicContact CB-CZ 4.49Å; L202-F225 HydrophobicContact CD1-CD2 4.26Å; L202-F225 HydrophobicContact CD1-CE2 3.48Å; L202-F225 VanDerWaalsContact CD1-CE2 3.48Å; L202-F225 HydrophobicContact CD1-CZ 3.65Å; L202-F225 HydrophobicContact CG-CD2 4.33Å; L202-F225 HydrophobicContact CG-CE2 4.04Å; L202-F225 HydrophobicContact CG-CZ 4.41Å
203E94.3Very high88.8Confident6 Ų637.1 Ų37.13%0.02820%0.198CC..Hα-helixtrans-71.8-37.5-178.8-61.2-60.416300111.3R95 F96 Y99 D199 G205 K206 L207R95-E203 HydrophobicContact CB-CG 3.76Å; F96-E203 HydrophobicContact CB-CB 3.8Å; F96-E203 HydrophobicContact CD2-CB 4.48Å; Y99-E203 HydrophobicContact CD2-CG 3.97Å; Y99-E203 HydrophobicContact CE2-CG 4.04Å; D199-E203 WeakPolarHBondContact O-CG 3.09Å; D199-E203 PolarHBondContact O-N 3.42Å; E203-G205 PolarHBondContact O-N 2.88Å; E203-K206 VanDerWaalsContact CD-NZ 3.26Å; E203-K206 PolarHBondContact O-N 3.38Å; E203-K206 IonicContact OE1-NZ 3.04Å; E203-K206 PolarHBondContact OE1-NZ 3.17Å; E203-K206 WeakPolarHBondContact OE2-CD 3.44Å; E203-K206 IonicContact OE2-NZ 3.93Å; E203-K206 PolarHBondContact OE2-NZ 3.04Å; E203-L207 WeakPolarHBondContact O-CG 3.47Å; E203-L207 PolarHBondContact O-N 3.04Å
204G92.2Very high87.9Confident6 Ų639.5 Ų39.56%0.06221%0.21CC..Hα-helixtrans-60.7-4317300000112.7V200 K206 L207 V208V200-G204 PolarHBondContact O-N 3.12Å; G204-K206 PolarHBondContact O-N 3.5Å; G204-L207 PolarHBondContact O-N 3.18Å; G204-V208 WeakPolarHBondContact O-CG2 3.27Å; G204-V208 PolarHBondContact O-N 2.9Å
205G90.1Very high87Confident14 Ų1444.5 Ų44.514%0.14423%0.231CC..Hα-helixtrans-62.9-39.5175.800000113.1F201 L202 E203 R209F201-G205 PolarHBondContact O-N 3.06Å; L202-G205 PolarHBondContact O-N 2.69Å; E203-G205 PolarHBondContact O-N 2.88Å; G205-R209 WeakPolarHBondContact O-CB 3.25Å; G205-R209 PolarHBondContact O-N 2.82Å
206K88.3Confident86.5Confident31 Ų3150.8 Ų50.814%0.13526%0.264CS..Hα-helixtrans-62-42.8173.2-70.1176.1-164.4160.60111.7C92 L202 E203 G204 R209 Y210C92-K206 HydrophobicContact CB-CB 4.45Å; L202-K206 HydrophobicContact CD2-CD 4.38Å; L202-K206 WeakPolarHBondContact O-CG 3.32Å; L202-K206 PolarHBondContact O-N 2.85Å; L202-K206 VanDerWaalsContact O-N 3.14Å; E203-K206 VanDerWaalsContact CD-NZ 3.26Å; E203-K206 PolarHBondContact O-N 3.38Å; E203-K206 IonicContact OE1-NZ 3.04Å; E203-K206 PolarHBondContact OE1-NZ 3.17Å; E203-K206 WeakPolarHBondContact OE2-CD 3.44Å; E203-K206 IonicContact OE2-NZ 3.93Å; E203-K206 PolarHBondContact OE2-NZ 3.04Å; G204-K206 PolarHBondContact O-N 3.5Å; K206-R209 PolarHBondContact O-N 3.36Å; K206-Y210 WeakPolarHBondContact O-CD2 3.18Å; K206-Y210 WeakPolarHBondContact O-CE2 3.31Å; K206-Y210 PolarHBondContact O-N 3.04Å
207L88.3Confident86Confident41 Ų4154.2 Ų54.222%0.21528%0.281CS..Hα-helixtrans-62-48.2178.5-69.2172.4000111.9I89 C92 F93 F96 E203 G204 R209 Y210I89-L207 HydrophobicContact CG2-CD2 4.04Å; C92-L207 HydrophobicContact CB-CD2 3.87Å; C92-L207 HydrophobicContact CB-CG 4.22Å; F93-L207 HydrophobicContact CB-CD1 4.39Å; F93-L207 HydrophobicContact CB-CD2 3.94Å; F93-L207 HydrophobicContact CD2-CD1 4.12Å; F96-L207 HydrophobicContact CB-CD1 3.82Å; F96-L207 HydrophobicContact CD1-CD1 4.04Å; F96-L207 HydrophobicContact CG-CD1 3.91Å; E203-L207 WeakPolarHBondContact O-CG 3.47Å; E203-L207 PolarHBondContact O-N 3.04Å; G204-L207 PolarHBondContact O-N 3.18Å; L207-R209 VanDerWaalsContact C-N 3.29Å; L207-R209 PolarHBondContact O-N 3.33Å; L207-Y210 PolarHBondContact O-N 3.21Å
208V86.3Confident85.5Confident33 Ų3353.8 Ų53.820%0.228%0.279CS..Hα-helixtrans-60.7-39.3177.8171.30000111.4G204 Y210 D211 M217 M221G204-V208 WeakPolarHBondContact O-CG2 3.27Å; G204-V208 PolarHBondContact O-N 2.9Å; V208-Y210 PolarHBondContact O-N 3.47Å; V208-D211 PolarHBondContact O-N 3.24Å; V208-M217 HydrophobicContact CB-CG 4.4Å; V208-M217 HydrophobicContact CG1-CB 3.68Å; V208-M217 HydrophobicContact CG1-CG 3.46Å; V208-M217 VanDerWaalsContact CG1-CG 3.46Å; V208-M217 HydrophobicContact CG2-CG 4.02Å; V208-M221 HydrophobicContact CG2-CG 4.12Å
209R82.6Confident85.1Confident71 Ų7157 Ų5727%0.26830%0.296SS..Hα-helixtrans-60.5-27.8-179.2-176.2-179.666.3-173.42.7113.5G205 K206 L207 D211 T218 D306G205-R209 WeakPolarHBondContact O-CB 3.25Å; G205-R209 PolarHBondContact O-N 2.82Å; K206-R209 PolarHBondContact O-N 3.36Å; L207-R209 VanDerWaalsContact C-N 3.29Å; L207-R209 PolarHBondContact O-N 3.33Å; R209-D211 PolarHBondContact O-N 3.25Å; R209-T218 HydrophobicContact CB-CG2 3.94Å; R209-T218 HydrophobicContact CG-CG2 4.12Å; R209-D306 IonicContact NH1-OD2 3.6Å
210Y74.4Confident84.9Confident50 Ų5061.3 Ų61.320%0.19631%0.314CS..THydrogen-bonded Turntrans-67.8-16.9178.2-72.7-69000113.1R85 I89 K206 L207 V208 A212R85-Y210 HydrophobicContact CG-CE1 4.23Å; R85-Y210 PolarHBondContact NH2-O 3.44Å; I89-Y210 HydrophobicContact CB-CE2 4.43Å; I89-Y210 HydrophobicContact CD1-CD1 4.02Å; I89-Y210 HydrophobicContact CD1-CD2 4.31Å; I89-Y210 HydrophobicContact CD1-CE1 4.4Å; I89-Y210 HydrophobicContact CD1-CG 3.96Å; I89-Y210 HydrophobicContact CG1-CD1 3.89Å; I89-Y210 HydrophobicContact CG1-CD2 3.58Å; I89-Y210 HydrophobicContact CG1-CE1 3.9Å; I89-Y210 HydrophobicContact CG1-CE2 3.6Å; I89-Y210 HydrophobicContact CG1-CG 3.71Å; K206-Y210 WeakPolarHBondContact O-CD2 3.18Å; K206-Y210 WeakPolarHBondContact O-CE2 3.31Å; K206-Y210 PolarHBondContact O-N 3.04Å; L207-Y210 PolarHBondContact O-N 3.21Å; V208-Y210 PolarHBondContact O-N 3.47Å; Y210-A212 PolarHBondContact O-N 2.89Å
211D72.6Confident84.6Confident76 Ų7662.3 Ų62.341%0.40632%0.318SS..  trans-88.596.9165.6-175.14.7000110.8V208 R209 H213 N214V208-D211 PolarHBondContact O-N 3.24Å; R209-D211 PolarHBondContact O-N 3.25Å; D211-H213 PolarHBondContact O-N 3.27Å; D211-H213 WeakPolarHBondContact OD1-CB 3.34Å; D211-H213 IonicContact OD1-CG 3.8Å; D211-H213 PolarHBondContact OD1-N 3.39Å; D211-H213 VanDerWaalsContact OD1-N 3.12Å; D211-H213 IonicContact OD1-ND1 3.29Å; D211-H213 PolarHBondContact OD1-ND1 3.35Å; D211-N214 PolarHBondContact O-N 2.85Å
212A65.3Low84.4Confident75 Ų7561.5 Ų61.562%0.6231%0.314SS*.THydrogen-bonded Turntrans-61.1-15.9-178.800000114.2Y210Y210-A212 PolarHBondContact O-N 2.89Å
213H66.9Low84.3Confident176 Ų17663.5 Ų63.582%0.81533%0.328SS*.THydrogen-bonded Turntrans-84.6-17.2-178.2-5790.8000112.8D211D211-H213 PolarHBondContact O-N 3.27Å; D211-H213 WeakPolarHBondContact OD1-CB 3.34Å; D211-H213 IonicContact OD1-CG 3.8Å; D211-H213 PolarHBondContact OD1-N 3.39Å; D211-H213 VanDerWaalsContact OD1-N 3.12Å; D211-H213 IonicContact OD1-ND1 3.29Å; D211-H213 PolarHBondContact OD1-ND1 3.35Å
214N78.3Confident84.4Confident64 Ų6465.7 Ų65.734%0.34234%0.339SS..  trans-110.560.6-173.5-154.2-15.6000113.5D211 N216 M217 T218D211-N214 PolarHBondContact O-N 2.85Å; N214-N216 VanDerWaalsContact C-N 3.29Å; N214-N216 PolarHBondContact O-N 3.19Å; N214-M217 HydrophobicContact CB-CB 4.34Å; N214-M217 VanDerWaalsContact CG-CB 3.44Å; N214-M217 PolarHBondContact O-N 3.13Å; N214-M217 WeakPolarHBondContact OD1-CB 3.42Å; N214-M217 PolarHBondContact OD1-N 3.02Å; N214-T218 PolarHBondContact O-N 3.49Å; N214-T218 VanDerWaalsContact O-N 3.08Å; N214-T218 PolarHBondContact O-OG1 2.93Å; N214-T218 VanDerWaalsContact O-OG1 3.06Å
215K80.1Confident84.6Confident118 Ų11866.2 Ų66.251%0.51334%0.34SS..Hα-helixtrans-60-37.5179.7-64.5179.6-176.8171.80112.8T218 N219K215-T218 PolarHBondContact O-N 3.26Å; K215-N219 PolarHBondContact O-N 3.08Å
216N84.9Confident84.9Confident135 Ų13568.2 Ų68.272%0.72235%0.345SS*.Hα-helixtrans-63.9-45.5179.8-69.2-10.2000111.3N214 T218 N219 F220N214-N216 VanDerWaalsContact C-N 3.29Å; N214-N216 PolarHBondContact O-N 3.19Å; N216-T218 VanDerWaalsContact C-N 3.34Å; N216-T218 PolarHBondContact O-N 3.43Å; N216-N219 PolarHBondContact O-N 3.08Å; N216-F220 WeakPolarHBondContact O-CB 3.39Å; N216-F220 PolarHBondContact O-N 3.37Å
217M87.4Confident85.3Confident72 Ų7269.8 Ų69.836%0.35536%0.36SS..Hα-helixtrans-65.9-37.6176-171.364.97500111.8V208 N214 N219 F220 M221V208-M217 HydrophobicContact CB-CG 4.4Å; V208-M217 HydrophobicContact CG1-CB 3.68Å; V208-M217 HydrophobicContact CG1-CG 3.46Å; V208-M217 VanDerWaalsContact CG1-CG 3.46Å; V208-M217 HydrophobicContact CG2-CG 4.02Å; N214-M217 HydrophobicContact CB-CB 4.34Å; N214-M217 VanDerWaalsContact CG-CB 3.44Å; N214-M217 PolarHBondContact O-N 3.13Å; N214-M217 WeakPolarHBondContact OD1-CB 3.42Å; N214-M217 PolarHBondContact OD1-N 3.02Å; M217-N219 PolarHBondContact O-N 3.11Å; M217-F220 PolarHBondContact O-N 2.9Å; M217-F220 HydrophobicContact SD-CD1 3.94Å; M217-M221 HydrophobicContact CG-CG 4.47Å; M217-M221 WeakPolarHBondContact O-CB 3.49Å; M217-M221 WeakPolarHBondContact O-CG 3.49Å; M217-M221 PolarHBondContact O-N 2.89Å; M217-M221 HydrophobicContact SD-CE 4.02Å
218T85.9Confident85.7Confident19 Ų1968.6 Ų68.612%0.11736%0.355CS..Hα-helixtrans-60.5-46.7176.3-57.70000111.1R209 N214 K215 N216 M221 F222R209-T218 HydrophobicContact CB-CG2 3.94Å; R209-T218 HydrophobicContact CG-CG2 4.12Å; N214-T218 PolarHBondContact O-N 3.49Å; N214-T218 VanDerWaalsContact O-N 3.08Å; N214-T218 PolarHBondContact O-OG1 2.93Å; N214-T218 VanDerWaalsContact O-OG1 3.06Å; K215-T218 PolarHBondContact O-N 3.26Å; N216-T218 VanDerWaalsContact C-N 3.34Å; N216-T218 PolarHBondContact O-N 3.43Å; T218-M221 PolarHBondContact O-N 2.93Å; T218-F222 WeakPolarHBondContact O-CB 3.43Å; T218-F222 PolarHBondContact O-N 3.02Å
219N87.1Confident86.3Confident66 Ų6667.6 Ų67.635%0.35335%0.348SS..Hα-helixtrans-65.4-41.3177-71.2-13.7000111.7K215 N216 M217 F222 V223K215-N219 PolarHBondContact O-N 3.08Å; N216-N219 PolarHBondContact O-N 3.08Å; M217-N219 PolarHBondContact O-N 3.11Å; N219-F222 WeakPolarHBondContact O-CB 3.42Å; N219-F222 PolarHBondContact O-N 3.3Å; N219-V223 WeakPolarHBondContact O-CG2 3.29Å; N219-V223 PolarHBondContact O-N 3.33Å
220F90.2Very high87Confident113 Ų11366.2 Ų66.250%0.49635%0.347SS..Hα-helixtrans-59.6-48.7176.2175.3-106.2000111.9N216 M217 F222 V223 L224N216-F220 WeakPolarHBondContact O-CB 3.39Å; N216-F220 PolarHBondContact O-N 3.37Å; M217-F220 PolarHBondContact O-N 2.9Å; M217-F220 HydrophobicContact SD-CD1 3.94Å; F220-F222 VanDerWaalsContact C-N 3.29Å; F220-F222 PolarHBondContact O-N 2.89Å; F220-V223 PolarHBondContact O-N 2.8Å; F220-V223 VanDerWaalsContact O-N 3.15Å; F220-L224 HydrophobicContact CD1-CD1 4.08Å; F220-L224 HydrophobicContact CE1-CD1 3.43Å; F220-L224 VanDerWaalsContact CE1-CD1 3.43Å; F220-L224 HydrophobicContact CE1-CG 4.18Å; F220-L224 HydrophobicContact CE2-CD1 4.4Å; F220-L224 HydrophobicContact CE2-CG 4.36Å; F220-L224 HydrophobicContact CZ-CD1 3.62Å; F220-L224 HydrophobicContact CZ-CD2 4.29Å; F220-L224 HydrophobicContact CZ-CG 4.05Å; F220-L224 PolarHBondContact O-N 2.63Å
221M91.6Very high88.2Confident42 Ų4266.1 Ų66.121%0.20736%0.356CS..Hα-helixtrans-61.9-37.4175.9-71.7-64.2174.500112V208 M217 T218 L224 F225V208-M221 HydrophobicContact CG2-CG 4.12Å; M217-M221 HydrophobicContact CG-CG 4.47Å; M217-M221 WeakPolarHBondContact O-CB 3.49Å; M217-M221 WeakPolarHBondContact O-CG 3.49Å; M217-M221 PolarHBondContact O-N 2.89Å; M217-M221 HydrophobicContact SD-CE 4.02Å; T218-M221 PolarHBondContact O-N 2.93Å; M221-L224 PolarHBondContact O-N 3.47Å; M221-L224 HydrophobicContact SD-CD1 4.28Å; M221-F225 WeakPolarHBondContact O-CB 3.48Å; M221-F225 PolarHBondContact O-N 3.44Å
222F91.4Very high89.4Confident42 Ų4263.3 Ų63.318%0.18434%0.342CS..Hα-helixtrans-61.9-41.9174.2-177.7-95.8000112.2T218 N219 F220 F225 F226 I291 I294 A295T218-F222 WeakPolarHBondContact O-CB 3.43Å; T218-F222 PolarHBondContact O-N 3.02Å; N219-F222 WeakPolarHBondContact O-CB 3.42Å; N219-F222 PolarHBondContact O-N 3.3Å; F220-F222 VanDerWaalsContact C-N 3.29Å; F220-F222 PolarHBondContact O-N 2.89Å; F222-F225 HydrophobicContact CD2-CD1 4.44Å; F222-F225 PolarHBondContact O-N 3.34Å; F222-F226 HydrophobicContact CE1-CB 4.5Å; F222-F226 WeakPolarHBondContact O-CB 3.3Å; F222-F226 PolarHBondContact O-N 2.9Å; F222-I291 HydrophobicContact CE2-CG2 4.39Å; F222-I291 HydrophobicContact CZ-CG2 4.23Å; F222-I294 HydrophobicContact CE2-CG2 3.96Å; F222-I294 HydrophobicContact CZ-CG2 4.37Å; F222-A295 HydrophobicContact CE1-CB 3.86Å; F222-A295 HydrophobicContact CZ-CB 3.77Å
223V92.8Very high90.9Very high83 Ų8360 Ų6050%0.50331%0.313SS..Hα-helixtrans-64.6-43.6176.2174.50000111.2N219 F220 F226 S227N219-V223 WeakPolarHBondContact O-CG2 3.29Å; N219-V223 PolarHBondContact O-N 3.33Å; F220-V223 PolarHBondContact O-N 2.8Å; F220-V223 VanDerWaalsContact O-N 3.15Å; V223-F226 PolarHBondContact O-N 2.78Å; V223-S227 VanDerWaalsContact O-CB 3.24Å; V223-S227 WeakPolarHBondContact O-CB 3.45Å; V223-S227 PolarHBondContact O-N 3.36Å; V223-S227 PolarHBondContact O-OG 3.47Å
224L95.4Very high92.4Very high53 Ų5353.2 Ų53.228%0.27728%0.283SS..Hα-helixtrans-61.4-46.1175.8-69.8-178.8000111.9F201 F220 M221 S228F201-L224 HydrophobicContact CD1-CB 3.85Å; F201-L224 HydrophobicContact CD1-CD1 4.04Å; F201-L224 HydrophobicContact CD2-CB 4.44Å; F201-L224 HydrophobicContact CE1-CB 4.14Å; F201-L224 HydrophobicContact CE1-CD1 3.82Å; F201-L224 HydrophobicContact CG-CB 4.02Å; F220-L224 HydrophobicContact CD1-CD1 4.08Å; F220-L224 HydrophobicContact CE1-CD1 3.43Å; F220-L224 VanDerWaalsContact CE1-CD1 3.43Å; F220-L224 HydrophobicContact CE1-CG 4.18Å; F220-L224 HydrophobicContact CE2-CD1 4.4Å; F220-L224 HydrophobicContact CE2-CG 4.36Å; F220-L224 HydrophobicContact CZ-CD1 3.62Å; F220-L224 HydrophobicContact CZ-CD2 4.29Å; F220-L224 HydrophobicContact CZ-CG 4.05Å; F220-L224 PolarHBondContact O-N 2.63Å; M221-L224 PolarHBondContact O-N 3.47Å; M221-L224 HydrophobicContact SD-CD1 4.28Å; L224-S228 WeakPolarHBondContact O-CB 3.35Å; L224-S228 PolarHBondContact O-N 3.4Å; L224-S228 PolarHBondContact O-OG 3.48Å
225F96.2Very high93.4Very high16 Ų1654.8 Ų54.87%0.0729%0.29CS..Hα-helixtrans-58.9-52.1175.1163-113.9000111.7S198 F201 L202 M221 F222 S227 S228 W229 I291S198-F225 WeakPolarHBondContact O-CD2 3.44Å; F201-F225 HydrophobicContact CB-CB 3.85Å; L202-F225 HydrophobicContact CB-CD2 3.58Å; L202-F225 HydrophobicContact CB-CE2 3.68Å; L202-F225 HydrophobicContact CB-CG 4.33Å; L202-F225 HydrophobicContact CB-CZ 4.49Å; L202-F225 HydrophobicContact CD1-CD2 4.26Å; L202-F225 HydrophobicContact CD1-CE2 3.48Å; L202-F225 VanDerWaalsContact CD1-CE2 3.48Å; L202-F225 HydrophobicContact CD1-CZ 3.65Å; L202-F225 HydrophobicContact CG-CD2 4.33Å; L202-F225 HydrophobicContact CG-CE2 4.04Å; L202-F225 HydrophobicContact CG-CZ 4.41Å; M221-F225 WeakPolarHBondContact O-CB 3.48Å; M221-F225 PolarHBondContact O-N 3.44Å; F222-F225 HydrophobicContact CD2-CD1 4.44Å; F222-F225 PolarHBondContact O-N 3.34Å; F225-S227 PolarHBondContact O-N 2.89Å; F225-S228 PolarHBondContact O-N 3.26Å; F225-S228 PolarHBondContact O-OG 3.09Å; F225-W229 HydrophobicContact CE2-CB 4.22Å; F225-W229 HydrophobicContact CE2-CD2 4.41Å; F225-W229 AromaticContact CE2-CE3 3.85Å; F225-W229 HydrophobicContact CE2-CE3 3.85Å; F225-W229 HydrophobicContact CZ-CB 4.48Å; F225-W229 HydrophobicContact CZ-CD2 4.38Å; F225-W229 HydrophobicContact CZ-CE3 4.08Å; F225-W229 VanDerWaalsContact O-CB 3.27Å; F225-W229 WeakPolarHBondContact O-CB 3.39Å; F225-W229 PolarHBondContact O-N 2.95Å; F225-I291 HydrophobicContact CE1-CD1 3.95Å; F225-I291 HydrophobicContact CE1-CG1 4.01Å; F225-I291 HydrophobicContact CE1-CG2 3.91Å; F225-I291 HydrophobicContact CZ-CD1 3.58Å; F225-I291 HydrophobicContact CZ-CG1 4.08Å
226F95.9Very high94.2Very high57 Ų5752.1 Ų52.125%0.2528%0.278CS..Hα-helixtrans-64.4-42.2-177.4-177.6-113.3000111.8F222 V223 W229 V230 I291 L292F222-F226 HydrophobicContact CE1-CB 4.5Å; F222-F226 WeakPolarHBondContact O-CB 3.3Å; F222-F226 PolarHBondContact O-N 2.9Å; V223-F226 PolarHBondContact O-N 2.78Å; F226-W229 PolarHBondContact O-N 3.16Å; F226-V230 HydrophobicContact CD1-CG2 4.46Å; F226-V230 HydrophobicContact CD2-CG2 4.29Å; F226-V230 HydrophobicContact CE1-CG2 4.07Å; F226-V230 HydrophobicContact CE2-CG2 3.9Å; F226-V230 HydrophobicContact CZ-CG2 3.77Å; F226-V230 VanDerWaalsContact O-CG2 3.31Å; F226-V230 WeakPolarHBondContact O-CG2 3.39Å; F226-V230 PolarHBondContact O-N 3.45Å; F226-I291 HydrophobicContact CD2-CG2 3.56Å; F226-I291 HydrophobicContact CE2-CG2 4.06Å; F226-L292 HydrophobicContact CE2-CD2 3.87Å; F226-L292 HydrophobicContact CE2-CG 4.48Å; F226-L292 HydrophobicContact CZ-CD2 3.65Å
227S96.8Very high94.9Very high64 Ų6445.7 Ų45.745%0.44824%0.243SC..Hα-helixtrans-64-45.7179.1-55.30000111.6V223 F225 V230 A231V223-S227 VanDerWaalsContact O-CB 3.24Å; V223-S227 WeakPolarHBondContact O-CB 3.45Å; V223-S227 PolarHBondContact O-N 3.36Å; V223-S227 PolarHBondContact O-OG 3.47Å; F225-S227 PolarHBondContact O-N 2.89Å; S227-V230 PolarHBondContact O-N 2.94Å; S227-A231 WeakPolarHBondContact O-CB 3.44Å; S227-A231 PolarHBondContact O-N 2.9Å
228S97.9Very high95.4Very high16 Ų1643.1 Ų43.111%0.11223%0.232CC..Hα-helixtrans-64.7-42.4175.956.60000111.9F201 L224 F225 V230 A231 T232F201-S228 WeakPolarHBondContact CD2-OG 3.3Å; L224-S228 WeakPolarHBondContact O-CB 3.35Å; L224-S228 PolarHBondContact O-N 3.4Å; L224-S228 PolarHBondContact O-OG 3.48Å; F225-S228 PolarHBondContact O-N 3.26Å; F225-S228 PolarHBondContact O-OG 3.09Å; S228-V230 PolarHBondContact O-N 3.37Å; S228-A231 PolarHBondContact O-N 2.98Å; S228-T232 WeakPolarHBondContact O-CG2 3.39Å; S228-T232 PolarHBondContact O-N 3.37Å; S228-T232 PolarHBondContact O-OG1 3.49Å
229W98.2Very high95.9Very high12 Ų1248.4 Ų48.45%0.04525%0.253CS..Hα-helixtrans-57.7-47.7175.6179.7-84.2000112.5F225 F226 R233 W287 T288 I291F225-W229 HydrophobicContact CE2-CB 4.22Å; F225-W229 HydrophobicContact CE2-CD2 4.41Å; F225-W229 AromaticContact CE2-CE3 3.85Å; F225-W229 HydrophobicContact CE2-CE3 3.85Å; F225-W229 HydrophobicContact CZ-CB 4.48Å; F225-W229 HydrophobicContact CZ-CD2 4.38Å; F225-W229 HydrophobicContact CZ-CE3 4.08Å; F225-W229 VanDerWaalsContact O-CB 3.27Å; F225-W229 WeakPolarHBondContact O-CB 3.39Å; F225-W229 PolarHBondContact O-N 2.95Å; F226-W229 PolarHBondContact O-N 3.16Å; W229-R233 HydrophobicContact CD2-CG 4.11Å; W229-R233 HydrophobicContact CE3-CG 4.18Å; W229-R233 HydrophobicContact CZ3-CG 4.44Å; W229-R233 VanDerWaalsContact O-CB 3.31Å; W229-R233 WeakPolarHBondContact O-CB 3.46Å; W229-R233 PolarHBondContact O-N 2.79Å; W229-W287 HydrophobicContact CH2-CB 3.91Å; W229-W287 HydrophobicContact CH2-CE3 4.18Å; W229-W287 HydrophobicContact CZ2-CB 3.71Å; W229-T288 PolarHBondContact NE1-OG1 3.38Å; W229-I291 HydrophobicContact CD2-CD1 3.75Å; W229-I291 HydrophobicContact CE3-CD1 4.27Å; W229-I291 HydrophobicContact CG-CD1 4.07Å; W229-I291 HydrophobicContact CH2-CD1 4.47Å; W229-I291 HydrophobicContact CZ2-CD1 3.99Å
230V98.2Very high96.4Very high41 Ų4148 Ų4825%0.24825%0.251CS..Iπ-helixtrans-62.8-48.5177172.30000110.3F226 S227 S228 T232 L234 I235F226-V230 HydrophobicContact CD1-CG2 4.46Å; F226-V230 HydrophobicContact CD2-CG2 4.29Å; F226-V230 HydrophobicContact CE1-CG2 4.07Å; F226-V230 HydrophobicContact CE2-CG2 3.9Å; F226-V230 HydrophobicContact CZ-CG2 3.77Å; F226-V230 VanDerWaalsContact O-CG2 3.31Å; F226-V230 WeakPolarHBondContact O-CG2 3.39Å; F226-V230 PolarHBondContact O-N 3.45Å; S227-V230 PolarHBondContact O-N 2.94Å; S228-V230 PolarHBondContact O-N 3.37Å; V230-T232 PolarHBondContact O-N 2.96Å; V230-L234 HydrophobicContact CG2-CD1 4.1Å; V230-L234 WeakPolarHBondContact O-CB 3.42Å; V230-L234 PolarHBondContact O-N 3.01Å; V230-L234 VanDerWaalsContact O-N 3.16Å; V230-I235 HydrophobicContact CG1-CD1 4.06Å; V230-I235 HydrophobicContact CG1-CG1 4.45Å; V230-I235 PolarHBondContact O-N 3.2Å
231A98.4Very high96.7Very high48 Ų4842.7 Ų42.740%0.39723%0.227SC..Iπ-helixtrans-59.4-45.4-179.100000112.2S227 S228 I235 Y236S227-A231 WeakPolarHBondContact O-CB 3.44Å; S227-A231 PolarHBondContact O-N 2.9Å; S228-A231 PolarHBondContact O-N 2.98Å; A231-I235 WeakPolarHBondContact O-CB 3.36Å; A231-Y236 VanDerWaalsContact O-CB 3.31Å; A231-Y236 WeakPolarHBondContact O-CB 3.42Å; A231-Y236 PolarHBondContact O-N 3.13Å
232T98.1Very high97Very high17 Ų1741.6 Ų41.610%0.10422%0.222CC..Iπ-helixtrans-89.1-44.6-172.964.40000113.4S194 V197 S228 V230 Y237S194-T232 WeakPolarHBondContact O-CB 3.2Å; S194-T232 WeakPolarHBondContact O-CG2 3.29Å; S194-T232 PolarHBondContact O-OG1 2.86Å; V197-T232 HydrophobicContact CG1-CG2 3.64Å; S228-T232 WeakPolarHBondContact O-CG2 3.39Å; S228-T232 PolarHBondContact O-N 3.37Å; S228-T232 PolarHBondContact O-OG1 3.49Å; V230-T232 PolarHBondContact O-N 2.96Å; T232-Y237 WeakPolarHBondContact O-CB 3.37Å; T232-Y237 PolarHBondContact O-N 3.12Å
233R98Very high97.2Very high6 Ų645.8 Ų45.82%0.02324%0.237CC..Iπ-helixtrans-90.8-29.3-173.7-55.9-60.2-179.1104.66.8114.4H195 D199 W229 P238 H284H195-R233 VanDerWaalsContact CB-NH2 3.26Å; H195-R233 PolarHBondContact CD2-NE 2.84Å; H195-R233 PolarHBondContact CD2-NH1 3.39Å; H195-R233 PolarHBondContact CD2-NH2 3.37Å; H195-R233 VanDerWaalsContact CG-NE 3.29Å; H195-R233 WeakPolarHBondContact NE2-CD 3.39Å; H195-R233 PolarHBondContact NE2-NE 3.04Å; H195-R233 PolarHBondContact NE2-NH1 3.06Å; H195-R233 PolarHBondContact O-NH2 3.16Å; H195-R233 VanDerWaalsContact O-NH2 3.15Å; D199-R233 IonicContact OD1-NH2 2.86Å; D199-R233 IonicContact OD2-NH2 3.74Å; W229-R233 HydrophobicContact CD2-CG 4.11Å; W229-R233 HydrophobicContact CE3-CG 4.18Å; W229-R233 HydrophobicContact CZ3-CG 4.44Å; W229-R233 VanDerWaalsContact O-CB 3.31Å; W229-R233 WeakPolarHBondContact O-CB 3.46Å; W229-R233 PolarHBondContact O-N 2.79Å; R233-P238 WeakPolarHBondContact O-CD 3.44Å; R233-H284 HydrophobicContact CB-CB 4.24Å; R233-H284 PolarHBondContact NH1-CD2 2.94Å; R233-H284 PolarHBondContact NH1-NE2 3.42Å
234L98.1Very high97.3Very high34 Ų3441.9 Ų41.918%0.17821%0.213CC..Iπ-helixtrans-103.6-24-177.1-57.3-177.2000113.7V230 P238 F239 F281 I285 T288V230-L234 HydrophobicContact CG2-CD1 4.1Å; V230-L234 WeakPolarHBondContact O-CB 3.42Å; V230-L234 PolarHBondContact O-N 3.01Å; V230-L234 VanDerWaalsContact O-N 3.16Å; L234-P238 WeakPolarHBondContact O-CG 3.45Å; L234-F239 WeakPolarHBondContact O-CE2 3.48Å; L234-F281 HydrophobicContact CD2-CE2 4.33Å; L234-I285 HydrophobicContact CD2-CD1 3.69Å; L234-T288 HydrophobicContact CD1-CG2 3.64Å
235I98.2Very high97.3Very high96 Ų9639.5 Ų39.549%0.49220%0.201SC..Iπ-helixtrans-106.9-69.4179.4-60.8172000110.4V230 A231 Y237 P238 F239V230-I235 HydrophobicContact CG1-CD1 4.06Å; V230-I235 HydrophobicContact CG1-CG1 4.45Å; V230-I235 PolarHBondContact O-N 3.2Å; A231-I235 WeakPolarHBondContact O-CB 3.36Å; I235-Y237 PolarHBondContact O-N 2.93Å; I235-P238 WeakPolarHBondContact O-CD 3.31Å; I235-F239 WeakPolarHBondContact O-CB 3.36Å; I235-F239 WeakPolarHBondContact O-CD2 3.45Å; I235-F239 PolarHBondContact O-N 3.16Å; I235-F239 VanDerWaalsContact O-N 3.11Å
236Y98.3Very high97.1Very high63 Ų6340.7 Ų40.725%0.24721%0.209CC..Iπ-helixtrans-60.1-49.8-173.6179.4-102.1000112.6A231 I240 V241A231-Y236 VanDerWaalsContact O-CB 3.31Å; A231-Y236 WeakPolarHBondContact O-CB 3.42Å; A231-Y236 PolarHBondContact O-N 3.13Å; Y236-I240 HydrophobicContact CD2-CB 4.02Å; Y236-I240 HydrophobicContact CD2-CG1 3.94Å; Y236-I240 HydrophobicContact CD2-CG2 4.34Å; Y236-I240 HydrophobicContact CE2-CB 4.16Å; Y236-I240 HydrophobicContact CE2-CG1 4.42Å; Y236-I240 HydrophobicContact CE2-CG2 4Å; Y236-I240 WeakPolarHBondContact O-CA 3.41Å; Y236-I240 WeakPolarHBondContact O-CB 3.28Å; Y236-I240 PolarHBondContact O-N 2.86Å; Y236-V241 HydrophobicContact CD1-CG2 4.01Å; Y236-V241 HydrophobicContact CE1-CG2 3.53Å; Y236-V241 PolarHBondContact O-N 3.01Å
237Y98.3Very high96.8Very high0 Ų042.1 Ų42.10%022%0.223CC..Iπ-helixtrans-59.8-55.4-176.8-174.8-111.5000114I191 H195 T232 I235 V241 I242 L277 F281 H284I191-Y237 HydrophobicContact CD1-CE2 4.19Å; I191-Y237 HydrophobicContact CG1-CD2 4.45Å; I191-Y237 HydrophobicContact CG1-CE2 4.14Å; I191-Y237 HydrophobicContact CG2-CE2 4.26Å; H195-Y237 AromaticContact CE1-CD2 3.58Å; H195-Y237 AromaticContact CE1-CE2 3.96Å; T232-Y237 WeakPolarHBondContact O-CB 3.37Å; T232-Y237 PolarHBondContact O-N 3.12Å; I235-Y237 PolarHBondContact O-N 2.93Å; Y237-V241 HydrophobicContact CD2-CB 4.37Å; Y237-V241 WeakPolarHBondContact O-CB 3.46Å; Y237-V241 PolarHBondContact O-N 3.01Å; Y237-I242 HydrophobicContact CD1-CD1 3.89Å; Y237-I242 HydrophobicContact CD1-CG1 4.47Å; Y237-I242 HydrophobicContact CE1-CD1 3.54Å; Y237-I242 HydrophobicContact CE1-CG1 4.22Å; Y237-I242 PolarHBondContact O-N 2.64Å; Y237-L277 HydrophobicContact CE2-CD2 4.14Å; Y237-L277 WeakPolarHBondContact OH-CA 3.2Å; Y237-L277 WeakPolarHBondContact OH-CD2 3.29Å; Y237-L277 PolarHBondContact OH-O 3.39Å; Y237-L277 VanDerWaalsContact OH-O 3.05Å; Y237-F281 HydrophobicContact CD1-CB 4.3Å; Y237-F281 HydrophobicContact CD1-CD2 4.01Å; Y237-F281 HydrophobicContact CE1-CB 3.9Å; Y237-F281 HydrophobicContact CE1-CD2 4.45Å; Y237-H284 AromaticContact CD1-CE1 3.92Å; Y237-H284 AromaticContact CD1-ND1 3.69Å; Y237-H284 AromaticContact CE1-CE1 3.78Å; Y237-H284 AromaticContact CE1-ND1 3.79Å
238P98Very high96.4Very high17 Ų1740.7 Ų40.711%0.1121%0.209CC..Iπ-helixtrans-73.6-44-179.527.5-35.4000113.7R233 L234 I235 R243 F281R233-P238 WeakPolarHBondContact O-CD 3.44Å; L234-P238 WeakPolarHBondContact O-CG 3.45Å; I235-P238 WeakPolarHBondContact O-CD 3.31Å; P238-R243 PolarHBondContact O-N 3.24Å; P238-R243 VanDerWaalsContact O-N 3.08Å; P238-F281 HydrophobicContact CB-CD2 4.22Å; P238-F281 HydrophobicContact CB-CE1 4.2Å; P238-F281 HydrophobicContact CB-CE2 3.78Å; P238-F281 HydrophobicContact CB-CZ 3.76Å; P238-F281 HydrophobicContact CG-CD2 4.32Å; P238-F281 HydrophobicContact CG-CE2 3.59Å; P238-F281 HydrophobicContact CG-CZ 3.81Å
239F97.4Very high96Very high130 Ų13040.1 Ų40.157%0.5721%0.205SC*.Iπ-helixtrans-87.5-20.7-169.5-61.3-72.3000114.1L234 I235 R243L234-F239 WeakPolarHBondContact O-CE2 3.48Å; I235-F239 WeakPolarHBondContact O-CB 3.36Å; I235-F239 WeakPolarHBondContact O-CD2 3.45Å; I235-F239 PolarHBondContact O-N 3.16Å; I235-F239 VanDerWaalsContact O-N 3.11Å; F239-R243 WeakPolarHBondContact O-CB 3.43Å; F239-R243 WeakPolarHBondContact O-CD 3.03Å; F239-R243 PolarHBondContact O-NE 2.87Å; F239-R243 VanDerWaalsContact O-NE 3.11Å
240I96.8Very high95.4Very high59 Ų5940 Ų4030%0.30321%0.208SC..Iπ-helixtrans-105.5-60.9175.7-49.4-59.6000109.9V119 Y236 S244V119-I240 HydrophobicContact CB-CG2 4.13Å; V119-I240 HydrophobicContact CG1-CG2 4.1Å; V119-I240 HydrophobicContact CG2-CG2 4.34Å; Y236-I240 HydrophobicContact CD2-CB 4.02Å; Y236-I240 HydrophobicContact CD2-CG1 3.94Å; Y236-I240 HydrophobicContact CD2-CG2 4.34Å; Y236-I240 HydrophobicContact CE2-CB 4.16Å; Y236-I240 HydrophobicContact CE2-CG1 4.42Å; Y236-I240 HydrophobicContact CE2-CG2 4Å; Y236-I240 WeakPolarHBondContact O-CA 3.41Å; Y236-I240 WeakPolarHBondContact O-CB 3.28Å; Y236-I240 PolarHBondContact O-N 2.86Å; I240-S244 WeakPolarHBondContact O-CB 3.45Å; I240-S244 PolarHBondContact O-N 3.25Å
241V97.3Very high94.8Very high0 Ų041 Ų410%022%0.22CC..Iπ-helixtrans-71.7-59.1-171.5179.90000112.1V187 I191 Y236 Y237 R243 S244 A245V187-V241 HydrophobicContact CG2-CG1 3.74Å; I191-V241 HydrophobicContact CD1-CG1 3.88Å; I191-V241 HydrophobicContact CG1-CG1 3.81Å; Y236-V241 HydrophobicContact CD1-CG2 4.01Å; Y236-V241 HydrophobicContact CE1-CG2 3.53Å; Y236-V241 PolarHBondContact O-N 3.01Å; Y237-V241 HydrophobicContact CD2-CB 4.37Å; Y237-V241 WeakPolarHBondContact O-CB 3.46Å; Y237-V241 PolarHBondContact O-N 3.01Å; V241-R243 PolarHBondContact O-N 3.34Å; V241-S244 PolarHBondContact O-N 2.8Å; V241-A245 WeakPolarHBondContact O-CB 3.41Å; V241-A245 PolarHBondContact O-N 2.94Å
242I97.1Very high94.3Very high20 Ų2042.1 Ų42.110%0.10322%0.219CC..Iπ-helixtrans-63.8-44.1-179.1-67.2178.1000110.2Y237 S244 A245 V246 L277 I278 F281Y237-I242 HydrophobicContact CD1-CD1 3.89Å; Y237-I242 HydrophobicContact CD1-CG1 4.47Å; Y237-I242 HydrophobicContact CE1-CD1 3.54Å; Y237-I242 HydrophobicContact CE1-CG1 4.22Å; Y237-I242 PolarHBondContact O-N 2.64Å; I242-S244 PolarHBondContact O-N 2.66Å; I242-A245 PolarHBondContact O-N 3.38Å; I242-V246 HydrophobicContact CG2-CG2 4.13Å; I242-V246 WeakPolarHBondContact O-CB 3.29Å; I242-V246 WeakPolarHBondContact O-CG2 3.47Å; I242-V246 PolarHBondContact O-N 3.21Å; I242-L277 HydrophobicContact CD1-CB 4.4Å; I242-L277 HydrophobicContact CG1-CB 4.21Å; I242-I278 HydrophobicContact CG2-CG1 4.42Å; I242-F281 HydrophobicContact CD1-CB 3.97Å; I242-F281 HydrophobicContact CD1-CG 4.41Å
243R96.1Very high93.7Very high130 Ų13042 Ų4249%0.49122%0.217SC..Hα-helixtrans-54.3-51.7175.8-170.1-169.871.3157.13.2111.3P238 F239 V241 A245 V246 T247P238-R243 PolarHBondContact O-N 3.24Å; P238-R243 VanDerWaalsContact O-N 3.08Å; F239-R243 WeakPolarHBondContact O-CB 3.43Å; F239-R243 WeakPolarHBondContact O-CD 3.03Å; F239-R243 PolarHBondContact O-NE 2.87Å; F239-R243 VanDerWaalsContact O-NE 3.11Å; V241-R243 PolarHBondContact O-N 3.34Å; R243-A245 VanDerWaalsContact C-N 3.34Å; R243-A245 PolarHBondContact O-N 3.13Å; R243-V246 PolarHBondContact O-N 3.26Å; R243-V246 VanDerWaalsContact O-N 3.15Å; R243-T247 HydrophobicContact CG-CG2 4.36Å; R243-T247 PolarHBondContact O-N 3.36Å; R243-T247 PolarHBondContact O-OG1 3.23Å
244S95.3Very high93.1Very high0 Ų042.3 Ų42.30%022%0.219CC..Hα-helixtrans-61.6-41.4179.3-174.90000111.8W123 I240 V241 I242 V246 E248 A249W123-S244 PolarHBondContact NE1-OG 3.13Å; I240-S244 WeakPolarHBondContact O-CB 3.45Å; I240-S244 PolarHBondContact O-N 3.25Å; V241-S244 PolarHBondContact O-N 2.8Å; I242-S244 PolarHBondContact O-N 2.66Å; S244-V246 VanDerWaalsContact C-N 3.3Å; S244-V246 PolarHBondContact O-N 2.96Å; S244-E248 WeakPolarHBondContact CB-OE2 3.39Å; S244-E248 WeakPolarHBondContact O-CA 3.41Å; S244-E248 WeakPolarHBondContact O-CB 3.44Å; S244-E248 PolarHBondContact O-N 3.27Å; S244-E248 PolarHBondContact OG-OE2 3.49Å; S244-A249 PolarHBondContact O-N 3.06Å
245A94.2Very high92.4Very high4 Ų446.5 Ų46.53%0.03325%0.248CC..Hα-helixtrans-62.7-33.5175.200000113.5W123 V241 I242 R243 A249 V274 L277W123-A245 HydrophobicContact CH2-CB 4.06Å; W123-A245 HydrophobicContact CZ2-CB 3.94Å; V241-A245 WeakPolarHBondContact O-CB 3.41Å; V241-A245 PolarHBondContact O-N 2.94Å; I242-A245 PolarHBondContact O-N 3.38Å; R243-A245 VanDerWaalsContact C-N 3.34Å; R243-A245 PolarHBondContact O-N 3.13Å; A245-A249 VanDerWaalsContact O-CB 3.3Å; A245-A249 WeakPolarHBondContact O-CB 3.29Å; A245-V274 HydrophobicContact CB-CG2 4.18Å; A245-L277 HydrophobicContact CB-CD1 4.4Å
246V92.1Very high91.6Very high40 Ų4046.2 Ų46.224%0.24225%0.248CC..Hα-helixtrans-83.8-40.1-179.81730000112.3I242 R243 S244 L259 V274I242-V246 HydrophobicContact CG2-CG2 4.13Å; I242-V246 WeakPolarHBondContact O-CB 3.29Å; I242-V246 WeakPolarHBondContact O-CG2 3.47Å; I242-V246 PolarHBondContact O-N 3.21Å; R243-V246 PolarHBondContact O-N 3.26Å; R243-V246 VanDerWaalsContact O-N 3.15Å; S244-V246 VanDerWaalsContact C-N 3.3Å; S244-V246 PolarHBondContact O-N 2.96Å; V246-L259 HydrophobicContact CB-CD2 4.45Å; V246-L259 HydrophobicContact CG1-CD2 4.43Å; V246-L259 HydrophobicContact CG2-CD2 4.37Å; V246-V274 HydrophobicContact CG2-CG1 3.74Å
247T89.8Confident90.9Very high87 Ų8743.6 Ų43.653%0.53424%0.238SC..Hα-helixtrans-101.6-35.6-169.563.40000114R243R243-T247 HydrophobicContact CG-CG2 4.36Å; R243-T247 PolarHBondContact O-N 3.36Å; R243-T247 PolarHBondContact O-OG1 3.23Å
248E89.7Confident90.2Very high34 Ų3448.8 Ų48.816%0.15926%0.264CS..THydrogen-bonded Turntrans-101.8-38.7-172.3-60.7174.9163.600111.6K120 S244 A250 L252K120-E248 WeakPolarHBondContact CE-OE1 3.39Å; K120-E248 VanDerWaalsContact CG-OE2 3.25Å; K120-E248 WeakPolarHBondContact CG-OE2 3.21Å; S244-E248 WeakPolarHBondContact CB-OE2 3.39Å; S244-E248 WeakPolarHBondContact O-CA 3.41Å; S244-E248 WeakPolarHBondContact O-CB 3.44Å; S244-E248 PolarHBondContact O-N 3.27Å; S244-E248 PolarHBondContact OG-OE2 3.49Å; E248-A250 VanDerWaalsContact C-N 3.31Å; E248-A250 PolarHBondContact O-N 3.35Å; E248-L252 HydrophobicContact CB-CD1 4.36Å; E248-L252 WeakPolarHBondContact O-CB 3.26Å; E248-L252 WeakPolarHBondContact O-CG 3.26Å; E248-L252 PolarHBondContact O-N 3.02Å
249A89.3Confident89.6Confident4 Ų448.4 Ų48.43%0.03326%0.261CS..Hα-helixtrans-59.8-41.6-176.700000111.9W123 S244 A245 A251 L252 I253W123-A249 HydrophobicContact CD2-CB 3.58Å; W123-A249 HydrophobicContact CE3-CB 3.63Å; W123-A249 HydrophobicContact CG-CB 4.16Å; W123-A249 HydrophobicContact CH2-CB 4Å; W123-A249 HydrophobicContact CZ2-CB 3.97Å; W123-A249 HydrophobicContact CZ3-CB 3.84Å; S244-A249 PolarHBondContact O-N 3.06Å; A245-A249 VanDerWaalsContact O-CB 3.3Å; A245-A249 WeakPolarHBondContact O-CB 3.29Å; A249-A251 PolarHBondContact O-N 3.3Å; A249-L252 PolarHBondContact O-N 3.15Å; A249-I253 HydrophobicContact CB-CD1 3.94Å; A249-I253 VanDerWaalsContact O-CB 3.24Å; A249-I253 WeakPolarHBondContact O-CB 3.41Å; A249-I253 WeakPolarHBondContact O-CD1 3.3Å; A249-I253 WeakPolarHBondContact O-CG1 3.22Å; A249-I253 PolarHBondContact O-N 2.9Å
250A85.9Confident88.9Confident11 Ų1149.4 Ų49.49%0.09126%0.261CS..Hα-helixtrans-57.8-52.1-174.300000112.3E248 L252 Q254 Y257 L259E248-A250 VanDerWaalsContact C-N 3.31Å; E248-A250 PolarHBondContact O-N 3.35Å; A250-L252 VanDerWaalsContact C-N 3.33Å; A250-L252 PolarHBondContact O-N 2.83Å; A250-Q254 PolarHBondContact O-N 3.36Å; A250-Y257 HydrophobicContact CB-CD1 3.97Å; A250-Y257 WeakPolarHBondContact CB-O 3.36Å; A250-L259 HydrophobicContact CB-CB 4.26Å
251A85.1Confident88.2Confident61 Ų6147.5 Ų47.550%0.50425%0.252SS..Hα-helixtrans-68.6-29.5179.700000113.6A249A249-A251 PolarHBondContact O-N 3.3Å
252L87.4Confident87.1Confident72 Ų7258.1 Ų58.138%0.37729%0.293SS..Hα-helixtrans-87.1-24.5-178.6-68.5172.8000113.3W123 I124 E248 A249 A250W123-L252 HydrophobicContact CB-CB 3.66Å; W123-L252 HydrophobicContact CB-CD1 3.66Å; W123-L252 HydrophobicContact CB-CG 4.3Å; W123-L252 HydrophobicContact CG-CD1 4.32Å; I124-L252 HydrophobicContact CG1-CD1 4.25Å; I124-L252 HydrophobicContact CG1-CD2 4.33Å; E248-L252 HydrophobicContact CB-CD1 4.36Å; E248-L252 WeakPolarHBondContact O-CB 3.26Å; E248-L252 WeakPolarHBondContact O-CG 3.26Å; E248-L252 PolarHBondContact O-N 3.02Å; A249-L252 PolarHBondContact O-N 3.15Å; A250-L252 VanDerWaalsContact C-N 3.33Å; A250-L252 PolarHBondContact O-N 2.83Å
253I85.9Confident86.2Confident13 Ų1364.4 Ų64.47%0.06732%0.322CS..Hα-helixtrans-70.5-48170.3-72.3164.3000109.1P12 Y126 F184 A249 P270P12-I253 HydrophobicContact CG-CG2 3.92Å; Y126-I253 HydrophobicContact CD1-CB 4.26Å; Y126-I253 HydrophobicContact CD1-CG1 3.72Å; Y126-I253 HydrophobicContact CD1-CG2 4.23Å; Y126-I253 HydrophobicContact CE1-CB 4.49Å; Y126-I253 HydrophobicContact CE1-CG1 3.95Å; Y126-I253 HydrophobicContact CE1-CG2 4.05Å; Y126-I253 HydrophobicContact CG-CG1 4.49Å; F184-I253 HydrophobicContact CE1-CD1 4.18Å; F184-I253 HydrophobicContact CZ-CD1 3.74Å; A249-I253 HydrophobicContact CB-CD1 3.94Å; A249-I253 VanDerWaalsContact O-CB 3.24Å; A249-I253 WeakPolarHBondContact O-CB 3.41Å; A249-I253 WeakPolarHBondContact O-CD1 3.3Å; A249-I253 WeakPolarHBondContact O-CG1 3.22Å; A249-I253 PolarHBondContact O-N 2.9Å; I253-P270 HydrophobicContact CD1-CB 4.36Å; I253-P270 HydrophobicContact CD1-CG 4.41Å
254Q84.6Confident85.4Confident13 Ų1362.6 Ų62.66%0.06132%0.322CS..  trans-161132.9179.5-170.2-171.8-82.700110.4A250 D256 Y257A250-Q254 PolarHBondContact O-N 3.36Å; Q254-D256 VanDerWaalsContact C-N 3.3Å; Q254-D256 VanDerWaalsContact CG-OD1 3.32Å; Q254-D256 WeakPolarHBondContact CG-OD1 3.49Å; Q254-D256 PolarHBondContact NE2-OD1 3.4Å; Q254-D256 PolarHBondContact O-N 3.08Å; Q254-D256 VanDerWaalsContact O-N 3.12Å; Q254-Y257 WeakPolarHBondContact O-CB 3.49Å; Q254-Y257 PolarHBondContact O-N 3.35Å
255P82.6Confident84.8Confident123 Ų12365.1 Ų65.180%0.79934%0.339SS*.THydrogen-bonded Turntrans-58.3-31.8-168.3-28.935.4000116.8
256D82.3Confident84.3Confident90 Ų9067.4 Ų67.448%0.48135%0.354SS..THydrogen-bonded Turntrans-103.46.9-179.365.7-34.4000112.9R13 Q254 I258R13-D256 IonicContact CZ-OD1 3.43Å; R13-D256 IonicContact CZ-OD2 3.25Å; R13-D256 VanDerWaalsContact CZ-OD2 3.25Å; R13-D256 IonicContact NH1-OD1 3.42Å; R13-D256 PolarHBondContact NH1-OD1 3.26Å; R13-D256 IonicContact NH1-OD2 2.7Å; R13-D256 PolarHBondContact NH1-OD2 2.93Å; R13-D256 IonicContact NH2-OD1 2.66Å; R13-D256 PolarHBondContact NH2-OD1 3.06Å; R13-D256 IonicContact NH2-OD2 2.93Å; R13-D256 PolarHBondContact NH2-OD2 3Å; Q254-D256 VanDerWaalsContact C-N 3.3Å; Q254-D256 VanDerWaalsContact CG-OD1 3.32Å; Q254-D256 WeakPolarHBondContact CG-OD1 3.49Å; Q254-D256 PolarHBondContact NE2-OD1 3.4Å; Q254-D256 PolarHBondContact O-N 3.08Å; Q254-D256 VanDerWaalsContact O-N 3.12Å; D256-I258 PolarHBondContact O-N 2.84Å
257Y83.9Confident84.2Confident8 Ų865.5 Ų65.53%0.03134%0.342CS..  trans-79.8119.7179.9-179.3-106.4000110.7A250 Q254 L259 P267 R271A250-Y257 HydrophobicContact CB-CD1 3.97Å; A250-Y257 WeakPolarHBondContact CB-O 3.36Å; Q254-Y257 WeakPolarHBondContact O-CB 3.49Å; Q254-Y257 PolarHBondContact O-N 3.35Å; Y257-L259 HydrophobicContact CE1-CD1 3.86Å; Y257-P267 HydrophobicContact CE2-CG 4.17Å; Y257-P267 VanDerWaalsContact CE2-O 3.29Å; Y257-P267 WeakPolarHBondContact CE2-O 3.35Å; Y257-P267 PolarHBondContact OH-O 3.09Å; Y257-R271 VanDerWaalsContact CE2-NH2 3.29Å; Y257-R271 PolarHBondContact OH-NH1 3.11Å
258I84.1Confident84.1Confident108 Ų10865.2 Ų65.255%0.55433%0.332SS*.  trans-107.6118.7176.4-59173.3000107.3D256 W260 D261 R271D256-I258 PolarHBondContact O-N 2.84Å; I258-W260 VanDerWaalsContact C-N 3.27Å; I258-W260 PolarHBondContact O-N 2.88Å; I258-D261 HydrophobicContact CB-CB 4.16Å; I258-D261 HydrophobicContact CG2-CB 4.21Å; I258-R271 PolarHBondContact O-NH2 2.68Å
259L83.9Confident84.2Confident9 Ų963.8 Ų63.85%0.04733%0.326CS..THydrogen-bonded Turntrans-63.1-34.2-175.6-165.671.5000112.7V246 A250 Y257 R271 V274V246-L259 HydrophobicContact CB-CD2 4.45Å; V246-L259 HydrophobicContact CG1-CD2 4.43Å; V246-L259 HydrophobicContact CG2-CD2 4.37Å; A250-L259 HydrophobicContact CB-CB 4.26Å; Y257-L259 HydrophobicContact CE1-CD1 3.86Å; L259-R271 HydrophobicContact CD1-CG 3.95Å; L259-R271 HydrophobicContact CG-CG 4.47Å; L259-R271 VanDerWaalsContact O-CD 3.25Å; L259-R271 WeakPolarHBondContact O-CD 3.4Å; L259-R271 PolarHBondContact O-NE 3.03Å; L259-V274 HydrophobicContact CD1-CG2 4.49Å; L259-V274 HydrophobicContact CD2-CB 4.37Å; L259-V274 HydrophobicContact CD2-CG1 4.09Å; L259-V274 HydrophobicContact CD2-CG2 4.08Å
260W82.6Confident84.4Confident151 Ų15163.7 Ų63.757%0.57233%0.325SS*.THydrogen-bonded Turntrans-110.436.5-175.1-55.3113.7000113.5I258 V274 I278I258-W260 VanDerWaalsContact C-N 3.27Å; I258-W260 PolarHBondContact O-N 2.88Å; W260-V274 HydrophobicContact CH2-CG1 4.28Å; W260-V274 HydrophobicContact CZ2-CG1 4.12Å; W260-I278 HydrophobicContact CH2-CD1 4.31Å; W260-I278 HydrophobicContact CZ2-CD1 4.49Å
261D82.8Confident84.6Confident20 Ų2064.3 Ų64.311%0.10733%0.325CS..  trans-77.2140175.566.6-22.3000112.6I258 Q263 L264 S265 R271I258-D261 HydrophobicContact CB-CB 4.16Å; I258-D261 HydrophobicContact CG2-CB 4.21Å; D261-Q263 PolarHBondContact O-N 3.48Å; D261-L264 PolarHBondContact O-N 3.2Å; D261-L264 WeakPolarHBondContact OD1-CA 3.42Å; D261-L264 PolarHBondContact OD1-N 3.4Å; D261-S265 PolarHBondContact OD1-N 3.44Å; D261-S265 WeakPolarHBondContact OD2-CA 3.47Å; D261-S265 WeakPolarHBondContact OD2-CB 3.22Å; D261-S265 PolarHBondContact OD2-N 2.92Å; D261-S265 PolarHBondContact OD2-OG 3.37Å; D261-R271 IonicContact OD1-CZ 3.3Å; D261-R271 VanDerWaalsContact OD1-CZ 3.3Å; D261-R271 IonicContact OD1-NE 3.37Å; D261-R271 PolarHBondContact OD1-NE 3.36Å; D261-R271 IonicContact OD1-NH2 2.68Å; D261-R271 PolarHBondContact OD1-NH2 3.15Å; D261-R271 IonicContact OD2-NH2 3.62Å
262Y74.3Confident85Confident222 Ų22266 Ų6687%0.87133%0.325SS*.THydrogen-bonded Turntrans-68-25.9177.3-73-79.9000112.5L264Y262-L264 PolarHBondContact O-N 2.75Å
263Q78.8Confident85.4Confident153 Ų15362.9 Ų62.972%0.71531%0.309SS*.THydrogen-bonded Turntrans-78.6-9.3-179.6-69.678-0.100112.6D261 S265D261-Q263 PolarHBondContact O-N 3.48Å; Q263-S265 PolarHBondContact O-N 3.47Å
264L79.6Confident85.9Confident92 Ų9262.5 Ų62.548%0.48231%0.307SS..  trans47.159.6-178-56.9170.4000111.3D261 Y262 Y268D261-L264 PolarHBondContact O-N 3.2Å; D261-L264 WeakPolarHBondContact OD1-CA 3.42Å; D261-L264 PolarHBondContact OD1-N 3.4Å; Y262-L264 PolarHBondContact O-N 2.75Å; L264-Y268 HydrophobicContact CB-CD1 4.17Å; L264-Y268 HydrophobicContact CB-CE1 3.62Å; L264-Y268 WeakPolarHBondContact O-CE1 3.25Å; L264-Y268 VanDerWaalsContact O-CZ 3.25Å; L264-Y268 PolarHBondContact O-OH 3.2Å; L264-Y268 VanDerWaalsContact O-OH 3.09Å
265S81.4Confident86.4Confident52 Ų5267.4 Ų67.436%0.36433%0.329SS..PPolyproline II helixtrans-65.3137.8-178.7-54.40000109.8D261 Q263 R271D261-S265 PolarHBondContact OD1-N 3.44Å; D261-S265 WeakPolarHBondContact OD2-CA 3.47Å; D261-S265 WeakPolarHBondContact OD2-CB 3.22Å; D261-S265 PolarHBondContact OD2-N 2.92Å; D261-S265 PolarHBondContact OD2-OG 3.37Å; Q263-S265 PolarHBondContact O-N 3.47Å; S265-R271 PolarHBondContact O-NH1 3.3Å; S265-R271 PolarHBondContact O-NH2 2.91Å
266P84.9Confident87.1Confident52 Ų5261.9 Ų61.934%0.33829%0.293SS..SBendtrans-61.3147.9178.9-9.919.8000111.8P8 Y268P8-P266 HydrophobicContact CB-CB 4Å; P8-P266 HydrophobicContact CB-CG 4.42Å; P8-P266 WeakPolarHBondContact O-CB 3.45Å; P266-Y268 HydrophobicContact CB-CE2 4.35Å; P266-Y268 HydrophobicContact CG-CE2 4.38Å
267P89.1Confident87.9Confident1 Ų158 Ų581%0.00627%0.272CS..PPolyproline II helixcis-83.8148.33.730.1-34.4000116.7P8 L11 Y257 P270 R271P8-P267 VanDerWaalsContact O-CA 3.23Å; P8-P267 WeakPolarHBondContact O-CA 3.39Å; L11-P267 WeakPolarHBondContact O-CB 3.47Å; Y257-P267 HydrophobicContact CE2-CG 4.17Å; Y257-P267 VanDerWaalsContact CE2-O 3.29Å; Y257-P267 WeakPolarHBondContact CE2-O 3.35Å; Y257-P267 PolarHBondContact OH-O 3.09Å; P267-P270 HydrophobicContact CG-CG 4.13Å; P267-R271 PolarHBondContact O-NH1 2.96Å
268Y88.8Confident88.5Confident81 Ų8159.8 Ų59.832%0.31828%0.282SS..  trans-85.8-35-179.3-58.9-75.8000113.5Y9 L264 P266 R271 L272Y9-Y268 AromaticContact CD1-CD2 3.5Å; Y9-Y268 HydrophobicContact CD1-CD2 3.5Å; Y9-Y268 VanDerWaalsContact CD1-CD2 3.5Å; Y9-Y268 AromaticContact CD1-CE2 3.38Å; Y9-Y268 HydrophobicContact CD1-CE2 3.38Å; Y9-Y268 HydrophobicContact CE1-CD2 4.15Å; Y9-Y268 AromaticContact CE1-CE2 3.63Å; Y9-Y268 HydrophobicContact CE1-CE2 3.63Å; Y9-Y268 HydrophobicContact CG-CD2 4.06Å; Y9-Y268 HydrophobicContact CG-CE2 4.36Å; Y9-Y268 PolarHBondContact O-N 2.93Å; L264-Y268 HydrophobicContact CB-CD1 4.17Å; L264-Y268 HydrophobicContact CB-CE1 3.62Å; L264-Y268 WeakPolarHBondContact O-CE1 3.25Å; L264-Y268 VanDerWaalsContact O-CZ 3.25Å; L264-Y268 PolarHBondContact O-OH 3.2Å; L264-Y268 VanDerWaalsContact O-OH 3.09Å; P266-Y268 HydrophobicContact CB-CE2 4.35Å; P266-Y268 HydrophobicContact CG-CE2 4.38Å; Y268-R271 WeakPolarHBondContact O-CB 3.48Å; Y268-R271 PolarHBondContact O-N 2.78Å; Y268-R271 VanDerWaalsContact O-N 3.07Å; Y268-L272 PolarHBondContact O-N 3.4Å
269A91.1Very high89.2Confident4 Ų457.7 Ų57.73%0.03327%0.272CS..Hα-helixtrans-54.8-42.6-173.900000114.6Y9 W10 I182 R271 L272 I273Y9-A269 PolarHBondContact O-N 3.5Å; W10-A269 HydrophobicContact CD2-CB 4.15Å; W10-A269 HydrophobicContact CE3-CB 3.61Å; W10-A269 HydrophobicContact CZ3-CB 4.1Å; I182-A269 HydrophobicContact CD1-CB 4.36Å; I182-A269 HydrophobicContact CG2-CB 4.09Å; A269-R271 VanDerWaalsContact C-N 3.27Å; A269-R271 PolarHBondContact O-N 3.12Å; A269-L272 PolarHBondContact O-N 2.93Å; A269-L272 VanDerWaalsContact O-N 3.16Å; A269-I273 WeakPolarHBondContact O-CG1 3.06Å; A269-I273 PolarHBondContact O-N 3.12Å
270P92.5Very high89.9Confident2 Ų257.4 Ų57.41%0.01327%0.27CS..Hα-helixtrans-58.1-35.6176.8-26.736.3000113.9I182 F184 I253 P267 I273 V274I182-P270 HydrophobicContact CD1-CG 4.23Å; F184-P270 HydrophobicContact CE2-CB 4.26Å; F184-P270 HydrophobicContact CZ-CB 4.14Å; F184-P270 HydrophobicContact CZ-CG 4.16Å; I253-P270 HydrophobicContact CD1-CB 4.36Å; I253-P270 HydrophobicContact CD1-CG 4.41Å; P267-P270 HydrophobicContact CG-CG 4.13Å; P270-I273 PolarHBondContact O-N 3.3Å; P270-V274 WeakPolarHBondContact O-CG2 3.33Å; P270-V274 PolarHBondContact O-N 3.31Å
271R91.5Very high90.6Very high23 Ų2352.5 Ų52.59%0.08725%0.253CS..Hα-helixtrans-65.9-43.1177.1-61.1-174.7-175.584.91111.9Y257 I258 L259 D261 S265 P267 Y268 A269 I273 V274 F275Y257-R271 VanDerWaalsContact CE2-NH2 3.29Å; Y257-R271 PolarHBondContact OH-NH1 3.11Å; I258-R271 PolarHBondContact O-NH2 2.68Å; L259-R271 HydrophobicContact CD1-CG 3.95Å; L259-R271 HydrophobicContact CG-CG 4.47Å; L259-R271 VanDerWaalsContact O-CD 3.25Å; L259-R271 WeakPolarHBondContact O-CD 3.4Å; L259-R271 PolarHBondContact O-NE 3.03Å; D261-R271 IonicContact OD1-CZ 3.3Å; D261-R271 VanDerWaalsContact OD1-CZ 3.3Å; D261-R271 IonicContact OD1-NE 3.37Å; D261-R271 PolarHBondContact OD1-NE 3.36Å; D261-R271 IonicContact OD1-NH2 2.68Å; D261-R271 PolarHBondContact OD1-NH2 3.15Å; D261-R271 IonicContact OD2-NH2 3.62Å; S265-R271 PolarHBondContact O-NH1 3.3Å; S265-R271 PolarHBondContact O-NH2 2.91Å; P267-R271 PolarHBondContact O-NH1 2.96Å; Y268-R271 WeakPolarHBondContact O-CB 3.48Å; Y268-R271 PolarHBondContact O-N 2.78Å; Y268-R271 VanDerWaalsContact O-N 3.07Å; A269-R271 VanDerWaalsContact C-N 3.27Å; A269-R271 PolarHBondContact O-N 3.12Å; R271-I273 VanDerWaalsContact C-N 3.31Å; R271-I273 PolarHBondContact O-N 3.03Å; R271-V274 PolarHBondContact O-N 3.43Å; R271-F275 WeakPolarHBondContact O-CB 3.18Å; R271-F275 PolarHBondContact O-N 2.93Å
272L93.1Very high91.4Very high96 Ų9657.8 Ų57.850%0.50328%0.275SS..Hα-helixtrans-63.2-40.2177.6-64.5177.9000111.3F174 Y268 A269 F275 A276F174-L272 HydrophobicContact CZ-CB 4.16Å; Y268-L272 PolarHBondContact O-N 3.4Å; A269-L272 PolarHBondContact O-N 2.93Å; A269-L272 VanDerWaalsContact O-N 3.16Å; L272-F275 PolarHBondContact O-N 3.41Å; L272-A276 WeakPolarHBondContact O-CB 3.28Å; L272-A276 PolarHBondContact O-N 3.34Å
273I95.6Very high92.5Very high8 Ų848.3 Ų48.34%0.04124%0.239CC..Hα-helixtrans-63.4-49.2175.5-68.5168.8000110.4L175 S178 I182 F184 A269 P270 R271 F275 A276 L277L175-I273 HydrophobicContact CD2-CG2 3.94Å; S178-I273 WeakPolarHBondContact OG-CG1 3.47Å; I182-I273 HydrophobicContact CD1-CD1 3.4Å; I182-I273 VanDerWaalsContact CD1-CD1 3.4Å; I182-I273 HydrophobicContact CG1-CD1 4.03Å; F184-I273 HydrophobicContact CD2-CD1 3.86Å; F184-I273 HydrophobicContact CD2-CG2 4.35Å; F184-I273 HydrophobicContact CE2-CD1 4.11Å; A269-I273 WeakPolarHBondContact O-CG1 3.06Å; A269-I273 PolarHBondContact O-N 3.12Å; P270-I273 PolarHBondContact O-N 3.3Å; R271-I273 VanDerWaalsContact C-N 3.31Å; R271-I273 PolarHBondContact O-N 3.03Å; I273-F275 VanDerWaalsContact C-N 3.32Å; I273-F275 PolarHBondContact O-N 3.16Å; I273-A276 PolarHBondContact O-N 3.07Å; I273-A276 VanDerWaalsContact O-N 3.16Å; I273-L277 HydrophobicContact CG2-CD1 4.27Å; I273-L277 HydrophobicContact CG2-CG 4.41Å; I273-L277 WeakPolarHBondContact O-CG 3.24Å; I273-L277 PolarHBondContact O-N 3.26Å
274V95.6Very high93.4Very high5 Ų541 Ų413%0.0321%0.205CC..Hα-helixtrans-60.6-42.1178.4169.90000111.6A245 V246 L259 W260 P270 R271 A276 L277 I278A245-V274 HydrophobicContact CB-CG2 4.18Å; V246-V274 HydrophobicContact CG2-CG1 3.74Å; L259-V274 HydrophobicContact CD1-CG2 4.49Å; L259-V274 HydrophobicContact CD2-CB 4.37Å; L259-V274 HydrophobicContact CD2-CG1 4.09Å; L259-V274 HydrophobicContact CD2-CG2 4.08Å; W260-V274 HydrophobicContact CH2-CG1 4.28Å; W260-V274 HydrophobicContact CZ2-CG1 4.12Å; P270-V274 WeakPolarHBondContact O-CG2 3.33Å; P270-V274 PolarHBondContact O-N 3.31Å; R271-V274 PolarHBondContact O-N 3.43Å; V274-A276 PolarHBondContact O-N 3.21Å; V274-L277 WeakPolarHBondContact O-CB 3.24Å; V274-L277 PolarHBondContact O-N 3.42Å; V274-I278 HydrophobicContact CG1-CD1 4.08Å; V274-I278 WeakPolarHBondContact O-CG1 3.34Å; V274-I278 PolarHBondContact O-N 3.19Å
275F95.8Very high94.3Very high116 Ų11640.3 Ų40.351%0.50920%0.201SC..Hα-helixtrans-59.8-45.9174.6179.5-104.2000111.8R271 L272 I273 L277 I278 L279R271-F275 WeakPolarHBondContact O-CB 3.18Å; R271-F275 PolarHBondContact O-N 2.93Å; L272-F275 PolarHBondContact O-N 3.41Å; I273-F275 VanDerWaalsContact C-N 3.32Å; I273-F275 PolarHBondContact O-N 3.16Å; F275-L277 VanDerWaalsContact C-N 3.35Å; F275-L277 PolarHBondContact O-N 3.48Å; F275-I278 PolarHBondContact O-N 3.43Å; F275-L279 HydrophobicContact CD1-CD1 3.97Å; F275-L279 HydrophobicContact CD1-CG 4.33Å; F275-L279 HydrophobicContact CE1-CD1 3.45Å; F275-L279 VanDerWaalsContact CE1-CD1 3.45Å; F275-L279 HydrophobicContact CE1-CD2 4.43Å; F275-L279 HydrophobicContact CE1-CG 3.97Å; F275-L279 HydrophobicContact CZ-CD1 3.96Å; F275-L279 HydrophobicContact CZ-CD2 4.1Å; F275-L279 HydrophobicContact CZ-CG 4.11Å; F275-L279 WeakPolarHBondContact O-CG 3.4Å; F275-L279 PolarHBondContact O-N 3.32Å
276A98.1Very high95Very high6 Ų641.3 Ų41.35%0.0520%0.199CC..Hα-helixtrans-64.2-35.3176.400000113I171 F174 L175 L272 I273 V274 I278 L279 L280I171-A276 HydrophobicContact CG2-CB 4.34Å; F174-A276 HydrophobicContact CD1-CB 3.83Å; F174-A276 HydrophobicContact CE1-CB 3.82Å; L175-A276 HydrophobicContact CD1-CB 4.42Å; L175-A276 HydrophobicContact CD2-CB 3.63Å; L175-A276 HydrophobicContact CG-CB 3.9Å; L272-A276 WeakPolarHBondContact O-CB 3.28Å; L272-A276 PolarHBondContact O-N 3.34Å; I273-A276 PolarHBondContact O-N 3.07Å; I273-A276 VanDerWaalsContact O-N 3.16Å; V274-A276 PolarHBondContact O-N 3.21Å; A276-I278 VanDerWaalsContact C-N 3.35Å; A276-L279 PolarHBondContact O-N 3.4Å; A276-L280 WeakPolarHBondContact O-CB 3.27Å; A276-L280 PolarHBondContact O-N 3.06Å
277L98.1Very high95.5Very high8 Ų839.4 Ų39.44%0.04219%0.185CC..Hα-helixtrans-62.6-41.2172.4-68.7173.2000111.6L175 I191 Y237 I242 A245 I273 V274 F275 L280 F281L175-L277 HydrophobicContact CD1-CD2 4.01Å; L175-L277 HydrophobicContact CD2-CD2 3.82Å; L175-L277 HydrophobicContact CD2-CG 3.87Å; I191-L277 HydrophobicContact CD1-CD2 3.64Å; Y237-L277 HydrophobicContact CE2-CD2 4.14Å; Y237-L277 WeakPolarHBondContact OH-CA 3.2Å; Y237-L277 WeakPolarHBondContact OH-CD2 3.29Å; Y237-L277 PolarHBondContact OH-O 3.39Å; Y237-L277 VanDerWaalsContact OH-O 3.05Å; I242-L277 HydrophobicContact CD1-CB 4.4Å; I242-L277 HydrophobicContact CG1-CB 4.21Å; A245-L277 HydrophobicContact CB-CD1 4.4Å; I273-L277 HydrophobicContact CG2-CD1 4.27Å; I273-L277 HydrophobicContact CG2-CG 4.41Å; I273-L277 WeakPolarHBondContact O-CG 3.24Å; I273-L277 PolarHBondContact O-N 3.26Å; V274-L277 WeakPolarHBondContact O-CB 3.24Å; V274-L277 PolarHBondContact O-N 3.42Å; F275-L277 VanDerWaalsContact C-N 3.35Å; F275-L277 PolarHBondContact O-N 3.48Å; L277-L280 PolarHBondContact O-N 3.28Å; L277-F281 PolarHBondContact O-N 2.97Å
278I97.9Very high95.9Very high47 Ų4740 Ų4024%0.24119%0.188CC..Hα-helixtrans-66.7-42176.6-66.7166.3000110.9I242 W260 V274 F275 A276 L280 F281 F282I242-I278 HydrophobicContact CG2-CG1 4.42Å; W260-I278 HydrophobicContact CH2-CD1 4.31Å; W260-I278 HydrophobicContact CZ2-CD1 4.49Å; V274-I278 HydrophobicContact CG1-CD1 4.08Å; V274-I278 WeakPolarHBondContact O-CG1 3.34Å; V274-I278 PolarHBondContact O-N 3.19Å; F275-I278 PolarHBondContact O-N 3.43Å; A276-I278 VanDerWaalsContact C-N 3.35Å; I278-L280 VanDerWaalsContact C-N 3.31Å; I278-L280 PolarHBondContact O-N 3.49Å; I278-F281 WeakPolarHBondContact O-CB 3.47Å; I278-F281 PolarHBondContact O-N 3.2Å; I278-F281 VanDerWaalsContact O-N 3.15Å; I278-F282 HydrophobicContact CG2-CD2 4Å; I278-F282 HydrophobicContact CG2-CE2 3.56Å; I278-F282 HydrophobicContact CG2-CZ 4.45Å; I278-F282 VanDerWaalsContact O-CD2 3.25Å; I278-F282 WeakPolarHBondContact O-CD2 3.32Å; I278-F282 PolarHBondContact O-N 2.9Å
279L98.1Very high96.2Very high64 Ų6442.7 Ų42.734%0.33520%0.202SC..Hα-helixtrans-60-42173.7-69.6-177.3000112I171 F275 A276 F281 F282 L283I171-L279 HydrophobicContact CD1-CB 3.97Å; I171-L279 HydrophobicContact CD1-CD1 4.38Å; F275-L279 HydrophobicContact CD1-CD1 3.97Å; F275-L279 HydrophobicContact CD1-CG 4.33Å; F275-L279 HydrophobicContact CE1-CD1 3.45Å; F275-L279 VanDerWaalsContact CE1-CD1 3.45Å; F275-L279 HydrophobicContact CE1-CD2 4.43Å; F275-L279 HydrophobicContact CE1-CG 3.97Å; F275-L279 HydrophobicContact CZ-CD1 3.96Å; F275-L279 HydrophobicContact CZ-CD2 4.1Å; F275-L279 HydrophobicContact CZ-CG 4.11Å; F275-L279 WeakPolarHBondContact O-CG 3.4Å; F275-L279 PolarHBondContact O-N 3.32Å; A276-L279 PolarHBondContact O-N 3.4Å; L279-F281 VanDerWaalsContact C-N 3.29Å; L279-F281 PolarHBondContact O-N 2.77Å; L279-F282 PolarHBondContact O-N 3.27Å; L279-L283 PolarHBondContact O-N 2.66Å
280L98.1Very high96.2Very high2 Ų243.7 Ų43.71%0.0121%0.206CC..Hα-helixtrans-62.5-38.5175.5-175.458.6000111.4H168 I171 T172 L175 A276 L277 I278 L283 H284H168-L280 WeakPolarHBondContact ND1-CD1 3.1Å; I171-L280 HydrophobicContact CG2-CB 4.1Å; T172-L280 HydrophobicContact CG2-CD1 4.06Å; T172-L280 HydrophobicContact CG2-CD2 4.11Å; L175-L280 HydrophobicContact CD1-CB 4.38Å; L175-L280 HydrophobicContact CD1-CD2 3.79Å; A276-L280 WeakPolarHBondContact O-CB 3.27Å; A276-L280 PolarHBondContact O-N 3.06Å; L277-L280 PolarHBondContact O-N 3.28Å; I278-L280 VanDerWaalsContact C-N 3.31Å; I278-L280 PolarHBondContact O-N 3.49Å; L280-L283 WeakPolarHBondContact O-CB 3.35Å; L280-L283 PolarHBondContact O-N 2.87Å; L280-H284 PolarHBondContact O-N 3.44Å; L280-H284 VanDerWaalsContact O-N 3.07Å
281F98.4Very high96.2Very high48 Ų4843.8 Ų43.821%0.21121%0.207CC..Hα-helixtrans-62.1-41.7173.6-175.3-124.5000112.9L234 Y237 P238 I242 L277 I278 L279 L283 H284 I285L234-F281 HydrophobicContact CD2-CE2 4.33Å; Y237-F281 HydrophobicContact CD1-CB 4.3Å; Y237-F281 HydrophobicContact CD1-CD2 4.01Å; Y237-F281 HydrophobicContact CE1-CB 3.9Å; Y237-F281 HydrophobicContact CE1-CD2 4.45Å; P238-F281 HydrophobicContact CB-CD2 4.22Å; P238-F281 HydrophobicContact CB-CE1 4.2Å; P238-F281 HydrophobicContact CB-CE2 3.78Å; P238-F281 HydrophobicContact CB-CZ 3.76Å; P238-F281 HydrophobicContact CG-CD2 4.32Å; P238-F281 HydrophobicContact CG-CE2 3.59Å; P238-F281 HydrophobicContact CG-CZ 3.81Å; I242-F281 HydrophobicContact CD1-CB 3.97Å; I242-F281 HydrophobicContact CD1-CG 4.41Å; L277-F281 PolarHBondContact O-N 2.97Å; I278-F281 WeakPolarHBondContact O-CB 3.47Å; I278-F281 PolarHBondContact O-N 3.2Å; I278-F281 VanDerWaalsContact O-N 3.15Å; L279-F281 VanDerWaalsContact C-N 3.29Å; L279-F281 PolarHBondContact O-N 2.77Å; F281-L283 VanDerWaalsContact C-N 3.26Å; F281-L283 PolarHBondContact O-N 2.78Å; F281-H284 HydrophobicContact CD2-CB 4.45Å; F281-H284 WeakPolarHBondContact O-CA 3.35Å; F281-H284 VanDerWaalsContact O-CB 3.32Å; F281-H284 WeakPolarHBondContact O-CB 3.45Å; F281-H284 PolarHBondContact O-N 3.19Å; F281-I285 HydrophobicContact CE1-CD1 4.21Å; F281-I285 HydrophobicContact CE1-CG1 4.21Å; F281-I285 HydrophobicContact CE2-CD1 3.91Å; F281-I285 HydrophobicContact CE2-CG1 4.38Å; F281-I285 HydrophobicContact CZ-CD1 3.68Å; F281-I285 HydrophobicContact CZ-CG1 4.15Å; F281-I285 WeakPolarHBondContact O-CG1 3.33Å; F281-I285 PolarHBondContact O-N 2.61Å
282F98.3Very high96.3Very high132 Ų13246.7 Ų46.758%0.57922%0.224SC*.Hα-helixtrans-59.8-37.3175.3-76.9-62.9000112.6I278 L279 I285 F286I278-F282 HydrophobicContact CG2-CD2 4Å; I278-F282 HydrophobicContact CG2-CE2 3.56Å; I278-F282 HydrophobicContact CG2-CZ 4.45Å; I278-F282 VanDerWaalsContact O-CD2 3.25Å; I278-F282 WeakPolarHBondContact O-CD2 3.32Å; I278-F282 PolarHBondContact O-N 2.9Å; L279-F282 PolarHBondContact O-N 3.27Å; F282-I285 PolarHBondContact O-N 3Å; F282-F286 PolarHBondContact O-N 3.17Å
283L97.3Very high96.1Very high22 Ų2247.8 Ų47.812%0.11522%0.221CC..Hα-helixtrans-64.7-39.4172.5-69.5168.1000111.7Q164 V167 H168 I171 L279 L280 F281 I285 F286 W287Q164-L283 HydrophobicContact CB-CD2 4.32Å; V167-L283 HydrophobicContact CG1-CD1 4.33Å; H168-L283 HydrophobicContact CB-CD1 3.99Å; I171-L283 HydrophobicContact CD1-CD1 4.05Å; L279-L283 PolarHBondContact O-N 2.66Å; L280-L283 WeakPolarHBondContact O-CB 3.35Å; L280-L283 PolarHBondContact O-N 2.87Å; F281-L283 VanDerWaalsContact C-N 3.26Å; F281-L283 PolarHBondContact O-N 2.78Å; L283-I285 VanDerWaalsContact C-N 3.32Å; L283-I285 PolarHBondContact O-N 3.25Å; L283-F286 WeakPolarHBondContact O-CB 3.33Å; L283-F286 PolarHBondContact O-N 2.73Å; L283-W287 VanDerWaalsContact C-CE3 3.43Å; L283-W287 HydrophobicContact CB-CE3 4.03Å; L283-W287 HydrophobicContact CB-CH2 4.03Å; L283-W287 HydrophobicContact CB-CZ3 3.54Å; L283-W287 PolarHBondContact O-N 3.16Å
284H97.9Very high95.6Very high0 Ų048.1 Ų48.10%022%0.223CC..Hα-helixtrans-59.5-41.5172.6-58154.7000112.2H195 R233 Y237 L280 F281 W287 T288H195-H284 AromaticContact NE2-CE1 3.32Å; H195-H284 PolarHBondContact NE2-CE1 3.46Å; H195-H284 VanDerWaalsContact NE2-CE1 3.32Å; H195-H284 AromaticContact NE2-NE2 3.69Å; R233-H284 HydrophobicContact CB-CB 4.24Å; R233-H284 PolarHBondContact NH1-CD2 2.94Å; R233-H284 PolarHBondContact NH1-NE2 3.42Å; Y237-H284 AromaticContact CD1-CE1 3.92Å; Y237-H284 AromaticContact CD1-ND1 3.69Å; Y237-H284 AromaticContact CE1-CE1 3.78Å; Y237-H284 AromaticContact CE1-ND1 3.79Å; L280-H284 PolarHBondContact O-N 3.44Å; L280-H284 VanDerWaalsContact O-N 3.07Å; F281-H284 HydrophobicContact CD2-CB 4.45Å; F281-H284 WeakPolarHBondContact O-CA 3.35Å; F281-H284 VanDerWaalsContact O-CB 3.32Å; F281-H284 WeakPolarHBondContact O-CB 3.45Å; F281-H284 PolarHBondContact O-N 3.19Å; H284-W287 PolarHBondContact O-N 2.73Å; H284-T288 WeakPolarHBondContact O-CB 3.47Å; H284-T288 PolarHBondContact O-N 2.72Å; H284-T288 PolarHBondContact O-OG1 3.41Å
285I98.1Very high95.2Very high77 Ų7748.7 Ų48.740%0.39523%0.229SC..Hα-helixtrans-62.5-44.5174.8-60.2-53.6000111L234 F281 F282 L283 W287 T288 F289L234-I285 HydrophobicContact CD2-CD1 3.69Å; F281-I285 HydrophobicContact CE1-CD1 4.21Å; F281-I285 HydrophobicContact CE1-CG1 4.21Å; F281-I285 HydrophobicContact CE2-CD1 3.91Å; F281-I285 HydrophobicContact CE2-CG1 4.38Å; F281-I285 HydrophobicContact CZ-CD1 3.68Å; F281-I285 HydrophobicContact CZ-CG1 4.15Å; F281-I285 WeakPolarHBondContact O-CG1 3.33Å; F281-I285 PolarHBondContact O-N 2.61Å; F282-I285 PolarHBondContact O-N 3Å; L283-I285 VanDerWaalsContact C-N 3.32Å; L283-I285 PolarHBondContact O-N 3.25Å; I285-W287 PolarHBondContact O-N 3.15Å; I285-T288 WeakPolarHBondContact O-CB 3.35Å; I285-T288 PolarHBondContact O-N 2.87Å; I285-F289 PolarHBondContact O-N 2.73Å
286F96.4Very high94.8Very high74 Ų7451 Ų5133%0.32524%0.235SC..Hα-helixtrans-56.2-50.2175.6167-96.8000112.2Q164 F282 L283 T288 F289 I290Q164-F286 HydrophobicContact CB-CD1 4.47Å; Q164-F286 HydrophobicContact CB-CE1 4.01Å; Q164-F286 HydrophobicContact CG-CD1 4.25Å; Q164-F286 HydrophobicContact CG-CE1 3.69Å; Q164-F286 HydrophobicContact CG-CZ 3.85Å; F282-F286 PolarHBondContact O-N 3.17Å; L283-F286 WeakPolarHBondContact O-CB 3.33Å; L283-F286 PolarHBondContact O-N 2.73Å; F286-T288 VanDerWaalsContact C-N 3.34Å; F286-T288 PolarHBondContact O-N 3.37Å; F286-F289 WeakPolarHBondContact O-CB 3.28Å; F286-F289 PolarHBondContact O-N 2.91Å; F286-I290 HydrophobicContact CD1-CD1 4.23Å; F286-I290 HydrophobicContact CE1-CD1 3.54Å; F286-I290 HydrophobicContact CE2-CD1 4.26Å; F286-I290 HydrophobicContact CZ-CD1 3.57Å; F286-I290 PolarHBondContact O-N 3.44Å
287W96Very high93.9Very high12 Ų1255.2 Ų55.25%0.04525%0.25CC..Hα-helixtrans-69.7-32178.8-72.3-52.5000113.1D161 Q164 L165 H168 W229 L283 H284 I285 F289 I290 I291D161-W287 PolarHBondContact OD2-NE1 3.08Å; Q164-W287 HydrophobicContact CB-CZ2 4.4Å; L165-W287 HydrophobicContact CD1-CZ2 4.42Å; H168-W287 HydrophobicContact CB-CH2 3.59Å; H168-W287 HydrophobicContact CB-CZ2 4.37Å; H168-W287 AromaticContact CG-CH2 3.65Å; H168-W287 AromaticContact ND1-CH2 3.72Å; H168-W287 AromaticContact ND1-CZ3 3.89Å; W229-W287 HydrophobicContact CH2-CB 3.91Å; W229-W287 HydrophobicContact CH2-CE3 4.18Å; W229-W287 HydrophobicContact CZ2-CB 3.71Å; L283-W287 VanDerWaalsContact C-CE3 3.43Å; L283-W287 HydrophobicContact CB-CE3 4.03Å; L283-W287 HydrophobicContact CB-CH2 4.03Å; L283-W287 HydrophobicContact CB-CZ3 3.54Å; L283-W287 PolarHBondContact O-N 3.16Å; H284-W287 PolarHBondContact O-N 2.73Å; I285-W287 PolarHBondContact O-N 3.15Å; W287-F289 VanDerWaalsContact C-N 3.29Å; W287-F289 PolarHBondContact O-N 3.4Å; W287-I290 PolarHBondContact O-N 3.35Å; W287-I290 VanDerWaalsContact O-N 3.1Å; W287-I291 WeakPolarHBondContact O-CD1 3.43Å; W287-I291 VanDerWaalsContact O-CG1 3.24Å; W287-I291 WeakPolarHBondContact O-CG1 3.44Å; W287-I291 PolarHBondContact O-N 2.8Å
288T96.6Very high92.8Very high12 Ų1255.7 Ų55.77%0.07425%0.253CS..Hα-helixtrans-58-44172.9-60.90000110.7W229 L234 H284 I285 F286 I290 I291 L292W229-T288 PolarHBondContact NE1-OG1 3.38Å; L234-T288 HydrophobicContact CD1-CG2 3.64Å; H284-T288 WeakPolarHBondContact O-CB 3.47Å; H284-T288 PolarHBondContact O-N 2.72Å; H284-T288 PolarHBondContact O-OG1 3.41Å; I285-T288 WeakPolarHBondContact O-CB 3.35Å; I285-T288 PolarHBondContact O-N 2.87Å; F286-T288 VanDerWaalsContact C-N 3.34Å; F286-T288 PolarHBondContact O-N 3.37Å; T288-I290 VanDerWaalsContact C-N 3.3Å; T288-I290 PolarHBondContact O-N 3.02Å; T288-I291 PolarHBondContact O-N 3.36Å; T288-L292 HydrophobicContact CG2-CD1 4.02Å; T288-L292 HydrophobicContact CG2-CG 4.31Å; T288-L292 WeakPolarHBondContact O-CB 3.33Å; T288-L292 WeakPolarHBondContact O-CG 3.46Å; T288-L292 PolarHBondContact O-N 3.06Å
289F95.3Very high91.7Very high139 Ų13958.5 Ų58.561%0.6128%0.277SS*.Hα-helixtrans-58.3-42.4174.9177.2-98.9000112I285 F286 W287 L292 R293I285-F289 PolarHBondContact O-N 2.73Å; F286-F289 WeakPolarHBondContact O-CB 3.28Å; F286-F289 PolarHBondContact O-N 2.91Å; W287-F289 VanDerWaalsContact C-N 3.29Å; W287-F289 PolarHBondContact O-N 3.4Å; F289-L292 PolarHBondContact O-N 3.37Å; F289-R293 WeakPolarHBondContact O-CB 2.94Å; F289-R293 PolarHBondContact O-N 2.9Å
290I92.1Very high90.6Very high24 Ų2459.9 Ų59.912%0.12329%0.288CS..Hα-helixtrans-65.4-43176.5-60.9169.2000111.4F286 W287 T288 R293 I294 R308F286-I290 HydrophobicContact CD1-CD1 4.23Å; F286-I290 HydrophobicContact CE1-CD1 3.54Å; F286-I290 HydrophobicContact CE2-CD1 4.26Å; F286-I290 HydrophobicContact CZ-CD1 3.57Å; F286-I290 PolarHBondContact O-N 3.44Å; W287-I290 PolarHBondContact O-N 3.35Å; W287-I290 VanDerWaalsContact O-N 3.1Å; T288-I290 VanDerWaalsContact C-N 3.3Å; T288-I290 PolarHBondContact O-N 3.02Å; I290-R293 WeakPolarHBondContact O-CB 3.48Å; I290-R293 PolarHBondContact O-N 3.08Å; I290-I294 HydrophobicContact CG2-CD1 4.08Å; I290-I294 WeakPolarHBondContact O-CG1 3.32Å; I290-I294 PolarHBondContact O-N 2.75Å; I290-R308 HydrophobicContact CG2-CG 3.9Å; I290-R308 VanDerWaalsContact CG2-NE 3.27Å
291I92.1Very high88.8Confident4 Ų462.7 Ų62.72%0.02132%0.317CS..Hα-helixtrans-64-42.8179.5-63.9158.2000110.5F222 F225 F226 W229 W287 T288 R293 I294 A295F222-I291 HydrophobicContact CE2-CG2 4.39Å; F222-I291 HydrophobicContact CZ-CG2 4.23Å; F225-I291 HydrophobicContact CE1-CD1 3.95Å; F225-I291 HydrophobicContact CE1-CG1 4.01Å; F225-I291 HydrophobicContact CE1-CG2 3.91Å; F225-I291 HydrophobicContact CZ-CD1 3.58Å; F225-I291 HydrophobicContact CZ-CG1 4.08Å; F226-I291 HydrophobicContact CD2-CG2 3.56Å; F226-I291 HydrophobicContact CE2-CG2 4.06Å; W229-I291 HydrophobicContact CD2-CD1 3.75Å; W229-I291 HydrophobicContact CE3-CD1 4.27Å; W229-I291 HydrophobicContact CG-CD1 4.07Å; W229-I291 HydrophobicContact CH2-CD1 4.47Å; W229-I291 HydrophobicContact CZ2-CD1 3.99Å; W287-I291 WeakPolarHBondContact O-CD1 3.43Å; W287-I291 VanDerWaalsContact O-CG1 3.24Å; W287-I291 WeakPolarHBondContact O-CG1 3.44Å; W287-I291 PolarHBondContact O-N 2.8Å; T288-I291 PolarHBondContact O-N 3.36Å; I291-R293 VanDerWaalsContact C-N 3.32Å; I291-R293 PolarHBondContact O-N 3.46Å; I291-I294 WeakPolarHBondContact O-CB 3.48Å; I291-I294 PolarHBondContact O-N 3.44Å; I291-A295 PolarHBondContact O-N 2.61Å
292L92.8Very high86.9Confident85 Ų8563.1 Ų63.145%0.44534%0.335SS..Hα-helixtrans-62.5-38.8175-72.6173.5000111.9F226 T288 F289 I294 A295 Y296F226-L292 HydrophobicContact CE2-CD2 3.87Å; F226-L292 HydrophobicContact CE2-CG 4.48Å; F226-L292 HydrophobicContact CZ-CD2 3.65Å; T288-L292 HydrophobicContact CG2-CD1 4.02Å; T288-L292 HydrophobicContact CG2-CG 4.31Å; T288-L292 WeakPolarHBondContact O-CB 3.33Å; T288-L292 WeakPolarHBondContact O-CG 3.46Å; T288-L292 PolarHBondContact O-N 3.06Å; F289-L292 PolarHBondContact O-N 3.37Å; L292-I294 VanDerWaalsContact C-N 3.32Å; L292-I294 PolarHBondContact O-N 3.45Å; L292-A295 PolarHBondContact O-N 2.93Å; L292-Y296 WeakPolarHBondContact O-CB 3.07Å; L292-Y296 PolarHBondContact O-N 3.28Å
293R89.4Confident84.9Confident118 Ų11861.2 Ų61.245%0.44533%0.328SS..Hα-helixtrans-62-40.2174.1-171.7-178-175.4-169.12.6111.9F289 I290 I291 R297F289-R293 WeakPolarHBondContact O-CB 2.94Å; F289-R293 PolarHBondContact O-N 2.9Å; I290-R293 WeakPolarHBondContact O-CB 3.48Å; I290-R293 PolarHBondContact O-N 3.08Å; I291-R293 VanDerWaalsContact C-N 3.32Å; I291-R293 PolarHBondContact O-N 3.46Å; R293-R297 WeakPolarHBondContact O-CG 3.38Å; R293-R297 PolarHBondContact O-N 2.94Å
294I86.2Confident82.9Confident15 Ų1560.9 Ų60.98%0.07733%0.328CS..Hα-helixtrans-64.6-47.5173.7-67.5162.1000110F222 I290 I291 L292 Y296 R297 T298 K305 D306 V307F222-I294 HydrophobicContact CE2-CG2 3.96Å; F222-I294 HydrophobicContact CZ-CG2 4.37Å; I290-I294 HydrophobicContact CG2-CD1 4.08Å; I290-I294 WeakPolarHBondContact O-CG1 3.32Å; I290-I294 PolarHBondContact O-N 2.75Å; I291-I294 WeakPolarHBondContact O-CB 3.48Å; I291-I294 PolarHBondContact O-N 3.44Å; L292-I294 VanDerWaalsContact C-N 3.32Å; L292-I294 PolarHBondContact O-N 3.45Å; I294-Y296 PolarHBondContact O-N 2.72Å; I294-R297 PolarHBondContact O-N 3.02Å; I294-T298 PolarHBondContact O-N 3.42Å; I294-T298 PolarHBondContact O-OG1 3.36Å; I294-K305 WeakPolarHBondContact CG2-O 3.23Å; I294-D306 HydrophobicContact CD1-CB 4.43Å; I294-V307 HydrophobicContact CG1-CB 4.23Å; I294-V307 HydrophobicContact CG1-CG2 3.76Å
295A87.1Confident80.8Confident18 Ų1866.3 Ų66.315%0.14935%0.352CS..Hα-helixtrans-57.2-49178.500000111.6F222 I291 L292 R297 T298 S299F222-A295 HydrophobicContact CE1-CB 3.86Å; F222-A295 HydrophobicContact CZ-CB 3.77Å; I291-A295 PolarHBondContact O-N 2.61Å; L292-A295 PolarHBondContact O-N 2.93Å; A295-R297 PolarHBondContact O-N 2.66Å; A295-T298 VanDerWaalsContact O-CB 3.25Å; A295-T298 WeakPolarHBondContact O-CB 3.46Å; A295-T298 PolarHBondContact O-N 2.68Å; A295-T298 VanDerWaalsContact O-N 3.12Å; A295-S299 PolarHBondContact O-N 3.37Å; A295-S299 PolarHBondContact O-OG 3.46Å
296Y85.5Confident78.8Confident164 Ų16463.6 Ų63.664%0.64334%0.338SS*.Hα-helixtrans-58.2-49.2178.7178.7-99.5000111.9L292 I294 T298 S299 T300L292-Y296 WeakPolarHBondContact O-CB 3.07Å; L292-Y296 PolarHBondContact O-N 3.28Å; I294-Y296 PolarHBondContact O-N 2.72Å; Y296-T298 VanDerWaalsContact C-N 3.25Å; Y296-T298 PolarHBondContact O-N 2.74Å; Y296-S299 PolarHBondContact O-N 2.82Å; Y296-T300 HydrophobicContact CD2-CG2 4.35Å; Y296-T300 HydrophobicContact CE1-CG2 4.16Å; Y296-T300 HydrophobicContact CE2-CG2 3.91Å; Y296-T300 PolarHBondContact O-N 2.8Å; Y296-T300 PolarHBondContact O-OG1 3.41Å
297R79.9Confident76.6Confident95 Ų9561.1 Ų61.136%0.35833%0.329SS..Hα-helixtrans-60.8-35.7176.8-74.3179172.6-164.1-3.2112.5R293 I294 A295 G301 D310R293-R297 WeakPolarHBondContact O-CG 3.38Å; R293-R297 PolarHBondContact O-N 2.94Å; I294-R297 PolarHBondContact O-N 3.02Å; A295-R297 PolarHBondContact O-N 2.66Å; R297-G301 WeakPolarHBondContact O-CA 3.4Å; R297-G301 PolarHBondContact O-N 3.12Å; R297-D310 IonicContact NH1-OD2 3.81Å
298T75.2Confident74.4Confident17 Ų1762.5 Ų62.510%0.10433%0.334CS..Hα-helixtrans-63-47.5175.6-51.30000111.2I294 A295 Y296 G302 Q303 A304I294-T298 PolarHBondContact O-N 3.42Å; I294-T298 PolarHBondContact O-OG1 3.36Å; A295-T298 VanDerWaalsContact O-CB 3.25Å; A295-T298 WeakPolarHBondContact O-CB 3.46Å; A295-T298 PolarHBondContact O-N 2.68Å; A295-T298 VanDerWaalsContact O-N 3.12Å; Y296-T298 VanDerWaalsContact C-N 3.25Å; Y296-T298 PolarHBondContact O-N 2.74Å; T298-G302 WeakPolarHBondContact O-CA 3.29Å; T298-G302 PolarHBondContact O-N 3.01Å; T298-Q303 WeakPolarHBondContact CA-O 3.32Å; T298-A304 HydrophobicContact CG2-CB 3.74Å; T298-A304 WeakPolarHBondContact OG1-CA 3.39Å; T298-A304 WeakPolarHBondContact OG1-CB 3.43Å
299S74.4Confident72.1Confident107 Ų10763.3 Ų63.375%0.74834%0.341SS*.Hα-helixtrans-69.6-33.5-177.3-60.60000112.9A295 Y296A295-S299 PolarHBondContact O-N 3.37Å; A295-S299 PolarHBondContact O-OG 3.46Å; Y296-S299 PolarHBondContact O-N 2.82Å
300T74.9Confident69.5Low93 Ų9359.5 Ų59.557%0.57133%0.327SS*.Hα-helixtrans-91.5-23.1-179.762.90000114.1Y296Y296-T300 HydrophobicContact CD2-CG2 4.35Å; Y296-T300 HydrophobicContact CE1-CG2 4.16Å; Y296-T300 HydrophobicContact CE2-CG2 3.91Å; Y296-T300 PolarHBondContact O-N 2.8Å; Y296-T300 PolarHBondContact O-OG1 3.41Å
301G61.2Low67Low61 Ų6161.7 Ų61.763%0.62934%0.344SS*.Hα-helixtrans-121.23.2-172.500000115.6R297 Q303R297-G301 WeakPolarHBondContact O-CA 3.4Å; R297-G301 PolarHBondContact O-N 3.12Å; G301-Q303 VanDerWaalsContact C-N 3.33Å; G301-Q303 PolarHBondContact O-N 2.69Å
302G57.2Low64.6Low56 Ų5663.4 Ų63.458%0.57735%0.353SS*.SBendtrans76.24.3171.600000116.6T298T298-G302 WeakPolarHBondContact O-CA 3.29Å; T298-G302 PolarHBondContact O-N 3.01Å
303Q57.3Low62.2Low92 Ų9260.6 Ų60.643%0.4334%0.341SS..SBendtrans-143.6132.7175.7-68.1-169-4.700113.7T298 G301 K305T298-Q303 WeakPolarHBondContact CA-O 3.32Å; G301-Q303 VanDerWaalsContact C-N 3.33Å; G301-Q303 PolarHBondContact O-N 2.69Å; Q303-K305 VanDerWaalsContact C-N 3.26Å; Q303-K305 HydrophobicContact CB-CG 4.2Å; Q303-K305 PolarHBondContact O-N 2.71Å; Q303-K305 VanDerWaalsContact OE1-CE 3.24Å
304A55.2Low59.8Low15 Ų1558.7 Ų58.712%0.12434%0.339CS..  trans-73.675.8171.100000112T298T298-A304 HydrophobicContact CG2-CB 3.74Å; T298-A304 WeakPolarHBondContact OG1-CA 3.39Å; T298-A304 WeakPolarHBondContact OG1-CB 3.43Å
305K54.5Low57.5Low115 Ų11565.1 Ų65.150%0.536%0.364SS..  trans-85.5123.9173.4-68.2-170.9176.8-172.40110I294 Q303 V307I294-K305 WeakPolarHBondContact CG2-O 3.23Å; Q303-K305 VanDerWaalsContact C-N 3.26Å; Q303-K305 HydrophobicContact CB-CG 4.2Å; Q303-K305 PolarHBondContact O-N 2.71Å; Q303-K305 VanDerWaalsContact OE1-CE 3.24Å; K305-V307 PolarHBondContact O-N 3.17Å
306D54.4Low55.4Low20 Ų2068.8 Ų68.811%0.10738%0.381CS..  trans-73.5116.8175.1175.57.6000109.7R209 I294 R308 S309R209-D306 IonicContact NH1-OD2 3.6Å; I294-D306 HydrophobicContact CD1-CB 4.43Å; D306-R308 PolarHBondContact O-N 3.2Å; D306-R308 VanDerWaalsContact OD1-CB 3.25Å; D306-R308 WeakPolarHBondContact OD1-CB 3.49Å; D306-R308 WeakPolarHBondContact OD1-CG 3.49Å; D306-R308 PolarHBondContact OD1-N 2.73Å; D306-S309 PolarHBondContact O-N 3.48Å; D306-S309 PolarHBondContact O-OG 2.8Å
307V52Low53.5Low22 Ų2264.5 Ų64.513%0.13337%0.367CS..THydrogen-bonded Turntrans-67.8-19.9-178.3-177.10000111.2I294 K305 S309 D310I294-V307 HydrophobicContact CG1-CB 4.23Å; I294-V307 HydrophobicContact CG1-CG2 3.76Å; K305-V307 PolarHBondContact O-N 3.17Å; V307-S309 VanDerWaalsContact C-N 3.34Å; V307-D310 PolarHBondContact O-N 2.97Å
308R49.4Very low51.9Low40 Ų4065.9 Ų65.915%0.15138%0.377CS..THydrogen-bonded Turntrans-77.5-21.6177.9-52-178.2-165.7-178.68.9112.6S160 D161 I290 D306S160-R308 PolarHBondContact OG-O 3.29Å; D161-R308 WeakPolarHBondContact OD2-CD 3.44Å; D161-R308 IonicContact OD2-CZ 3.81Å; D161-R308 IonicContact OD2-NE 2.64Å; D161-R308 IonicContact OD2-NH1 3.16Å; D161-R308 PolarHBondContact OD2-NH1 3Å; I290-R308 HydrophobicContact CG2-CG 3.9Å; I290-R308 VanDerWaalsContact CG2-NE 3.27Å; D306-R308 PolarHBondContact O-N 3.2Å; D306-R308 VanDerWaalsContact OD1-CB 3.25Å; D306-R308 WeakPolarHBondContact OD1-CB 3.49Å; D306-R308 WeakPolarHBondContact OD1-CG 3.49Å; D306-R308 PolarHBondContact OD1-N 2.73Å
309S47.7Very low50.6Low30 Ų3069 Ų6921%0.2139%0.39CS..THydrogen-bonded Turntrans-88-14.2172.748.20000113.9D306 V307 S311 D312D306-S309 PolarHBondContact O-N 3.48Å; D306-S309 PolarHBondContact O-OG 2.8Å; V307-S309 VanDerWaalsContact C-N 3.34Å; S309-S311 VanDerWaalsContact C-N 3.27Å; S309-S311 PolarHBondContact O-N 3.07Å; S309-D312 PolarHBondContact O-N 3.29Å
310D41.3Very low49.4Very low59 Ų5969.5 Ų69.532%0.31638%0.383SS..THydrogen-bonded Turntrans-69.9-20.1-178.4-101.2-15.4000113.1R297 V307R297-D310 IonicContact NH1-OD2 3.81Å; V307-D310 PolarHBondContact O-N 2.97Å
311S38.8Very low48.5Very low70 Ų7067 Ų6749%0.4937%0.371SS..THydrogen-bonded Turntrans-92.7-10.1175.257.50000114.1S160 S309S160-S311 WeakPolarHBondContact CB-OG 3.43Å; S309-S311 VanDerWaalsContact C-N 3.27Å; S309-S311 PolarHBondContact O-N 3.07Å
312D41.8Very low48.6Very low40 Ų4071.5 Ų71.521%0.21437%0.369CS..THydrogen-bonded Turntrans-124.894.7-170.3-68.9-53.8000111.3K88 R159 S160 S309 D314K88-D312 PolarHBondContact NZ-O 3.21Å; R159-D312 WeakPolarHBondContact CA-OD2 3.4Å; S160-D312 PolarHBondContact N-OD2 3.27Å; S309-D312 PolarHBondContact O-N 3.29Å; D312-D314 VanDerWaalsContact C-N 3.31Å; D312-D314 PolarHBondContact O-N 3.11Å
313S42Very low48.9Very low26 Ų2675.2 Ų75.218%0.18237%0.366CS..THydrogen-bonded Turntrans67.8-8153.393.70000120K88 Y315 D316 E317K88-S313 PolarHBondContact NZ-OG 3.26Å; S313-Y315 VanDerWaalsContact C-N 3.33Å; S313-D316 PolarHBondContact O-N 3.07Å; S313-E317 VanDerWaalsContact O-CB 3.31Å; S313-E317 WeakPolarHBondContact O-CB 3Å; S313-E317 PolarHBondContact O-N 3.29Å
314D38.7Very low49.4Very low77 Ų7776.9 Ų76.941%0.41237%0.373SS..Hα-helixtrans-70.8-35.4171.2-88.85.9000110.4D312 E318D312-D314 VanDerWaalsContact C-N 3.31Å; D312-D314 PolarHBondContact O-N 3.11Å; D314-E318 VanDerWaalsContact O-CB 3.27Å; D314-E318 WeakPolarHBondContact O-CB 3.46Å; D314-E318 WeakPolarHBondContact O-CG 3.27Å; D314-E318 PolarHBondContact O-N 3.12Å; D314-E318 VanDerWaalsContact O-N 3.08Å
315Y39Very low50.3Low150 Ų15084.4 Ų84.459%0.58840%0.399SS*.Hα-helixtrans-65.5-44.2167.6-75.5-84.7000111.5S313 E319S313-Y315 VanDerWaalsContact C-N 3.33Å; Y315-E319 WeakPolarHBondContact O-CA 3.15Å; Y315-E319 WeakPolarHBondContact O-CB 3.37Å; Y315-E319 PolarHBondContact O-N 3.36Å
316D42Very low51.3Low95 Ų9582.3 Ų82.351%0.50840%0.395SS..Hα-helixtrans-72.6-38.1-177.7-62.5-48.4000113S313 M320S313-D316 PolarHBondContact O-N 3.07Å; D316-M320 WeakPolarHBondContact O-CA 3.37Å; D316-M320 WeakPolarHBondContact O-CB 3.49Å; D316-M320 WeakPolarHBondContact O-CG 3.36Å; D316-M320 PolarHBondContact O-N 3.26Å
317E45.8Very low52.4Low75 Ų7590.6 Ų90.635%0.3543%0.425SS..Hα-helixtrans-70.7-43.5175.2-81.8-170.5170.900111.2S313 A321S313-E317 VanDerWaalsContact O-CB 3.31Å; S313-E317 WeakPolarHBondContact O-CB 3Å; S313-E317 PolarHBondContact O-N 3.29Å; E317-A321 WeakPolarHBondContact O-CB 3.5Å; E317-A321 PolarHBondContact O-N 2.9Å
318E47.3Very low53.5Low124 Ų12494.5 Ų94.558%0.57945%0.445SS*.Hα-helixtrans-64.5-41.5173.9-81-163.1172.300111.5D314 R322D314-E318 VanDerWaalsContact O-CB 3.27Å; D314-E318 WeakPolarHBondContact O-CB 3.46Å; D314-E318 WeakPolarHBondContact O-CG 3.27Å; D314-E318 PolarHBondContact O-N 3.12Å; D314-E318 VanDerWaalsContact O-N 3.08Å; E318-R322 VanDerWaalsContact O-CB 3.24Å; E318-R322 WeakPolarHBondContact O-CB 3.22Å; E318-R322 PolarHBondContact O-N 3.45Å; E318-R322 IonicContact OE2-NH2 3.42Å; E318-R322 PolarHBondContact OE2-NH2 2.7Å
319E46.8Very low54.9Low81 Ų8198 Ų9838%0.37947%0.466SS..Hα-helixtrans-70-41.1178.6-165.8-175.117300111.6Y315 R322 R323Y315-E319 WeakPolarHBondContact O-CA 3.15Å; Y315-E319 WeakPolarHBondContact O-CB 3.37Å; Y315-E319 PolarHBondContact O-N 3.36Å; E319-R322 CarbonylContact O-C 3.55Å; E319-R322 WeakPolarHBondContact O-CB 3.34Å; E319-R322 PolarHBondContact O-N 3.46Å; E319-R323 HydrophobicContact CG-CG 4.42Å; E319-R323 VanDerWaalsContact O-CB 3.32Å; E319-R323 WeakPolarHBondContact O-CB 3.26Å; E319-R323 WeakPolarHBondContact O-CG 3.06Å; E319-R323 PolarHBondContact O-N 3.49Å; E319-R323 IonicContact OE1-CZ 3.87Å; E319-R323 IonicContact OE1-NE 3.49Å; E319-R323 PolarHBondContact OE1-NE 3.48Å; E319-R323 IonicContact OE1-NH2 3.17Å; E319-R323 PolarHBondContact OE1-NH2 3Å; E319-R323 IonicContact OE2-NH2 2.62Å
320M50.9Low56.1Low119 Ų119103.5 Ų103.559%0.58649%0.486SS*.Hα-helixtrans-64.5-43.4174-73.5-76-8300111.1D316 R322 R323 E324D316-M320 WeakPolarHBondContact O-CA 3.37Å; D316-M320 WeakPolarHBondContact O-CB 3.49Å; D316-M320 WeakPolarHBondContact O-CG 3.36Å; D316-M320 PolarHBondContact O-N 3.26Å; M320-R322 VanDerWaalsContact C-N 3.29Å; M320-R322 PolarHBondContact O-N 3.1Å; M320-R323 PolarHBondContact O-N 2.84Å; M320-E324 WeakPolarHBondContact O-CB 3.36Å; M320-E324 PolarHBondContact O-N 3.36Å
321A55.7Low57.5Low40 Ų40108.4 Ų108.433%0.33151%0.505SS..Hα-helixtrans-64.4-33.7173.100000112E317 R325E317-A321 WeakPolarHBondContact O-CB 3.5Å; E317-A321 PolarHBondContact O-N 2.9Å; A321-R325 WeakPolarHBondContact O-CB 3.47Å; A321-R325 PolarHBondContact O-N 2.91Å
322R63.6Low59.1Low156 Ų156112.2 Ų112.259%0.58951%0.513SS*.Hα-helixtrans-69-43.7173.6-140.9176.6-68.9-133.91.4111.2E318 E319 M320 R325 T326E318-R322 VanDerWaalsContact O-CB 3.24Å; E318-R322 WeakPolarHBondContact O-CB 3.22Å; E318-R322 PolarHBondContact O-N 3.45Å; E318-R322 IonicContact OE2-NH2 3.42Å; E318-R322 PolarHBondContact OE2-NH2 2.7Å; E319-R322 CarbonylContact O-C 3.55Å; E319-R322 WeakPolarHBondContact O-CB 3.34Å; E319-R322 PolarHBondContact O-N 3.46Å; M320-R322 VanDerWaalsContact C-N 3.29Å; M320-R322 PolarHBondContact O-N 3.1Å; R322-R325 PolarHBondContact O-N 2.98Å; R322-T326 WeakPolarHBondContact O-CB 3.19Å; R322-T326 PolarHBondContact O-N 3.09Å; R322-T326 PolarHBondContact O-OG1 2.93Å
323R63.5Low60.3Low133 Ų133118.2 Ų118.250%0.50254%0.537SS..Hα-helixtrans-64.3-41.1177-74.9169.5178.9-166.81.1110.8E319 M320 T326 R327E319-R323 HydrophobicContact CG-CG 4.42Å; E319-R323 VanDerWaalsContact O-CB 3.32Å; E319-R323 WeakPolarHBondContact O-CB 3.26Å; E319-R323 WeakPolarHBondContact O-CG 3.06Å; E319-R323 PolarHBondContact O-N 3.49Å; E319-R323 IonicContact OE1-CZ 3.87Å; E319-R323 IonicContact OE1-NE 3.49Å; E319-R323 PolarHBondContact OE1-NE 3.48Å; E319-R323 IonicContact OE1-NH2 3.17Å; E319-R323 PolarHBondContact OE1-NH2 3Å; E319-R323 IonicContact OE2-NH2 2.62Å; M320-R323 PolarHBondContact O-N 2.84Å; R323-T326 PolarHBondContact O-N 2.95Å; R323-R327 WeakPolarHBondContact O-CB 3.03Å; R323-R327 WeakPolarHBondContact O-CG 2.86Å; R323-R327 PolarHBondContact O-N 3.48Å
324E66.8Low61.1Low127 Ų127123.3 Ų123.359%0.59356%0.562SS**Hα-helixtrans-69.3-44.3176.1-168.3172.1-169.700112.1M320 T326 R327 L328M320-E324 WeakPolarHBondContact O-CB 3.36Å; M320-E324 PolarHBondContact O-N 3.36Å; E324-T326 VanDerWaalsContact C-N 3.27Å; E324-T326 PolarHBondContact O-N 3.34Å; E324-R327 PolarHBondContact O-N 3.28Å; E324-L328 HydrophobicContact CG-CD1 4.33Å; E324-L328 WeakPolarHBondContact O-CG 3.34Å; E324-L328 PolarHBondContact O-N 2.94Å
325R75.1Confident61.8Low174 Ų174128.5 Ų128.566%0.65758%0.581SS**Hα-helixtrans-56.6-43.2171.2-118.8179.4-80.4-137.8-1.2111.6A321 R322 L328 L329A321-R325 WeakPolarHBondContact O-CB 3.47Å; A321-R325 PolarHBondContact O-N 2.91Å; R322-R325 PolarHBondContact O-N 2.98Å; R325-L328 PolarHBondContact O-N 2.92Å; R325-L329 WeakPolarHBondContact O-CB 3.35Å; R325-L329 WeakPolarHBondContact O-CG 3.38Å; R325-L329 PolarHBondContact O-N 2.78Å
326T75.1Confident62.4Low70 Ų70126.5 Ų126.543%0.42958%0.584SS.*Hα-helixtrans-66.5-39.6178.5-54.40000111.7R322 R323 E324 L329 K330R322-T326 WeakPolarHBondContact O-CB 3.19Å; R322-T326 PolarHBondContact O-N 3.09Å; R322-T326 PolarHBondContact O-OG1 2.93Å; R323-T326 PolarHBondContact O-N 2.95Å; E324-T326 VanDerWaalsContact C-N 3.27Å; E324-T326 PolarHBondContact O-N 3.34Å; T326-L329 PolarHBondContact O-N 3.25Å; T326-K330 WeakPolarHBondContact O-CB 3.33Å; T326-K330 PolarHBondContact O-N 3.47Å
327R76.1Confident62.4Low194 Ų194125.8 Ų125.873%0.73259%0.587SS**Hα-helixtrans-63.6-44.7173.6-79177.3178.2177.70111.9R323 E324 K330 K331R323-R327 WeakPolarHBondContact O-CB 3.03Å; R323-R327 WeakPolarHBondContact O-CG 2.86Å; R323-R327 PolarHBondContact O-N 3.48Å; E324-R327 PolarHBondContact O-N 3.28Å; R327-K330 PolarHBondContact O-N 2.72Å; R327-K331 WeakPolarHBondContact O-CB 3.39Å; R327-K331 PolarHBondContact O-N 2.84Å
328L76.5Confident62.1Low104 Ų104127 Ų12755%0.54560%0.601SS.*Hα-helixtrans-65.4-40.3177.7-70.5170.5000111.7E324 R325 K331 K332E324-L328 HydrophobicContact CG-CD1 4.33Å; E324-L328 WeakPolarHBondContact O-CG 3.34Å; E324-L328 PolarHBondContact O-N 2.94Å; R325-L328 PolarHBondContact O-N 2.92Å; L328-K331 PolarHBondContact O-N 3.29Å; L328-K332 WeakPolarHBondContact O-CB 3.23Å; L328-K332 PolarHBondContact O-N 3.33Å
329L77.6Confident62Low114 Ų114127 Ų12760%0.59761%0.614SS**Hα-helixtrans-64.2-42.8174.4-73.4167.2000112R325 T326 K332 K333R325-L329 WeakPolarHBondContact O-CB 3.35Å; R325-L329 WeakPolarHBondContact O-CG 3.38Å; R325-L329 PolarHBondContact O-N 2.78Å; T326-L329 PolarHBondContact O-N 3.25Å; L329-K332 PolarHBondContact O-N 3.18Å; L329-K333 WeakPolarHBondContact O-CB 3.14Å; L329-K333 PolarHBondContact O-N 3.18Å
330K73.6Confident61.5Low145 Ų145128.1 Ų128.163%0.6363%0.627SS**Hα-helixtrans-61.9-43.4172.7-81.1-174.6175.9-175.50112T326 R327 K332 K333 N334T326-K330 WeakPolarHBondContact O-CB 3.33Å; T326-K330 PolarHBondContact O-N 3.47Å; R327-K330 PolarHBondContact O-N 2.72Å; K330-K332 VanDerWaalsContact C-N 3.29Å; K330-K332 PolarHBondContact O-N 2.84Å; K330-K333 PolarHBondContact O-N 3.02Å; K330-N334 PolarHBondContact O-N 3.14Å
331K71.5Confident60.7Low163 Ų163129.7 Ų129.771%0.70964%0.638SS**Hα-helixtrans-65.5-32.9177.9-158.5174-173.6177.90112R327 L328 K335R327-K331 WeakPolarHBondContact O-CB 3.39Å; R327-K331 PolarHBondContact O-N 2.84Å; L328-K331 PolarHBondContact O-N 3.29Å; K331-K335 WeakPolarHBondContact O-CB 3.44Å; K331-K335 PolarHBondContact O-N 2.82Å
332K71.8Confident59.8Low150 Ų150134.9 Ų134.965%0.65266%0.66SS**Hα-helixtrans-74.8-37.5174.8-149.2175.6-173.9-175.60111.7L328 L329 K330 K335 V336L328-K332 WeakPolarHBondContact O-CB 3.23Å; L328-K332 PolarHBondContact O-N 3.33Å; L329-K332 PolarHBondContact O-N 3.18Å; K330-K332 VanDerWaalsContact C-N 3.29Å; K330-K332 PolarHBondContact O-N 2.84Å; K332-K335 PolarHBondContact O-N 3.31Å; K332-V336 WeakPolarHBondContact O-CB 3.15Å; K332-V336 WeakPolarHBondContact O-CG2 3.46Å; K332-V336 PolarHBondContact O-N 3.33Å
333K67.6Low58.5Low165 Ų165134 Ų13472%0.71767%0.667SS**Hα-helixtrans-67-40.8176.5-156.2175.2-176.5-177.50112.2L329 K330 K335 V336 S337L329-K333 WeakPolarHBondContact O-CB 3.14Å; L329-K333 PolarHBondContact O-N 3.18Å; K330-K333 PolarHBondContact O-N 3.02Å; K333-K335 PolarHBondContact O-N 3.42Å; K333-V336 PolarHBondContact O-N 3.5Å; K333-S337 PolarHBondContact O-N 3.43Å
334N57.3Low57.1Low134 Ų134135.4 Ų135.472%0.71768%0.684SS**THydrogen-bonded Turntrans-71.9-12.9174.2-75.614.9000114K330K330-N334 PolarHBondContact O-N 3.14Å
335K54.6Low55.5Low185 Ų185136.3 Ų136.380%0.80469%0.693SS**THydrogen-bonded Turntrans-98.2-9.1176.1-131.4-178-177.1-1700113K331 K332 K333K331-K335 WeakPolarHBondContact O-CB 3.44Å; K331-K335 PolarHBondContact O-N 2.82Å; K332-K335 PolarHBondContact O-N 3.31Å; K333-K335 PolarHBondContact O-N 3.42Å
336V52Low53.5Low109 Ų109136.6 Ų136.666%0.66170%0.702SS**THydrogen-bonded Turntrans-115.32.3-175.7177.60000111.5K332 K333 P338K332-V336 WeakPolarHBondContact O-CB 3.15Å; K332-V336 WeakPolarHBondContact O-CG2 3.46Å; K332-V336 PolarHBondContact O-N 3.33Å; K333-V336 PolarHBondContact O-N 3.5Å; V336-P338 VanDerWaalsContact O-CD 3.22Å; V336-P338 WeakPolarHBondContact O-CD 3.41Å
337S41.5Very low51.4Low80 Ų80136.7 Ų136.756%0.55972%0.717SS**SBendtrans-84.7103.8157.250.30000108.3K333K333-S337 PolarHBondContact O-N 3.43Å
338P40Very low49.4Very low101 Ų101135.5 Ų135.566%0.65672%0.72SS**  trans-71.4135.4168.7-3.324000107.5V336 T340V336-P338 VanDerWaalsContact O-CD 3.22Å; V336-P338 WeakPolarHBondContact O-CD 3.41Å; P338-T340 PolarHBondContact O-N 2.64Å; P338-T340 VanDerWaalsContact O-N 3.16Å
339S44.2Very low47.5Very low122 Ų122140.2 Ų140.285%0.85374%0.739SS**  trans-61.3107.4154.2510000107.8
340T35.7Very low45.6Very low105 Ų105142.9 Ų142.964%0.64475%0.749SS**  trans-132.891.9160.3450000105.5P338P338-T340 PolarHBondContact O-N 2.64Å; P338-T340 VanDerWaalsContact O-N 3.16Å
341D34.3Very low43.8Very low153 Ų153143.9 Ų143.982%0.81875%0.753SS**  154.3121.7104.5-75.5-20.2000109
342D36.9Very low42.1Very low148 Ų148141.6 Ų141.679%0.79175%0.748SS**  trans-70.6150.7163-74-43.3000109.5
343D36.8Very low40.6Very low138 Ų138142.1 Ų142.174%0.73876%0.758SS**  trans64.2104.7152.9-56.4-24.2000119.4
344D33.9Very low39.3Very low162 Ų162144.4 Ų144.487%0.86676%0.763SS**  171.8141.299.7-88.7-28.7000113
345D32.3Very low38.5Very low147 Ų147148 Ų14879%0.78677%0.772SS**  trans104139.1141.8-129.7-0.4000122.4
346E34.2Very low37.8Very low180 Ų180143.5 Ų143.584%0.84177%0.769SS**  trans-68.4155.8-162.4-65.9169.5161.500115.7
347G31Very low37.3Very low72 Ų72149.6 Ų149.674%0.74278%0.78SS**  trans91.7103141.200000117.8
348E34.8Very low37.4Very low169 Ų169154.6 Ų154.679%0.7979%0.794SS**  trans-17168132.2-104.4-164.5173.100109.5E350E348-E350 PolarHBondContact O-N 2.8Å
349E35.4Very low37.7Very low203 Ų203161.4 Ų161.495%0.94981%0.807SS**  trans-91.649.3164.6-157.1177-147.400109.6
350E39.1Very low37.5Very low170 Ų170167.7 Ų167.779%0.79481%0.812SS**  trans-160.274.9174.8-149.8-179.8-165.500112E348E348-E350 PolarHBondContact O-N 2.8Å
351K35Very low37.7Very low165 Ų165167.2 Ų167.272%0.71782%0.818SS**SBendtrans-166.5120150-105.5149.1-159.8166.40112.6
352N36.7Very low38.6Very low115 Ų115165.7 Ų165.762%0.61582%0.817SS**  trans86.554.4153.6-61.9-38.7000117.2R354N352-R354 HydrophobicContact CB-CB 4.05Å; N352-R354 PolarHBondContact O-N 3.06Å
353D39.1Very low38.8Very low162 Ų162170.3 Ų170.387%0.86682%0.823SS**THydrogen-bonded Turn-34.836.1116.5-150.77000116.4
354R41.1Very low39.5Very low213 Ų213172.7 Ų172.780%0.80483%0.827SS**THydrogen-bonded Turntrans-123.1-0.4-174.8-111.1-177.5-177.9-166.41.9115.1N352N352-R354 HydrophobicContact CB-CB 4.05Å; N352-R354 PolarHBondContact O-N 3.06Å
355K39.3Very low40.1Very low210 Ų210177.2 Ų177.291%0.91384%0.843SS**SBendtrans-109.85.1174.6-87.3-177.2176.6175.70115.2
356A40.9Very low40.5Very low90 Ų90178.8 Ų178.874%0.74485%0.846SS**SBendtrans-83.72.3175.500000115
357R42.2Very low40.8Very low236 Ų236178.7 Ų178.789%0.89185%0.846SS**SBendtrans-108.611.4-166.7-111.9-178.9-175-134.72.5118.3
358H43.5Very low41.3Very low186 Ų186184.6 Ų184.686%0.86185%0.852SS**SBendtrans-137.626.9-176.2-118.318.1000119.2
359R44.8Very low41.7Very low244 Ų244185.5 Ų185.592%0.92186%0.856SS**  trans-145.781166.3-73.3-169.4173-170.9-3112.5
360R40.4Very low42.1Very low253 Ų253184.4 Ų184.496%0.95585%0.85SS**  trans-177.1102.2161.1-99.4164.3-167.3-151.24104.8
361A41.1Very low42.3Very low95 Ų95185.4 Ų185.479%0.78585%0.854SS**  159.5-176.178.300000106.4
362P52.3Low42.8Very low121 Ų121186.9 Ų186.979%0.78686%0.863SS**  cis-128.7172.8-1229-6.9000114.5
363R40.7Very low43.3Very low246 Ų246192.4 Ų192.493%0.92888%0.882SS**  trans-90.8134.1169.2-167.7-176.4-169.9-170.62.6109.3
364K51.7Low43.7Very low188 Ų188194.9 Ų194.982%0.81788%0.884SS**  trans-157138.1159.4-70.7-167177.9-1710104.9
365E46.2Very low43.9Very low257 Ų257193.3 Ų193.3100%1.20189%0.891SS**  cis-143.605.3-110.6166.4-169.600107

Retrieved 365 of 365 residues in 134.4 ms (Link to these results)

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